Hall of fame

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Contents

Introduction

There is no obligation to reference/cite Euler if you use it for work that is published in a scientific journal, a conference paper or a thesis. If you did some cool science using the Euler cluster and mention this in your publication (for instance in the acknowledgment section), then please also send an email to cluster support with the reference to your publication, so we can add a citation to this wiki page.

Referencing Euler

If you are using Euler as a guest user, we kindly ask you to acknowledge this in your publications (acknowledgment section). This will help us keep Euler open to all members of ETH, as the cluster's public share is financed by the (limited) budget of Scientific IT Services.

There is no standard sentence how Euler should be cited, but please find below some citations from publications from this list:

  • "The numerical simulations were performed on the Euler cluster operated by the High Performance Computing group at ETH Zürich."
  • "Numerical simulations were performed on the ETH Zürich Euler cluster"
  • "The calculations were run on the Euler cluster of ETH Zürich"
  • "The simulations were performed on the ETH Euler cluster"
  • "All simulations were performed on the ETH-Zürich Euler cluster"
  • "Calculations were carried out on the ETH Euler cluster"

Summary

The summary lists the total number of scientific publications that reference the HPC clusters (Euler, Leonhard, Brutus) or the HPC group since 2008. Publications that are referencing more than one cluster are only counted once.

Articles in scientific journals Conference contributions Theses Total
1190 58 407 1655

Please find below graphs showing the number of journal articles per year for each cluster, the total number of conference papers per year and the number of theses (bachelor, master, phd) per year.

Articles in scientific journals

Euler: Leonhard Open: Brutus:
HPC team (no cluster specified): Total (journal articles):

Conference contributions and theses

Total (conference contributions): Total (theses):

Grand total

Total (journal articles+theses+conference contributions):

Publications in scientific journals, referencing HPC clusters of ETH

Euler cluster (2014-now) sorted by year

2024

  • Achermann, Fl., Stastny, Th., Danciu, B., Kolobov, A., Chung, J.J., Siegwart, R., Lawrance, N., WindSeer: Real-Time Volumetric Wind Prediction Over Complex Terrain Aboard a Small Uncrewed Aerial Vehicle, Nat. Comun., 15, 3507, (2024), https://doi.org/10.1038/s41467-024-47778-4
  • Allen B.J., Hill, D.J., Burke, A.M., Clark, M., Marchant, R., Stringer, L.C., Williams, Lyon, Ch., Projected Future Climatic Forcing on Theglobal Distribution of Vegetation Types, Phil. Trans. R. Soc. B, 379, 20230011, (2024), https://doi.org/10.1098/rstb.2023.0011
  • Allen, B.J., Volkova Oliveira, M.V., Stadler, T., Vaughan, T.G., Warnock, R.C.M., Mechanistic Phylodynamic Models Do Not Provide Conclusive Evidence That Non-avian Dinosaurs Were in Decline Before Their Final Extinction, Cambridge Prisms: Extinction, 1-39, (2024), https://doi.org/10.1017/ext.2024.5
  • Arsenović, P., Rozanov, E., Usoskin, I., Turney, Ch., Sukhodolov, T., McCracken, K., Friedel, M., Anet, J., Simić, St., Maliniemi, V., Egorova, T., Korte, M., Rieder, Cooper, A., Peter, Th., Global Impacts of an Extreme Solar Particle Event Under Different Geomagnetic Field Strengths, PNAS, 121(28), e2321770121, (2024), https://doi.org/10.1073/pnas.2321770121
  • Balázs, A., Gerya, T., Modelling the Contrasting Tectonic and Magmatic Evolution of Rifted and Transform Margins and Subsequent Oceanic Spreading, Tectonophysics, 889, 230446, (2024), https://doi.org/10.1016/j.tecto.2024.230446
  • Berner, P., Refregier, A., Moser, B., Tortorelli, L., Machado Poletti Valle, L.F., Kacprzak, T., Fast Forward Modelling of Galaxy Spatial and Statistical Distributions, JCAP, 04, 023, (2024), https://doi.org/10.1088/1475-7516/2024/04/023
  • Blagojević, N., Bodenmann, L., Reuland, Y., Stojadinović, B., Regional Recovery Modeling and Postdisaster Model Updating: The Case of the 2010 Kraljevo Earthquake in Serbia, J. Struct. Eng.-ASCE, 150(2), 05023006, (2024), https://doi.org/10.1061/JSENDH.STENG-12334
  • Bousquet, E., Lelièvre-Berna, E., Quershi, N., Soh, J.-R., Spaldin, N.A., Urru, A., Verbeek, X.H., Weber, S.F., On the Sign of the Linear Magnetoelectric Coefficient in Cr2O3, J. Phys. - Condens. Mat., 36(15), 155701, (2024), https://doi.org/10.1088/1361-648X/ad1a59
  • Bräunlich, G., Saxena, Sh., Weberndorfer, M., Spinola, M., Gupta, Pr., Kochmann, D.M., AQCNES: A Quasi-Continuum Non-Equilibrium Solver, J. Open Source Softw., 9(101), 7068, (2024), https://doi.org/10.21105/joss.07068
  • Bröchin, M., Pickering, B., Tröndle, T., Pfenniger, St., Harder, Better, Faster, Stronger: Understanding and Improving the Tractability of Large Energy System Models, Energ. Sustain. Soc., 14, 27, (2024), https://doi.org/10.1186/s13705-024-00458-z
  • Brododowsky, Ch.V., Sukhodolov, T., Chiodo, G., Aquila, V., Bekki, S., Dhomse, S.S., Höpfner, M., Laakso, A., Mann, G.W., Niemeier, U., Pitari, G., Quaglia, I., Rozanov, E., Schmidt, A., Sekiya, T., Tilmes, S., Timmreck, C., Vattioni, S., Visioni, D., Yu, P., Zu, Y., Peter, Th., Analysis of the Global Atmospheric Background Sulfur Budget in a Multi-Model Framework, Atmos. Chem. Phys., 24(9), (2024), 5513-5548, https://doi.org/10.5194/acp-24-5513-2024
  • Burmann, F., Kira, L., Noir, J., Precessing Non-Axisymmetric Ellipsoids: Bi-Stability and Fluid Instabilities, J. Fluid. Mech., 997, A52, (2024), https://doi.org/10.1017/jfm.2024.774
  • Campese, L., Russo, L., Abagnale, M., Alberti, A., Bachi, G., Balestra, C., Bellardini, D., Buondonno, A., Cardini, U., Carotenuto, Y., Checcucci, G., Chiusano, M.L., D'Ambra, I., d'Ippolito, G., Di Capua, I., Donnarumma, V., Fontana, A., Furia, M., Galarza-Verkovitch, D., Gallia, R., Labadie, K., Leone, S., Licandro, Pr., Longo, A., Maselli, M., Merquiol, L., Murano, C., Oliveira, P.H., Passarelli, A., Percopo, I., Perdereau, A., Piredda, R., Raffini, Fr., Roncalli, V., Ruscheweyh, H.-J., Russo, E., Saggiomo, M., Santinelli, Ch., Sarno, D., Sunagawa, Sh., Tramontano, F., Trano, A.C., Uttieri, M., Wincker, P., Zampicinini, G., Casotti, R., Conversano, F., D'Alelio, D., Iudicone, D., Margiotta, Fr., Montresor, M., The NEREA Augmented Observatory: an integrative approach to marine coastal ecology, Sci. Data, 11, 989, (2024), https://doi.org/10.1038/s41597-024-03787-y
  • Cavadini, G.B., Rodriguez, M., Nguyen, Tr., Cook, L.M., Can Blue–Green Infrastructure Counteract the Effects of Climate Change on Combined Sewer Overflows? Study of a Swiss Catchment, Environ. Res. Lett., 19, 094025, (2024), https://doi.org/10.1088/1748-9326/ad6462
  • Cavallaro, A., Gabrielli, M., Hammes, F., Rhoads, W.J., The Impact of DNA Extraction on the Quantification of Legionella, with Implications for Ecological Studies, Microbiol. Spectr., 12(8), e00713-24, (2024), https://doi.org/10.1128/spectrum.00713-24
  • Ciotti, F., John, R., Katic Secerovic,N., Gozzi, N., Cimolato, A., Jayaprakash, N., Song, W., Toth, V., Zanos, St., Raspopovic, St., Towards Enhanced Functionality of Vagus Neuroprostheses Through in Silico Optimized Stimulation, Nat. Commun., 15, 6119, (2024), https://doi.org/10.1038/s41467-024-50523-6
  • Clementucci, R., Lanari, R., Faccenna, C., Crosetto, S., Reitano, R., Zoppis, G., Ballato, P., Morpho-Tectonic Evolution of the Southern Apennines and Calabrian Arc: Insights From Pollino Range and Surrounding Extensional Intermontane Basins, Tectonics, 43, e2023TC008002, (2024), https://doi.org/10.1029/2023TC008002
  • Delavaux, C.S., Ramos, R.J., Stürmer, S.L., Bever, J.D., An Updated LSU Database and Pipeline for Environmental DNA Identification of Arbuscular Mycorrhizal Fungi, Mycorrhiza, (2024), https://doi.org/10.1007/s00572-024-01159-3
  • Desiderio, M., Ballmer, M.D., Ancient Stratified Thermochemical Piles Due To High Intrinsic Viscosity, Geophys. Res. Lett., 51(14), e2024GL110006, (2024), https://doi.org/10.1029/2024GL110006
  • Dmitrijeva, M., Ruscheweyh,H.-J., Feer, L., Li, K., Miravet-Verde, S., Sintsova, A., Mende, D.R., Zeller, G., Sunagawa, Sh., The mOTUs Online Database Provides Web-Accessible Genomic Context to Taxonomic Profiling of Microbial Communities, Nucleic Acids Res., gkae1004, (2024), 1-9, https://doi.org/10.1093/nar/gkae1004
  • Dinnebier, R.E., Seidel, K., Terban, M.W., Yakimov, A.V., Müller, Ph., Wieczorek, Th., Elam, D.A., Fees, J., Kratzer, B., Speitling, M., Jacques, S.D.M., Price, St.W.P., Hoffmann, W., Blum, C., Meyer, L., Liebel, M., Müller, I.B., Copéret, Ch., Viertelhaus, M., Structure of Metiram, a Crystalline Zinc Coordination Complex with Amorphous Side Phase, Cryst. Growth Des., 24, (2024), 8185-8202, https://doi.org/10.1021/acs.cgd.4c00465
  • Dome, T., Volosniev, A.G., Ghazaryan, A. ,Safari, L., Schmidt, R., Lemeshko, M., Linear Rotor in an Ideal Bose Gas Near the Threshold for Binding, Phys. Rev. B, 109, 014102, (2024), https://doi.org/10.1103/PhysRevB.109.014102
  • Esteban-Hofer, L., Emmanouilidis, L., Yulikov, M., Allain, F.H.-T., Jeschke, G., Ensemble Structure of the N-Terminal Domain (1–267) of FUS in a Biomolecular Condensate, Biophys. J., 123(5), (2024), 538-554, https://doi.org/10.1016/j.bpj.2024.01.023
  • Fang, Zh., Gupta, A., Kumar, S., Khammash, M., Advanced Methods for Gene Network Identification and Noise Decomposition From Single-Cell Data, Nat. Commun., 15, 4911, (2024), https://doi.org/10.1038/s41467-024-49177-1
  • Fang, W., Zhu, Y.-Ch., Cheng, Y., Hao, Y.-P., Richardson, J.O., Robust Gaussian Process Regression Method for Efficient Tunneling Pathway Optimization: Application to Surface Processes, J. Chem. Theory Comput., 20(9), (2024), 3766-3778, https://doi.org/10.1021/acs.jctc.4c00158
  • Fiechter, M.R., Svoboda, V., Wörner, H.J., Theoretical Study of Time-Resolved Photoelectron Circular Dichroism in the Photodissociation of a Chiral Molecule, Struct Dyn., 10(6), 064103, (2024), https://doi.org/10.1063/4.0000213
  • Fogarty, E.C., Schechter, M.S., Lolans, K., Sheahan, M., Veseli, J., Moore, R.M., Kiefl, E., Moody, Th., Rice, Ph.A., Yu, M.K., Mimee, M., Chang, E.B., Ruscheweyh, H.-J., Sunagawa, Sh., McLellan, Willis, A.D., Comstock, L.E., Eren, A.M., A Cryptic Plasmid Is Among the Most Numerous Genetic Elements in the Human Gut, Cell, 187, (2024), 1206-1222, https://doi.org/10.1016/j.cell.2024.01.039
  • Gassler, L., Afrasiabi, M., Bambach, M., Efficient Process Simulation of Metallic Bipolar Plate Stamping Using a Gpu-Accelerated One-Step Solver, J. Manuf. Process., 131, (2024), 2391-2504, https://doi.org/10.1016/j.jmapro.2024.09.118
  • Graziotto, L., Macheda, Fr., Venanzi, Marchese, G., Sitgiu, S., Ouaj, T., Stellino, E., Fasolato, Cl., Postorino, P., Metzelaars, M., Kögerler, P., Beschoten, B., Calandra, Ortolani, M., Stampfer, Ch., Mauri, Fr., Baldassarre, L., Infrared Resonance Raman of Bilayer Graphene: Signatures of Massive Fermions and Band Structure on the 2D Peak, Nano Lett., 24(6), 1867-1873, (2024), https://doi.org/10.1021/acs.nanolett.3c03502
  • Haake, F., Sendra, J., Calvo, M., Galinski, H., Spolenak, R., Strain Mapping in Amorphous Germanium Thin Films With Scanning Reflectance Anisotropy Microscopy, Appl, Phys. Lett., 125, 041602, (2024), https://doi.org/10.1063/5.0218645
  • Heinzmann, J., Carrara, P., Luo, Ch., Manav, M., Mishra, A., Nagaraja, S., Oudich, H., Vicentini Fr., De Lorenzis, L., Calibration and Validation of a Phase-Field Model of Brittle Fracture Within the Damage Mechanics Challenge, Eng. Fract. Mech., 307, 110319, (2024), https://doi.org/10.1016/j.engfracmech.2024.110319
  • Houba, N., Strub, St.H., Ferraioli, L., Giardini, D., Detection and Prediction of Future Massive Black Hole Mergers With Machine Learning and Truncated Waveforms, Phys. Rev. D, 110, 062003, (2024), https://doi.org/10.1103/PhysRevD.110.062003
  • Janusz, P., Bergamo, P., Bonilla, L.F., Panzera, Fr., Roten, D., Loviknes, K., Fäh, D., Multistep Procedure for Estimating Non-linear Soil Response in Low Seismicity Areas—a Case Study of Lucerne, Switzerland, Geophys. J. Int., 239(2), (2024), 1133-1154, https://doi.org/10.1093/gji/ggae324
  • Jiang, Y., Zhao, Y., Carmeliet, J., Nie, B., Xu, F., Critical Transitions on a Route to Chaos of Natural Convection on a Heated Horizontal Circular Surface, J. Fluid. Mech., 988, A38, (2024), https://doi.org/10.1017/jfm.2024.453
  • Käber, Y., Hartig, F., Bugmann, H., Inferring the Tree Regeneration Niche From Inventory Data Using a Dynamic Forest Model, Geosci. Model Dev., 17(7), (2024), 2727-2753, https://doi.org/10.5194/gmd-17-2727-2024
  • Kakiuchi, Y., Copéret, Ch., Electronic Structures of Late versus Early Transition Metal Imido Complexes from 15N NMR Signatures, Helv. Chim. Acta, 107(11), e202400142, (2024), https://doi.org/10.1002/hlca.202400142
  • Kakiuchi, Y., Docherty, S.R., Berkson, Z.J., Yakimov, A.V., Wörle, M., Copéret, Ch., Aghazada, S., Origin of Reactivity Trends of an Elusive Metathesis Intermediate from NMR Chemical Shift Analysis of Surrogate Analogues, J. Am. Chem. Soc., 146(29), (2024), 20168-20182, https://doi.org/10.1021/jacs.4c05193
  • Kakiuchi, Y., Karmakar, P.S., Roudin, J., Tonks, I.A., Copéret, Ch., Bonding and Reactivity of d0 Transition Metal Imido Complexes Encoded in Their 15N NMR Signatures, J. Am. Chem. Soc., 146, (2024), 9860-9870, https://doi.org/10.1021/jacs.3c14723
  • Kanellopoulos, C. Jeremic, B., Anastasopoulos, I., Stojadinovic, B., Resonant Metamaterials for high-frequency vibration mitigation in Nuclear Power Plants, J. Phys.: Conf. Ser., 2647, 082015, (2024), https://doi.org/10.1088/1742-6596/2647/8/082015
  • Kanellopoulos, C., Rangelow, P., Jeremic, B., Anastasopoulos, I., Stojadinovic, B., Dynamic Structure-Soil-Structure Interaction for Nuclear Power Plants, Soil Dyn. Earthq. Eng., 181, 108631, (2024), https://doi.org/10.1016/j.soildyn.2024.108631
  • Khanppnavar, B., Schuster, D., Lavriha, P., Uliana, F., Özel, M., Metha, V., Leitner, A., Picotti, P., Korkhov, V.M., Regulatory Sites of Cam-Sensitive Adenylyl Cyclase AC8 Revealed by Cryo-Em and Structural Proteomics, EMBO Rep., 25, (2024), 1513-1540, https://doi.org/10.1038/s44319-024-00076-y
  • Kocur, G.K., Markert, B., Time Reverse Modeling of Acoustic Waves for Enhanced Mapping of Cracking Sound Events in Textile Reinforced Concrete, J. Nondestruct. Eval., 43, 100, (2024). https://doi.org/10.1007/s10921-024-01110-8
  • Köhn, E.E., Vogt, M., Münnich, M., Gruber, N., On the Vertical Structure and Propagation of Marine Heatwaves in the Eastern Pacific, J. Geophys. Res. Oceans, 129(1), e2023JC020063, (2024), https://doi.org/10.1029/2023JC020063
  • Lee, J., Duperrex, E., El-Battrawy,I., Hohn, A., Saguner, A.M., Duru, F., Emmenegger, V., Cyganek, L., Hierlemann, A., Ulusan, H., CardioMEA: Comprehensive Data Analysis Platform for Studying Cardiac Diseases and Drug Responses, Front. Physiol., 15, 1472126, (2024), https://doi.org/10.3389/fphys.2024.1472126
  • Lehner, M.T., Katzberger, P., Maeder, N., Landrum, G.A., Riniker, S.Z., DASH Properties: Estimating Atomic and Molecular Properties From a Dynamic Attention-Based Substructure Hierarchy, J. Chem. Phys., 161, 074103, (2024), https://doi.org/10.1063/5.0218154
  • Lerbinger, A., Powell, S., Mavromatidis, G., MANGOever: An Optimization Framework for the Long-Term Planning and Operations of Integrated Electric Vehicle and Building Energy Systems, Adv. Appl. Energ., 16, 100193, (2024), https://doi.org/10.1016/j.adapen.2024.100193
  • Maffei, St., Jackson, A., Livermore, Ph.W., Plesio-Geostrophy for Earth’s Core – II: Thermal Equations and Onset of Convection, Geophys. J. Int., 239(1), 2024, 725-753, https://doi.org/10.1093/gji/ggae294
  • Maffei, St., Jackson, A., Livermore, Ph.W., Characterization of Columnar Inertial Modes in Rapidly Rotating Spheres and Spheroids, Proc. R. Soc. A, 473, 20170181, (2024), https://doi.org/10.1098/rspa.2017.0181
  • Marti, L., Pagonakis,I.Gr., Sieben, L., Millen, M., Genoud, J., Hogge, J.-Ph., Barnes, A.B., Electron Optics Simulation in the Overall Gyrotron Geometry, Phys. Plasmas, 31, 103102, (2024), https://doi.org/10.1063/5.0228801
  • Meier, M., Bugmann, H., Bigler, Ch., Process-Oriented Models of Leaf Senescence Are Biased Towards the Mean: Impacts on Model Performance and Future Projections, Glob. Change Biol., 30, e17099, (2024), https://doi.org/10.1111/gcb.17099
  • Mishra, A., Carrara, P., Marfia, S., Sacco, E., De Lorenzis, L., Enhanced Transformation Field Analysis for Reduced-Order Modeling of Problems With Cohesive Interfaces, Comput. Method. Appl. M., 421, 116755, (2024), https://doi.org/10.1016/j.cma.2024.116755
  • Mishra, A., Carrara, P., Marfia, S., Sacco, E., De Lorenzis, L., Multiscale Enhanced Non-Uniform Transformation Field Analysis, Int. J. Numer. Meth. Eng., 125(16), e7501, (2024), https://doi.org/10.1002/nme.7501
  • Mizrahi, L., Jozinović, D., Modeling the Asymptotic Behavior of Higher Order Aftershocks with Deep Learning, Seismol. Res. Lett., 95(6), (2024), 3295-3305, https://doi.org/10.1785/0220240028
  • Molignini, P., Chakrabarti, B., Unbounded Entropy Production and Violent Fragmentation for Repulsive-To-Attractive Interaction Quench in Long-Range Interacting Systems, New J. Phys., 26, 103030, (2024), https://doi.org/10.1088/1367-2630/ad80b8
  • Moser, B., Kacprzak, T., Fischbarcher, S., Refregier, A., Grimm, D., Tortorelli, L., Simulation-Based Inference of Deep Fields: Galaxy Population Model and Redshift Distributions, JCAP, 05, 049, (2024), https://doi.org/10.1088/1475-7516/2024/05/049
  • Nippa, D.F., Atz, K., Hohler, R., Müller, A.T., Marx, A., Bartelmus, Ch., Wuitschik, G., Marzuoli, I., Jost, V., Wolfard, J., Binder, M., Stepan, A.F., Konrad, D.B., Grether, U., Martin, R.E., Schneider, G., Enabling Late-Stage Drug Diversification by High-Throughput Experimentation With Geometric Deep Learning, Nat. Chem., 16, (2024), 239-248, https://doi.org/10.1038/s41557-023-01360-5
  • Norris, G.J., Michaud, L., Pahl, D. Kerschbaum, M., Eichler, Ch., Besse, J.-C., Wallraff, A., Improved Parameter Targeting in 3D-Integrated Superconducting Circuits Through a Polymer Spacer Process, EPJ Quantum Technol., 11, 5, (2024), https://doi.org/10.1140/epjqt/s40507-023-00213-x
  • Oberholzer, S., Herrmann, Ch., Bodenhausen, N., Krause, H.-M., Mestrot, A., Speranza, Ch.I., Jraosch, K.A., No Effect on Biological or Chemical Soil Properties When Amended With Effective Microorganisms for Improved Cover Crop Decomposition, Appl. Soil Ecol., 197, 105358, (2024), https://doi.org/10.1016/j.apsoil.2024.105358
  • Oberle, D., Pruett, C.D., Jenny, P., Advancing the Temporal Direct Deconvolution Method With Spatial Regularization, Phys. Fluids, 36, 015150, (2024), https://doi.org/10.1063/5.0180666
  • Oravecz, É., Balázs, A., Gerya, T., May, D.A., Fodor, L., Competing Effects of Crustal Shortening, Thermal Inheritance, and Surface Processes Explain Subsidence Anomalies in Inverted Rift Basins, Geology, 52(6), (2024), 447-452, https://doi.org/10.1130/G51971.1
  • Palm, M.L., Ding, Ch., Huxter, W.S., Taniguchi, T., Watanabe, K., Degen, Ch.L., Observation of Current Whirlpools in Graphene at Room Temperature, Science, 384(6694), (2024), 465-469, https://doi.org/10.1126/science.adj2167
  • Paudel, J.R., Mansouri Tehrani, A., Terilli, M., Kareev, M., Grassi, J., Sah, R.K., Wu, L., Strocov, V.N., Klewe, Ch., Shafer, P., Chakhalian, J., Spaldin, N.A., Depth-Resolved Profile of the Interfacial Ferromagnetism in CaMnO3/CaRuO3 Superlattices, Nano Lett., 24(48), (2024), 15195-15201, https://doi.org/10.1021/acs.nanolett.4c02087
  • Powell, S., Martin, S., Rajagopal, R., Azevedo, I.M.L., de Chalendar, J., Future-Proof Rates for Controlled Electric Vehicle Charging: Comparing Multi-Year Impacts of Different Emission Factor Signals, Energ. Policy, 190, 114131, (2024), https://doi.org/10.1016/j.enpol.2024.114131
  • Proske, Ulrike, Ferrachat, S., Lohmann, U., Developing a Climatological Simplification of Aerosols to Enter the Cloud Microphysics of a Global Climate Model, Atmos. Chem. Phys., 24(10), (2024), 5907-5933, https://doi.org/10.5194/acp-24-5907-2024
  • Pylypovskyi, O.V., Weber, S.F., Makushko, P., Veremchuk, I., Spaldin, N.A., Makarov, D., Surface-Symmetry-Driven Dzyaloshinskii-Moriya Interaction and Canted Ferrimagnetism in Collinear Magnetoelectric Antiferromagnet Cr2O3, Phys. Rev. Lett., 132, 226702, (2024), https://doi.org/10.1103/PhysRevLett.132.226702
  • Rajarajan, A., Decaestrecker, E., Bulteel, L., Walswer, J.-C., Spaak, P., Wolinska, J., Host Genotype and Infection Status Interact to Shape Microbiomes in Daphnia Magna, Parasitology, (2024), https://doi.org/10.1017/S0031182024000787
  • Reeves, A., Nicola, A., Refregier, A., Kacprzak, Machado Poletti Valle, L.F., 12 × 2 Pt Combined Probes: Pipeline, Neutrino Mass, and Data Compression, J. Cosmol. Astropart. P., 2024, 042, (2024), https://doi.org/10.1088/1475-7516/2024/01/042
  • Ritter, S., Balázs, A., Ribeiro, J., Gerya, T., Magmatic Fingerprints of Subduction Initiation and Mature Subduction: Numerical Modelling and Observations From the Izu-Bonin-Mariana System, Front. Earth Sci., 12, 1286468, (2024), https://doi.org/10.3389/feart.2024.1286468
  • Rodriguez, M., Cavadini, G.B., Cook, L.M., Do Baseline Assumptions Alter the Efficacy of Green Stormwater Infrastructure to Reduce Combined Sewer Overflows?, Water Res., 253, 121284, (2024), https://doi.org/10.1016/j.watres.2024.121284
  • Rogger, J., Judd, E.J., Mills, B.J.W., Goddéris, Y., Gerya, T.V., Pellissier, L., Biogeographic Climate Sensitivity Controls Earth System Response to Large Igneous Province Carbon Degassing, Science, 385(6709), 661-666, (2024), https://doi.org/10.1126/science.adn3450
  • Scheel, P., Hosseini, E., Pulse Approach: A Physics-Guided Machine Learning Model for Thermal Analysis in Laser-Based Powder Bed Fusion of Metals, Prog. Addit. Manuf., (2024), https://doi.org/10.1007/s40964-024-00744-4
  • Schemm, S., Röthlisberger, M., Aquaplanet Simulations With Winter and Summer Hemispheres: Model Setup and Circulation Response to Warming, Weather Clim. Dynam., 5(1), (2024), 43-63, https://doi.org/10.5194/wcd-5-43-2024
  • Seidel, S., Stadler, T., Vaughan, T.G., Estimating Pathogen Spread Using Structured Coalescent and Birth–Death Models: A Quantitative Comparison, Epidemics, 49, 100795, (2024), https://doi.org/10.1016/j.epidem.2024.100795
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2022

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  • Kraus, M.A., Bischof, R., Kaufmann, W., Thoma, K., Artificial Intelligence - Finite Element Method - Hybrids for Efficient Nonlinear Analysis Ofconcrete Structures, Acta Polytech. CTU Proc., 36(99), 108, (2022), https://doi.org/10.14311/APP.2022.36.0099
  • Krauss, K., Krail, M., Axhausen, K.W., What Drives the Utility of Shared Transport Services for Urban Travellers? A Stated Preference Survey in German Cities, Travel, behaviour & society, 26, (2022), 206-220, https://doi.org/10.1016/j.tbs.2021.09.010
  • Kummer, Th., Rossi, S., Vandenberghe, S., Demertzis, S., Jenny, P., Embedded Computational Heart Model for External Ventricular Assist Device Investigations, Cardiovasc. Eng. Tech., 2022, https://doi.org/10.1007/s13239-022-00610-w
  • Lefebure, N., Khosravi, M., Badyn, M.H., Bünning, F., Lygeros, J., Jones, C., Smith, R.S., Distributed Model Predictive Control of Buildings and Energy Hubs, Energ. Buildings, 259, 111806, (2022), https://doi.org/10.1016/j.enbuild.2021.111806
  • Li, T.-R., Huck, F., Piccini, G., Tiefenbacher, K., Mimicry of the Proton Wire Mechanism of Enzymes Inside a Supramolecular Capsule Enables β-Selective O-Glycosylations, Nat. Chem., 2022, (2022), https://doi.org/10.1038/s41557-022-00981-6
  • Li, M., Jain, Sh., Haller, G., Nonlinear Analysis of Forced Mechanical Systemswith Internal Resonance Using Spectral Submanifolds, Part I: Periodic Response and Forced Response Curve, Nonlinear Dynam., (2022), https://doi.org/10.1007/s11071-022-07714-x
  • Liu, M., Gerya, T., Rozel, A.B., Self-Organization of Magma Supply Controls Crustal Thickness Variation and Tectonic Pattern Along Melt-Poor Mid-Ocean Ridges, Earth Planet. Sci. Lett., 584, 117482, (2022), https://doi.org/10.1016/j.epsl.2022.117482
  • Lori, M., Armengot, L., Schneider, M., Schneidewind, U., Bodenhausen, N., Mäder, P., Krause, H.-M., Organic Management Enhances Soil Quality and Drives Microbial Community Diversity in Cocoa Production Systems, Sci. Total Environ., 834, 155223, (2022), https://doi.org/10.1016/j.scitotenv.2022.155223
  • Lovecchio, E., Gruber, N., Münnich, M., Frenger, I., On the Processes Sustaining Biological Production in the Offshore Propagating Eddies of the Northern Canary Upwelling System, J. Geophys. Res. Oceans, 127, e2021JC017691, (2022), https://doi.org/10.1029/2021JC017691
  • Mittelviefhaus, M., Georges, G., Boulouchos, K., Electrification of Multi-Energy Hubs Under Limited Electricity Supply: De-/Centralized Investment and Operation for Cost-Effective Greenhouse Gas Mitigation, Adv. Appl. Energ., 5, 100083, (2022), https://doi.org/10.1016/j.adapen.2022.100083
  • Mlkvik, P., Ederer, Cl., Spaldin, N.A., Influence of Germanium Substitution on the Structural and Electronic Stability of the Competing Vanadium Dioxide Phases, Phys. Rev. Research, 4, 043129, (2022), https://doi.org/10.1103/PhysRevResearch.4.043129
  • Moser, B., Lorenz, C.S., Schmitt, U., Réfrégier, A., Fluri, J., Sgier, R., Tarsitano, F., Heisenberg, L., Symbolic Implementation of Extensions of the PyCosmo Boltzmann Solver, Astron. Comput., 40, 100603, (2022), https://doi.org/10.1016/j.ascom.2022.100603
  • Müller, A., Comas-Vives, A., Copéret, Ch., Ga and Zn Increase the Oxygen Affinity of Cu-Based Catalysts for the COx Hydrogenation According to Ab Initio Atomistic Thermodynamics, Chem. Sci., 13, (2022), 13442-13485, https://doi.org/10.1039/D2SC03107H
  • Munch, J., Ueada, K., Schnydrig, St., May, D.A., Gerya, T., Contrasting Influence of Sediments vs Surface Processes on Retreating Subduction Zones Dynamics, Tectonophysics, 836, 229410, https://doi.org/10.1016/j.tecto.2022.229410
  • Nagy, P., Kaszás, B., Csabai, I., Hegedűs, Z., Michler, J., Pethö, L., Gubicza, J., Machine Learning-Based Characterization of the Nanostructure in a Combinatorial Co-Cr-Fe-Ni Compositionally Complex Alloy Film, Nanomaterials, 12(24), 4407, (2022), https://doi.org/10.3390/nano12244407
  • Narayanan, H., Cruz Bournazou, M.N., Gosálbez, G.G., Butté, A., Functional-Hybrid Modeling through Automated Adaptive Symbolic Regression for Interpretable Mathematical Expressions, Chem. Eng. J., 430, 133032, (2022), https://doi.org/10.1016/j.cej.2021.133032
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  • Noble, R., Burri, D., Le Sueur, C., Lemant, J., Viossat, Y., Kather, J.N., Beerenwinkel, N., Spatial Structure Governs the Mode of Tumour Evolution, Nat. Ecol. Evol., 6, (2022), 207-217, https://doi.org/10.1038/s41559-021-01615-9
    (article does not explicitly mention the Euler cluster but the author R. Noble informed us that the cluster was used for this work)
  • Ocana-Pujol, J.L., Forster, L., Spolanek, R., Galinski, H., Strain-Driven Thermal and Optical Instability in Silver/Amorphous-Silicon Hyperbolic Metamaterials, Adv. Opt. Mater., 10(24), 2201749, (2022), https://doi.org/10.1002/adom.202201749
  • Petkov, I., Mavromatidis, G., Knoeri, Ch., Allan, J., Hoffmann, V.H., Mangoret: An Optimization Framework for the Long-Term Investment Planning of Building Multi-Energy System and Envelope Retrofits, Appl. Energ., 314, 118901, (2022), https://doi.org/10.1016/j.apenergy.2022.118901
  • Pickering, B., Lombardi, F., Pfenninger, S., Diversity of Options To Eliminate Fossil Fuels and Reach Carbon Neutrality Across the Entire European Energy System, Joule, 6(6), (2022), 1253-1276, https://doi.org/10.1016/j.joule.2022.05.009
  • Portmann, R., Beyerle, U., Davin, E., Fischer, E.M., De Hertog, St., Schemm, S., Global Forestation and Deforestation Affect Remote Climate via Adjusted Atmosphere and Ocean Circulation, Nat. Commun., 13, 5569, (2022), https://doi.org/10.1038/s41467-022-33279-9
  • Rajarajan, A., Wolinska, J., Walser, J.-C., Mäder, M., Spaak, P., Infection by a Eukaryotic Gut Parasite in Wild Daphnia SP. Associates With a Distinct Bacterial Community, FEMS Microbiol. Ecol., 98(10),fiac097 , (2022), https://doi.org/10.1093/femsec/fiac097
  • Rieder, S.R., Ries, B., Kubincová, A., Champion, C., Barros, E.P., Hünenberger, Ph.H., Riniker, S.Z., Leveraging the Sampling Efficiency of Re-Eds in Openmm Using a Shifted Reaction-Field With an Atom-Based Cutoff, J. Chem. Phys., 157, 104117, (2022), https://doi.org/10.1063/5.0107935
  • Ries, B., Normak, K., Weiss, R.G., Rieder, S., Barros, E.P., Champion, C., König, G., Riniker, S., Relative Free-Energy Calculations for Scaffold Hopping-Type Transformations with an Automated RE-EDS Sampling Procedure, J. Comput. Aided Mol. Des., 36, (2022), 117-130, https://doi.org/10.1007/s10822-021-00436-z
    (article does not explicitly mention the Euler cluster but the author B. Ries informed us that the cluster was used for this work)
  • Ries, B., Rieder, S., Rhiner, C., Hünenberger, Ph.H., Riniker, S., RestraintMaker: A Graph-Based Approach to Select Distance Restraints in Free-Energy Calculations with Dual Topology,J. Comput. Aided Mol. Des., (2022), https://doi.org/10.1007/s10822-022-00445-6
    (article does not explicitly mention the Euler cluster but the author B. Ries informed us that the cluster was used for this work)
  • Rosa-Medina, R., Ferri, F., Finger, F., Dogra, N., Kroeger, K., Lin, R., Chitra, R., Donner, T., Esslinger, T., Observing Dynamical Currents in a Non-Hermitian Momentum Lattice, Phys. Rev. Lett., 128, 143602, (2022), https://doi.org/10.1103/PhysRevLett.128.143602
  • Ruscheweyh, H.J., Milanese, A., Paoli, L., Karcher, N., Clayssen, Q., Keller, M.I., Wirbel, J., Bork, P., Mende, D.R., Zeller, G., Sunagawa, Sh., Cultivation-Independent Genomes Greatly Expand Taxonomic-Profiling Capabilities of mOTUS Across Various Environments, Microbiome, 10, 212, (2022), https://doi.org/10.1186/s40168-022-01410-z
  • Sabia, C., Buffo, A., Casalini, T., Marchisio, D.L., Barbato, M.C., Storti, G., FBR for Polyolefin Production in Gas Phase: Validation of a Two-Phase Compartmentalized Model by Comparison with CFD, Macromol. React. Eng., 2022, 2100058, (2022), https://doi.org/10.1002/mren.202100058
  • Sayed, M.A., Dehbi, A., Niceno, B., Mikityuk, K., Particle Subgrid Scale Modeling in Hybrid RANS/LES of Turbulent Channel Flow at Low to Moderate Reynolds Number, Powder Technol., 397, 117013, (2022), https://doi.org/10.1016/j.powtec.2021.11.057
  • Schemm, S., Papritz, L., Rivière, G., Storm Track Response to Uniform Global Warming Downstream of an Idealized Sea Surface Temperature Front, Weather Clim. Dynam., 3, (2022), 601-623, https://doi.org/10.5194/wcd-3-601-2022
  • Schmid, B., Becker, F., Molloy, J., Axhausen, K., Lüdering, J., Hagen, J., Blome, A., Modeling Train Route Decisions During Track Works, J. Rail Transp. Plan. Manag., 22, 100320, (2022), https://doi.org/10.1016/j.jrtpm.2022.100320
  • Scire, J., Barido-Sottani, J., Kühnert, D., Vaughan, T.G., Stadler, T., Robust Phylodynamic Analysis of Genetic Sequencing Data from Structured Populations, viruses, 14(8), 1648, (2022), https://doi.org/10.3390/v14081648
  • Stadelmann, Th., Balmer, Ch., Riniker, S., Ebert, M.-O., Impact of Solvent Interactions on 1H and 13C Chemical Shifts Investigated Using DFT and a Reference Dataset Recorded in CDCl3 and CCl4, Phys. Chem. Chem. Phys., 24, (2022), 23551-23560, https://doi.org/10.1039/D2CP03205H
  • Szulágyi, J., Binkert, F., Surville, C., Meridional Circulation of Dust and Gas in the Circumstellar Disk: Delivery of Solids onto the Circumplanetary Region, ApJ, 924, 1, (2022), https://doi.org/10.3847/1538-4357/ac32d1
  • Tagliavini, G., Khan, M.H., McCorquodale, M., Westbrook, Ch., Holzner, M., Wake Characteristics of Complex-Shaped Snow Particles: Comparison of Numerical Simulations With Fixed Snowflakes to Time-Resolved Particle Tracking Velocimetry Experiments With Free-Falling Analogs, Phys. Fluids, 34, 055112, (2022), https://doi.org/10.1063/5.0089759
  • Thürlemann, M., Böselt, L., Riniker, S., Learning Atomic Multipoles: Prediction of the Electrostatic Potential with Equivariant Graph Neural Networks, J. Chem. Theory Comput., 18(3), (2022), 1701-1710, https://doi.org/10.1021/acs.jctc.1c01021
  • Turano, M., Walker, M., Grillo, F., Gattinoni, Ch., Hunt, G., Kirkman, P., Richardson, N.V., Baddeley, Ch.J., Costantini, G., Adsorption of the Prototypical Organic Corrosion Inhibitor Benzotriazole on the Cu(100) Surface, Corros. Sci., 207, 110589, (2022), https://doi.org/10.1016/j.corsci.2022.110589
  • van Zelst, I., Rannabauer, L., Gabriel, A.-A., van Dinther, Y., Earthquake Rupture on Multiple Splay Faults and Its Effect on Tsunamis, J. Geophys. Res. Sol. Ea., 127, e2022JB024300, (2022), https://doi.org/10.1029/2022JB024300
  • Wagner, M.A., Schwarz, F., Huber, N., Geistlich, L., Galinski, H., Spolanek, R., Deformation-Induced Topological Transitions in Mechanical Metamaterials and Their Application to Tunable Non-linear Stiffening, Mater. Design, 221, 110918, (2022), https://doi.org/10.1016/j.matdes.2022.110918
  • Wong, K.W., Bures, L., Mikityuk, K., Interface Tracking Investigation of the Sliding Bubbles Effects on Heat Transfer in the Laminar Regime, Nucl. Technol., 208, 1266-1278, (2022), https://doi.org/10.1080/00295450.2021.1971025
  • Wüthrich, C., de Figueiredo, M., Burton-Pimentel, K.J., Vergères, G., Wahl, F., Zenobi, R., Giannoukos, St., Breath Response Following a Nutritional Challenge Monitored by Secondary Electrospray Ionization High-Resolution Mass Spectrometry, J. Breath Res., 16(4), 046007, https://doi.org/10.1088/1752-7163/ac894e
  • Yang, M., Bonati, L., Polino, D., Parrinello, M., Using Metadynamics to Build Neural Network Potentials for Reactive Events: The Case of Urea Decomposition in Water, Catal. Today,387, (2022), 143-149, https://doi.org/10.1016/j.cattod.2021.03.018
  • Yakimov, A.V., Ravi, M., Verel, R., Sushkevich, V.L., van Bokhoven, J.A., Copéret, Ch., Structure and Framework Association of Lewis Acid Sites in MOR Zeolite, J. Am. Chem. Soc., 144, (2022), 10377-10385, https://doi.org/10.1021/jacs.2c02212

2021

  • Andrienko, G., Andrienko, N., Boldrini, Ch., Caldarelli, G., Cintia, P., Cresci, S., FAcchini, A., Giannotti, F., Gionis, A., Guidotti, R., Mathioudakis, M., Muntean, C.I., Pappalardo, L., Pendreschi, D., Purnaras, E., Pratesi, F., Tesconi, M., Trasarti, R., (So) Big Data and the Transformation of the City, Int. J. Data Sc. Anal., 11, (2021), 311-340, https://doi.org/10.1007/s41060-020-00207-3
  • Balázs, A., Faccenna, C., Ueda, K., Funiciello, F., Boutoux, A., Blanc, E. J.-P., Gerya, T., Oblique Subduction and Mantle Flow Control on Upper Plate Deformation: 3D Geodynamic Modeling, Earth Planet. Sci. Lett., 569, 117056, (2021), https://doi.org/10.1016/j.epsl.2021.117056
  • Bhowal, S., O'Neill, D., Fechner, M., Spaldin, N.A., Staub, U., Duffy, J., Collins, S.P., Anti-Symmetric Compton Scattering in LiNiPO4: Towards a Direct Probe of the Magneto-Electric Multipole Moment, Open Res. Europe, 2021, 1:134, (2021), https://doi.org/10.12688/openreseurope.13863.2
  • Bindeman, I.N., Colón, D.P., Wotzlaw, J.-F., Stern, R., Chiaradia, M., Guillong, M., Young Silicic Magmatism of the Greater Caucasus, Russia, with Implication for Its Delamination Origin Based on Zircon Petrochronology and Thermomechanical Modeling, J. Volcanol. Geoth. Res., 412, 107173, (2021), https://doi.org/10.1016/j.jvolgeores.2021.107173
  • Bissig, F., Khan, A., Tauzin, B., Sossi, P.A., Munch, F.D., Giardini, D., Multifrequency Inversion of Ps and Sp Receiver Functions: Methodology and Application to USArray Data, J. Geophys. Res. Sol. Ea., 126, e2020JB020350, (2021), https://doi.org/10.1029/2020JB020350
  • Bjelobrk, Z., Mendels, D., Karmakar, T., Parrinello, M., Mazzotti, M., Solubility Prediction of Organic Molecules with Molecular Dynamics Simulations, Cryst. Growth Des., 21, (2021), 5198-5205, https://doi.org/10.1021/acs.cgd.1c00546
  • Bonino, G., Lovecchio, E., Gruber, N., Münnich, M., Masina, S., Drivers and Impact of the Seasonal Variability of the Organic Carbon Offshore Transport in the Canary Upwelling System, Biogeosciences, 18, (2021), 2429-2448, https://doi.org/10.5194/bg-18-2429-2021
  • Brodowski, C., Sukhodolov, T., Feinberg, A., Höpfner, M., Peter, T., Stenke, A., Rozanov, E., Modeling the Sulfate Aerosol Evolution After Recent Moderate Volcanic Activity, 2008–2012, J. Geophys. Res. Atmos., 126, e2021JD035472, (2021), https://doi.org/10.1029/2021JD035472
  • Chalifour, A., Walser, J.-C., Pomati, F., Fenner, K., Temperature, Phytoplankton Density and Bacteria Diversity Drive the Biotransformation of Micropollutants in a Lake Ecosystem, Water Res., 202, 117412, (2021), https://doi.org/10.1016/j.watres.2021.117412
  • Comeau, Ch., Ries, B., Stadelmann, Th., Tremblay, J., Poulet, S., Fröhlich, U., Côté, J., Boudreault, P.-L., Derbali, R.M., Sarret, Ph., Grandbois, M., Leclair, G., Riniker, S., Marsault, E., Modulation of the Passive Permeability of Semipeptidic Macrocycles: N- and C-Methylations Fine-Tune Conformation and Properties, J. Med. Chem., 64, (2021), 5365-5383, https://doi.org/10.1021/acs.jmedchem.0c02036
    (article does not explicitly mention the Euler cluster but the author B. Ries informed us that the cluster was used for this work)
  • Cooper, A., Turney, C.S.M., Palmer, J., Hogg, A., McGlone, M., Wilmshurst, J., Lorry, A.M., Heaton, T.J., Russell, J.M., McCracken, K., Anet, J.G., Rozanov, E., Friedel, M., Suter, I., Peter, Th., Muscheler, R., Adolphi, F., Dosseto, A., Faith, J.T., Fenwick, P., Fogwill, Ch.J., Hughen, K., Lipson, M., Liu, J., Nowaczyk, N., Rainsley, E., Ramsey, Ch.B., Sebastianelli, P., Souilmi, Y., Stevenson, J., Thomas, Z., Tobler, R., Zech, R., A Global Environmental Crisis 42,000 Years Ago, Science, 371, (2021), 811-818, https://doi.org/10.1126/science.abb8677
  • Do, C.-T., Manjaly, Z.-M., Heinzle, J., Schöbi, D., Kasper, L., Pruessmann, K.P., Stephan, K.E., Frässle, S., Hemodynamic Modeling of Long-Term Aspirin Effects on Blood Oxygenated Level Dependent Responses at 7 Tesla in Patients at Cardiovascular Risk, Eur. J. Neurosci., 53(4), (2021), 1262-1278, https://doi.org/10.1111/ejn.14970
  • Economides, A., Arampatzis, G., Alexeev, D., Litvinov, S., Amoudruz, L., Kulakova, L., Papadimitriou, C., Koumoutsakos, P., Hierarchical Bayesian Uncertainty Quantification for a Model of the Red Blood Cell, Phys. Rev. Applied, 15, 034062, (2021), https://doi.org/10.1103/PhysRevApplied.15.034062
  • Efe, I., Spaldin, N.A., Gattinoni, C., On the Happiness of Ferroelectric Surfaces and Its Role in Water Dissociation: The Example of Bismuth Ferrite, J. Chem. Phys., 154, 024702, (2021), https://doi.org/10.1063/5.0033897
  • Fei, F., Jenny, P., A Hybrid Particle Approach Based on the Unified Stochastic Particle Bhatnagar-Gross-Krook and DSMC Methods, J. Comput. Phys., 424, 109858, (2021), https://doi.org/10.1016/j.jcp.2020.109858
  • Frässle, S., Harrison, S.J., Heinzle, J., Clementz, B.A., Tamminga, C.A., Sweeney, J.A., Gershon, E.S., Keshavan, M.S., Pearlson, G.D., Powers, A., Stephan, K.E., Regression Dynamic Causal Modeling for Resting-State fMRI, Hum. Brain Mapp., 42(7), (2021), 2159-2180, https://doi.org/10.1002/hbm.25357
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  • Gerick, F., Jault, D., Noir, J., Fast Quasi-Geostrophic Magneto-Coriolis Modes in the Earth's Core, Geophys. Res. Lett., 48, e2020GL090803, (2021), https://doi.org/10.1029/2020GL090803
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  • Mylonas, Ch., Abdallah, I., Chatzi, E., Conditional Variational Autoencoders for Probabilistic Wind Turbine Blade Fatigue Estimation Using Supervisory, Control, and Data Acquisition Data, Wind Energy, 24(10), (2021), 1122-1139, https://doi.org/10.1002/we.2621
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  • Nissen, C., Gruber, N., Münnich, M., Vogt, M., Southern Ocean Phytoplankton Community Structure as a Gatekeeper for Global Nutrient Biogeochemistry, Global Biogeochem. Cy., 35, e2021GB006991, (2021), https://doi.org/10.1029/2021GB006991
  • Nissen, C., Vogt, M., Factors Controlling the Competition Between Phaeocystis and Diatoms in the Southern Ocean and Implications for Carbon Export Fluxes, Biogeosciences, 18, (2021), 251-283, https://doi.org/10.5194/bg-18-251-2021
  • Nonemana, K., Muhich, Ch., Ausman, K., Henry, M., Jankowski, E., Molecular Simulations for Understanding the Stabilization of Fullerenes in Water, J. Comp. Sci. Educ., 12(1), (2021), 39-48, https://doi.org/10.22369/issn.2153-4136/12/1/6
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  • Pulido, H., Stanczyk, N.M., De Moraes, C.M., Mescher, M.C., A Unique Volatile Signature Distinguishes Malaria Infection from Other Conditions That Cause Similar Symptoms, Sci. Rep., 11, 13928, (2021), https://doi.org/10.1038/s41598-021-92962-x
  • Rombach, D., Birenheide, B., Wagenknecht, H.-A., Photoredox Catalytic Pentafluorosulfanylative Domino Cyclization of α-Substituted Alkenes to Oxaheterocycles by Using SF6, Chem. Eur. J., 27, (2021), 8088-8093, https://doi.org/10.1002/chem.202100767
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  • Spaldin, N.A., Efe, I., Rossell, M., Gattinoni, C., Layer and Spontaneous Polarizations in Perovskite Oxides and Their Interplay in Multiferroic Bismuth Ferrite, J. Chem. Phys., 154, 154702, (2021), https://doi.org/10.1063/5.0046061
  • Stelmakh, A., Aebli, M., Baumketner, A., Kovalenko, M.V., On the Mechanism of Alkylammonium Ligands Binding to the Surface of CsPbBr3 Nanocrystals, Chem. Mater., 33, (2021), 5962-5973, https://doi.org/10.1021/acs.chemmater.1c01081
  • Sukhodolov, T., Egorova, T., Stenke, A., Ball, W.T., Brodowsky, Ch., Chiodo, G., Feinberg, A., Friedel, M., Karagodin-Doyennel, A., Peter, Th., Sedlacek, J., Vattioni, S., Rozanov, E., Atmosphere–Ocean–Aerosol–Chemistry–Climate Model SOCOLv4.0: Description and Evaluation, Geosci. Model Dev., 14(9), (2021), 5525-5560, https://doi.org/10.5194/gmd-14-5525-2021
  • Tabibi, S., Boulet, J., Dillier, N., Bruce, I.C., Phenomenological Model of Auditory Nerve Population Responses to Cochlear Implant Stimulation, J. Neurosci. Meth., 358, 109212, (2021), https://doi.org/10.1016/j.jneumeth.2021.109212
  • Tagliavini, G., McCorquodale, M., Westbrook, Ch., Corso, P., Krol, Q., Holzner, M., Drag Coefficient Prediction of Complex-Shaped Snow Particles Falling in Air Beyond the Stokes Regime, Int. J. Multiphas. Flow, 140, 103652, (2021), https://doi.org/10.1016/j.ijmultiphaseflow.2021.103652
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  • Tan, E. Y.-Z., Schwonnek, R., Goh, K.T., Primaatmaja, I.W., Lim, C. C.-W., Computing Secure Key Rates for Quantum Cryptography with Untrusted Devices, npj Quantum Inf., 7, 158, (2021), https://doi.org/10.1038/s41534-021-00494-z
  • Tsimouri, I.Ch., Caseri, W.R., Gusev, A.A., Monte Carlo Evidence on Simple Conventional Means to Characterize the Final Extent of Reaction of Cured End-Linked Polymer Networks through the Miller–Macosko Nonlinear Polymerization Theory, Macromolecules, 54(4), (2021), 1589-1598, https://doi.org/10.1021/acs.macromol.0c02251
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2020

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  • Bodénan, J.-D., Surville, C., Szulágyi, J., Mayer, L., Schönbächler, M., Can Chondrules Be Produced by the Interaction of Jupiter with the Protosolar Disk?, ApJ, 901(1), 60(13pp), (2020), https://doi.org/10.3847/1538-4357/abaef2
  • D'Acquisto, M., Dal Zilio, L., Molinari, I., Kissling, E., Gerya, T., van Dinther, Y., Tectonics and Seismicity in the Northern Apennines Driven by Slab Retreat and Lithospheric Delamination, Tectonophysics, 789, 228481, (2020), https://doi.org/10.1016/j.tecto.2020.228481
  • Dal Zilio, L., Kissling, E., Gerya, T., van Dinther, Y., Slab Rollback Orogeny Model: A Test of Concept, Geophys. Res. Lett., 47, e2020GL089917, (2020), https://doi.org/10.1029/2020GL089917
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  • Ferrario, A., Naegelin, M., The Art of Natural Language Processing: Classical, Modern and Contemporary Approaches to Text Document Classification, SSRN, (2020), 1-51, https://dx.doi.org/10.2139/ssrn.3547887
  • Gasparini, B., McGraw, Z., Storelvmo, T., Lohmann, U., To What Extent Can Cirrus Cloud Seeding Counteract Global Warming?, Environ. Res. Lett., 15, 054002, (2020), https://doi.org/10.1088/1748-9326/ab71a3
  • Gülcher, A.J.P., Gebhardt, D.J., Ballmer, M.D., Tackley, P.J., Variable Dynamic Styles of Primordial Heterogeneity Preservation in the Earth’s Lower Mantle, Earth Planet. Sci. Lett., 536, 116160, (2020), https://doi.org/10.1016/j.epsl.2020.116160
  • Gülcher, A.J.P., Gerya, T., Montési, L.G.J., Corona Structures Driven by Plume–lithosphere Interactions and Evidence for Ongoing Plume Activity on Venus, Munch, J., Nat. Geosci., 13 (2020), 547-554, https://doi.org/10.1038/s41561-020-0606-1
  • Hadjidoukas, P.E., Bartezzaghi, A., Scheidegger, F., Istrate, R., Bekas, C., Malossi, A.C.I., Torcpy: Supporting Task Parallelism in Python, SoftwareX, 12, 100512, (2020), https://doi.org/10.1016/j.softx.2020.100517
  • Hahn, K.R., Baiker, A., Comparative Density Functional Theory Study of Cinchonidine and Hydrogen Coadsorption on Platinum Group Metals (Rh, Ir, Pd, and Pt) and Its Implications on Surface Chiral Site Formation, J. Phys. Chem. C, 124, 33, (2020), 18020-18030, https://doi.org/10.1021/acs.jpcc.0c03255
  • Hell, M.C., Schneider, T., Li, C., Atmospheric Circulation Response to Short-Term Arctic Warming in an Idealized Model, J. Atmos. Sci., 77(2), (2020), 531-549, https://doi.org/10.1175/JAS-D-19-0133.1
  • Hirshberg, B., Invernizzi, M., Parrinello, M., Path Integral Molecular Dynamics for Fermions: Alleviating the Sign Problem with the Bogoliubov Inequality, J. Chem. Phys., 152, 171102, (2020), https://doi.org/10.1063/5.0008720
  • Hou, I.C.-Y., Sun, Q., Eimre, K., Di Giovannantonio, M., Urgel, J.I., Ruffieux, P., Narita, A., Fasel, R., Müllen, K., On-Surface Synthesis of Unsaturated Carbon Nanostructures with Regularly Fused Pentagon−Heptagon Pairs, J. Am. Chem. Soc., 142, (2020), 10291-10296, https://dx.doi.org/10.1021/jacs.0c03635
  • Jordan, I., Huppert, M., Rattenbacher, D., Peper, M., Jelovina, D., Perry, C., von Conta, A., Schild, A., Wörner, H.J., Attosecond Spectroscopy of Liquid Water, Science, 369, (2020), 974-979, https://doi.org/10.1126/science.abb0979
  • Kacprzak, T., Herbel, J., Nicola, A., Sgier, R., Tarsitano, F., Bruderer, C., Amara, A., Refregier, A., Bridle, S.L., Drlica-Wagner, A., Grün, D., Hartley, W.G., Hoyle. B, Secco, L.F., Zuntz, J., Annis, J., Avila, S., Bertin, E., Brooks, D., Buckley-Geer, E., Carnero Rosell, A., Carrasco Kind, M., Carretero, J., da Costa, L.N., De Vicente, J., Desai, S., Diehl, H.T., Doel, P., García-Bellido, J., Gaztanaga, E., Gründl, R.A., Gschwend, J., Gutierrez, G., Hollowood, D.J., Honscheid, K., James, D.J., Jarvis, M., Lima, M., Maia, M.A.G., Marshall, J.L., Melchior, P., Menanteau, F., Miquel, R., Paz-Chinchón, F., Plazas, A.A., Sanchez, E., Scarpine, V., Serrano, S., Sevilla-noarbe, I., Smith, M., Suchyta, E., Swanson, M.E.C., Tarle, G., Vikram, V., Weller, J., Monte Carlo Control Loops for Cosmic Shear Cosmology with DES Year 1 Data, Phys. Rev. D, 101, 082003, (2020), https://doi.org/10.1103/PhysRevD.101.082003
  • Käppeli, R., Balsara, D.S., Chandrashekar, P., Hazra, A., Optimal, Globally Constraint-Preserving, DG(TD)2 Schemes for Computational Electrodynamics Based on Two-Derivative Runge-Kutta Timestepping and Multidimensional Generalized Riemann Problem Solvers – A von Neumann Stability Analysis, J. Comput. Phys., 408, 109238, (2020), https://doi.org/10.1016/j.jcp.2020.109238
  • Knezevic, M., Heilmann, M., Piccini, G.M., Tiefenbacher, K., Overriding Intrinsic Reactivity in Aliphatic C−H Oxidation: Preferential C3/C4 Oxidation of Aliphatic Ammonium Substrates, Angew. Chem. Int. Ed., 59, (2020), 12387-12391, https://doi.org/10.1002/anie.202004242
  • Kumar, S., Tutcuoglu, A.D., Hollenweger, Y., Kochmann, D.M., A Meshless Multiscale Approach to Modeling Severe Plastic Deformation of Metals: Application to ECAE of Pure Copper, Comp. Mater. Sci., 173, 109329, (2020), https://doi.org/10.1016/j.commatsci.2019.109329
  • Kundel, D., Bodenhausen, N., Jørgensen, H.B., Truu, J., Birkhofer, K., Hedlund, K., Mäder, P., Fliessbach, A., Effects of Simulated Drought on Biological Soil Quality, Microbial Diversity and Yields Under Long-Term Conventional and Organic Agriculture, FEMS Microbiol. Ecol., 96(12), fiaa205, (2020), https://doi.org/10.1093/femsec/fiaa205
  • Li, X., Prasser, H.-M. Niceno, B., URANS Simulations of the Single-Phase Mixing in a 4*4 LWR Fuel Bundle with Mixing Vanes, Validated Against a Sub-Channel Experiment, Nucl. Eng. Des., 363, 110612, (2020), https://doi.org/10.1016/j.nucengdes.2020.110612
  • Liang, S., Hemberger, P., Steglich, M., Simonetti, P., Levalois-Grützmacher, J., Grützmacher, Gaan, S., The Underlying Chemistry to the Formation of PO2 Radicals from Organophosphorus Compounds: A Missing Puzzle Piece in Flame Chemistry, Chem. Eur. J., 26, (2020), 10795-10800, https://doi.org/10.1002/chem.202001388
  • Lin, R., Molignini, P., Lode, A.U.J., Chitra, R., Pathway to Chaos through Hierarchical Superfluidity in Blue-Detuned Cavity-BEC Systems, Phys. Rev. A, 101, 061602(R), (2020), https://doi.org/10.1103/PhysRevA.101.061602
  • Lin, R., Molignini, P., Papariello, L., Tsatsos, MC., Lévêque, C., Weiner, S.E., Fasshauer, E., Chitra, R., Lode, A.U.J., MCTDH-X: The Multiconfigurational Time-Dependent Hartree Method for Indistinguishable Particles Software, Quantum Sci. Technol., 5, 024004, (2020), https://doi.org/10.1088/2058-9565/ab788b
  • Lombardi, F., Pickering, B., Colombo, E., Pfenninger, S., Policy Decision Support for Renewables Deployment through Spatially Explicit Practically Optimal Alternatives, Joule, 4(10), (2020), 2185-2207, https://doi.org/10.1016/j.joule.2020.08.002
  • Manser, P., Becker, H., Hörl, S., Axhausen, K.W., Designing a Large-Scale Public Transport Network Using Agent-Based Microsimulation, Transport. Res. A - Pol., 137, (2020), 1-15, https://doi.org/10.1016/j.tra.2020.04.011
  • Mascello, N., Spaldin, N.A., Narayan, A., Meier, Q.N., Theoretical Investigation of Twin Boundaries in WO3: Structure, Properties, and Implications for Superconductivity, Phys. Rev. Research, 2, 033460, (2020), https://doi.org/10.1103/PhysRevResearch.2.033460
  • Mastrotheodoros, T., Pappas, C., Molnar, P., Burlando, P., Manoli, G., Parajka, J., Rigon, R., Szeles, B., Bottazzi, M., Hadjidoukas, P., Fatichi, S., More Green and Less Blue Water in the Alps During Warmer Summers, Nat. Cli. Chang., 10 (2020), 155-161, https://doi.org/10.1038/s41558-019-0676-5
  • Meier, Q.N., Stucky, A., Teyssier, J., Griffin, S.M., van der Marel, D., Spaldin, N.A., Manifestation of Structural Higgs and Goldstone Modes in the Hexagonal Manganites, Phys. Rev. B, 102, 014102, (2020), https://doi.org/10.1103/PhysRevB.102.014102
  • Menant, A., Angiboust, S., Gerya, T., Lacassin, R., Simoes, M., Grandin, R., Transient Stripping of Subducting Slabs Controls Periodic Forearc Uplift, Nat. Commun., 11, 1823, (2020), https://doi.org/10.1038/s41467-020-15580-7
  • Merget, S., Catti, L., Piccini, G.M., Tiefenbacher, K., Requirements for Terpene Cyclizations inside the Supramolecular Resorcinarene Capsule: Bound Water and Its Protonation Determine the Catalytic Activity, J. Am. Chem. Soc., 142, (2020), 4400-4410, https://doi.org/10.1021/jacs.9b13239
  • Munch, F.D., Khan, A., Tauzin, B., van Driel, M., Giardini, D., Seismological Evidence for Thermo-Chemical Heterogeneity in Earth’s Continental Mantle, Earth Planet. Sci. Lett., 539, 116240, (2020), https://doi.org/10.1016/j.epsl.2020.116240
  • Münch, S., Lohmann, U., Developing a Cloud Scheme With Prognostic Cloud Fraction and Two Moment Microphysics for ECHAM‐HAM, J. Adv. Model. Earth. Sy., 12, e2019MS001824, (2020), https://doi.org/10.1029/2019MS001824
  • Noble, R., Burley, J.T., Le Sueur, C., Hochberg, M.E., When, Why and How Tumour Clonal Diversity Predicts Survival, Evol. Appl., 13, (2020), 1558-1568, https://doi.org/10.1111/eva.13057
    (article does not explicitly mention the Euler cluster but the author R. Noble informed us that the cluster was used for this work)
  • Oberle, D., Pruett, C.D., Jenny, P., Temporal large-eddy simulation based on direct deconvolution, Phys. Fluids, 32, 065112, (2020), https://doi.org/10.1063/5.0006637
  • Pikulski, M., Shiroka, T., Casola, F., Reyes, A.P., Kuhns, Ph.L., Wang, Sh., Ott, H.-R., Mesot, J., Two Coupled Chains Are Simpler Than One: Field-Induced Chirality in a Frustrated Spin Ladder, Sci. Rep., 10, 15862, (2020), https://doi.org/10.1038/s41598-020-72215-z
  • Preuss, S., Ampuero, J.P., Gerya, T., van Dinther, Y., Characteristics of Earthquake Ruptures and Dynamic Off-Fault Deformation on Propagating Faults, Solid Earth, 11, (2020), 1333-1360, https://doi.org/10.5194/se-11-1333-2020
  • Rellstab, Ch., Zoller, S., Sailer, Ch., Tedder, A., Gugerli, F., Shimizu, K.K., Holderegger, R., Widmer, A., Fischer, M.C., Genomic Signatures of Convergent Adaptation to Alpine Environments in Three Brassicaceae Species, Mol. Ecol., 29(22), (2020), 4350-4365, https://doi.org/10.1111/mec.15648
  • Rüdisser, S., Goldberg, N., Ebert, M.-O., Kovacs, H., Gossert, A.D., Efficient Affinity Ranking of Fluorinated Ligands by 19F NMR: CSAR and FastCSAR, J. Biomol. NMR, 74, (2020), 579-594, https://doi.org/10.1007/s10858-020-00325-x
  • Sakellarakis, V.D., Vera-Tudela, W., Doll, U., Ebi, D., Wright, Y.M., Boulouchos, K., The Effect of High-Pressure Injection Variations on the Mixing State of Underexpanded Methane Jets, Int. J. Engine Res., 22(9), (2020), 2900-2918, https://doi.org/10.1177/1468087420960895
  • Sanan, P., May, D.A., Bollhöfer, M., Schenk, O., Pragmatic Solvers for 3D Stokes and Elasticity Problems with Heterogeneous Coefficients: Evaluating Modern Incomplete LDLT Preconditioners, Solid Earth, 11, (2020), https://doi.org/10.5194/se-11-2031-2020
  • Schultheiss, J., Schaab, J., Småbråten, D.R., Skjærvø, S.H., Bourret, E., Yan, Z., Selbach, S.M., Meier, D., Intrinsic and Extrinsic Conduction Contributions at Nominally Neutral Domain Walls in Hexagonal Manganites, Appl. Phys. Lett., 116, 262903, (2020), https://doi.org/10.1063/5.0009185
  • Stegmann, J., Capelo, P.R., Bortola, E., Mayer, L., Improved Constraints from Ultra-Faint Dwarf Galaxies on Primordial Black Holes as Dark Matter, MNRAS, 492, (2020), 5247-5260, https://doi.org/10.1093/mnras/staa170
  • Tröndle, T., Lilliestam, J., Marelli, S., Pfenninger, S., Trade-offs between geographic scale, cost, and infrastructure requirements for fully renewable electricity in Europe, Joule, 4(9), (2020), 1929–1948, https://doi.org/10.1016/j.joule.2020.07.018
    (article does not explicitly mention the Euler cluster but the author T. Tröndle informed us that the cluster was intensively used for this work)
  • Tröndle, T., Supply-side options to reduce land requirements of fully renewable electricity in Europe, PLoS ONE, 15(8), e0236958, (2020), https://doi.org/10.1371/journal.pone.0236958
    (article does not explicitly mention the Euler cluster but the author T. Tröndle informed us that the cluster was intensively used for this work)
  • Tsimouri, I.Ch., Schwarz, F., Caseri, W., Hine, P.J., Gusev, A.A., Comparative Experimental and Molecular Simulation Study of the Entropic Viscoelasticity of End-Linked Polymer Networks, Macromolecules, 53(13), (2020), 5371-5380, https://doi.org/10.1021/acs.macromol.0c00972
  • Valcamonico, D., Sansavini, G., Zio, E., Cooperative Co-Evolutionary Approach to Optimize Recovery for Improving Resilience in Multi-Communities, Reliab. Eng. Syst. Safe., 197, 106800, (2020), https://doi.org/10.1016/j.ress.2020.106800
  • Yan, J., Ballmer, M.D., Tackley, P.J., The Evolution and Distribution of Recycled Oceanic Crust in the Earth's Mantle: Insight from Geodynamic Models, Earth Planet. Sci. Lett., 537, 116171, (2020), https://doi.org/10.1016/j.epsl.2020.116171
  • Zhang, X., Schneider, T., Kaul, C.M., Sensitivity of Idealized Mixed-Phase Stratocumulus to Climate Perturbations, Q. J. Roy. Meteor. Soc., 146, (2020), 3285-3305, https://doi.org/10.1002/qj.3846

2019

  • Ams, M.R., Trapp, N., Schwab, A., Milić, Diederich, F., Chalcogen Bonding“2S–2N Squares”versus CompetingInteractions:Exploring the Recognition Properties of Sulfur, Chem. Eur. J., 25, (2019), 323-333, https://doi.org/10.1002/chem.201804261
  • Antenucci, A., Crespo del Granado, P., Gjorgiev, B., Sansavini, G., Can Models for Long-Term Decarbonization Policies Guarantee Security of Power Supply? A Perspective from Gas and Power Sector Coupling, Energ. Strateg. Rev., 26, 100410, (2019), https://doi.org/10.1016/j.esr.2019.100410
  • Bakowies, D., Estimating Systematic Error and Uncertainty in Ab Initio Thermochemistry. I. Atomization Energies of Hydrocarbons in the ATOMIC(hc) Protocol, J. Chem. Theory Comput., 15, (2019), 5230-5251, https://doi.org/10.1021/acs.jctc.9b00343
  • Balsara, D.S., Käppeli, R., Von Neumann Stability Analysis of Globally Constraint-Preserving DGTD and PNPM Schemes for the Maxwell Equations Using Multidimensional Riemann Solvers, J. Comput. Phys., 376, (2019), 1108-1137, https://doi.org/10.1016/j.jcp.2018.09.051
  • Baykusuheva, D., Zindel, D., Svoboda, V., Bommeli, E., Ochsner, M., Tehlar, A., Wörner, H.J., Real-Time Probing of Chirality During a Chemical Reaction, PNAS, 116(48), (2019), 23923-23929, https://doi.org/10.1073/pnas.1907189116
  • Beaussier, S.J., Gerya, T.V., Burg, J.-P., Near-Ridge Initiation of Intraoceanic Subduction: Effects of Inheritance in 3D Numerical Models of the Wilson Cycle, Tectonophysics, 763, (2019), 1-13, https://doi.org/10.1016/j.tecto.2019.04.011
  • Bjelobrk, Z., Piaggi, P.M., Weber, T., Karmakar, T., Mazzoti, M., Parrinello, M., Naphthalene Crystal Shape Prediction from Molecular Dynamics Simulations, CrystEngComm, 21, (2019), 3280-3288, https://doi.org/10.1039/C9CE00380K
  • Bodenhausen, N., Somerville, V., Desirò, A., Walser, J.-C., Borghi, L., van der Heijden, M.G.A., Schlaeppi, K., Petunia- and Arabidopsis-Specific Root Microbiota Responses to Phosphate Supplementation, Phytobiomes Journal, 3(2), (2019), 112-124, https://doi.org/10.1094/PBIOMES-12-18-0057-R
  • Bongiorno, G., Bodenhausen, N., Bünemann, E.K., Brussaard, L., Greisen, S., Mäder, P., Quist, C.W., Walser, J.-C., de Goede, R.G.M., Reduced Tillage, But Not Organic Matter Input, Increased Nematode Diversity and Food Web Stability in European Long-Term Field Experiments, Mol. Ecol., 28(22), (2019), 4987-5005, https://doi.org/10.1111/mec.15270
  • Bont, L.G., Maurer, S., Breschan, J.R., Automated Cable Road Layout and Harvesting Planning for Multiple Objectives in Steep Terrain, Forests, 10(8), 687, (2019), https://doi.org/10.3390/f10080687
  • Di Palma, P.R., Guyennon, N., Parmigiani, A., Huber, Ch., Hesse, F., Romano, E., Impact of Synthetic Porous Medium Geometric Properties on Solute Transport Using Direct 3D Pore-Scale Simulations, Geofluids, 2019, 6810467, (2019), https://doi.org/10.1155/2019/6810467
  • Dieleman, J., Muschick, M., Nyingi, W.D., Verschuren, D., Species Integrity and Origin of Oreochromis Hunteri (Pisces: Cichlidae), Endemic to Crater Lake Chala (Kenya–Tanzania), Hydrobiologia, 832, (2019), 269-282, https://doi.org/10.1007/s10750-018-3570-7
  • Drechsler, S., Balog, S., Kilbinger, A.F.M., Casalini, T., The Influence of Substituents on Gelation and Stacking Order of Oligoaramid – Based Supramolecular Networks, Soft Matter., 15, (2019), 7250-7261, https://doi.org/10.1039/C9SM00148D
  • Dürrenberger, P., Gupta, A., Khammash, M., A Finite State Projection Method for Steady-State Sensitivity Analysis of Stochastic Reaction Networks, J. Chem. Phys., 150, 134101, (2019), https://doi.org/10.1063/1.5085271
  • Grosheintz-Laval, L., Käppeli, R., High-Order Well-Balanced Finite Volume Schemes for the Euler Equations with Gravitation, J. Comput. Phys., 378, (2019), 324-343, https://doi.org/10.1016/j.jcp.2018.11.018
  • Grübel, J., Wise, S., Thrash, T., Hölscher, C., A Cognitive Model for Routing in Agent-Based Modelling, AIP Conf. Proc., 2116, 250005, (2019), https://doi.org/10.1063/1.5114245
  • Gülcher, A.J.P., Beaussier, S.J., Gerya, T.V., On the Formation of Oceanic Detachment Faults and Their Influence on Intra-Oceanic Subduction Initiation: 3D Thermomechanical Modeling, Earth Planet. Sci. Lett., 506, (2019), 195-208, https://doi.org/10.1016/j.epsl.2018.10.042
  • Gusev, A.A., Numerical Estimates of the Topological Effects in the Elasticity of Gaussian Polymer Networks and Their Exact Theoretical Description, Macromolecules, 52, (2019), 3244-3251, https://doi.org/10.1021/acs.macromol.9b00262
  • Halabi, E.A., Pinotsi, D., Rivera-Fuentes, P., Photoregulated Fluxional Fluorophores for Live-Cell Super-Resolution Microscopy with No Apparent Photobleaching, Nat. Commun., 10, 1232, (2019), https://doi.org/10.1038/s41467-019-09217-7
  • Hampel, A., Liu, P., Franchini, C., Ederer, C., Energetics of the Coupled Electronic–structural Transition in the Rare-Earth Nickelates, NPJ Quantum Materials, 4(1), (2019), http://dx.doi.org/10.1038/s41535-019-0145-4
  • Herrmann, M., Kraft, T., Tormann, T., Scarabello, L., Wiemer, S., A Consistent High-Resolution Catalog of Induced Seismicity in Basel Based on Matched Filter Detection and Tailored Post-Processing, J. Geophys. Res. Sol. Ea., 124, (2019), 8449-8477, https://doi.org/10.1029/2019JB017468
  • Herrmann, L., Schwab, C., Multilevel Quasi-Monte Carlo Integration with Product Weights for Elliptic PDEs with Lognormal Coefficients, ESAIM: M2AN, 53(5), (2019), 1507-1552, https://doi.org/10.1051/m2an/2019016
  • Invernizzi, M., Parrinello, M., Making the Best of a Bad Situation: A Multiscale Approach to Free Energy Calculation, J. Chem. Theory Comput., 15, (2019), 2187-2194, https://doi.org/10.1021/acs.jctc.9b00032
  • Jain, Sh., Tiso, P., Hyper-Reduction Over Nonlinear Manifolds for Large Nonlinear Mechanical Systems, J. Comput. Nonlinear Dynam., 14(8), 081008, (2019), https://doi.org/10.1115/1.4043450
  • Kranjčević, M., Adelmann, A., Arbenz, P., Citterio, A., Stingelin, L., Multi-Objective Shape Optimization of Radio Frequency Cavities Using an Evolutionary Algorithm, Nuclear Inst. and Methods in Physics Research, A920, (2019), 106-114, https://doi.org/10.1016/j.nima.2018.12.066
  • Kranjčević, M., Zadeh, S.G., Adelmann, A., Arbenz, P., van Rienen, U., Constrained Multiobjective Shape Optimization of Superconducting Rf Cavities Considering Robustness Against Geometric Perturbations, Phys. Rev. Accel. Beams, 22, 122001, (2019), https://doi.org/10.1103/PhysRevAccelBeams.22.122001
  • Kumar, P.V., Rossi, T.P., Dafcik, D.M., Reichmuth, D., Kuisma, M., Erhart, P., Puska, M.J., Norris, D.J., Plasmon-Induced Direct Hot-Carrier Transfer at Metal-Acceptor Interfaces, ACS Nano, 13(3), (2019), 3188-3195, https://doi.org/10.1021/acsnano.8b08703
  • Kumar, P.V., Rossi, T.P., Kuisma, M., Erhart, P., Norris, D.J., Direct Hot-Carrier Transfer in Plasmonic Catalysis, Faraday Discuss., 2014, (2019), 189-197, https://doi.org/10.1039/C8FD00154E
  • Kuznetsov, D.A., Chen, Z., Kumar, P.V., Tsoukalou, A., Kierzkowska, A., Abdala, P.M., Safonova, O.V., Federov, A., Müller, C.R., Single Site Cobalt Substitution in 2D Molybdenum Carbide (MXene) Enhances Catalytic Activity in the Hydrogen Evolution Reaction, J. Am. Chem. Soc., 141(44), (2019), 17809-17816, https://doi.org/10.1021/jacs.9b08897
  • Lichtenberg, T., Golabek, G.J., Burn, R. Meyer, M.R., Alibert, Y., Gerya, T.V., Morasini, C., A Water Budget Dichotomy of Rocky Protoplanets from 26Al-Heating, Nat. Astron., 3, (2019), 307-313, https://doi.org/10.1038/s41550-018-0688-5
  • Lichtenberg, T., Keller, T., Katz, R.F., Golabek, G.J., Gerya, T.V., Magma Ascent in Planetesimals: Control by Grain Size, Earth Planet. Sci. Lett., 507, (2019), 154-165, https://doi.org/10.1016/j.epsl.2018.11.034
  • Lin, R., Papariello, L., Molignini, P., Chitra, R., Lode, A.U.J., Superfluid–Mott-Insulator Transition of Ultracold Superradiant Bosons in a Cavity, Phys. Rev. A, 100, 013611, (2019), https://doi.org/10.1103/PhysRevA.100.013611
  • Malär, A.A., Smith-Penzel, S., Camenisch, G.-M., Wiegand, T., Samoson, A., Böckmann, A., Ernst, M., Meier, B.H., Quantifying Proton NMR Coherent Linewidth in Proteins Under Fast MAS Conditions: a Second Moment Approach, Phys. Chem. Chem. Phys., 21, (2019), 18850-18865, https://doi.org/10.1039/C9CP03414E
  • Marques, D.A., Lucek, K., Sousa, V.C., Excoffier, L., Seehausen, O., Admixture Between Old Lineages Facilitated Contemporary Ecological Speciation in Lake Constance Stickleback, Nat. Commun., 10, 4240, (2019), https://doi.org/10.1038/s41467-019-12182-w
  • Meyer de Freitas, L., Becker, H., Zimmermann, M., Axhausen, K.W., Modelling Intermodal Travel in Switzerland: A Recursive Logit Approach, Transport. Res. A - Pol, 119, (2019), 200-213, https://doi.org/10.1016/j.tra.2018.11.009
  • Miho, E., Roškar, R., Greiff, V., Reddy, S.T., Large-Scale Network Analysis Reveals the Sequence Space Architecture of Antibody Repertoires, Nat. Commun., 10, 1321, (2019), https://doi.org/10.1038/s41467-019-09278-8
  • Milanese, A., Mende, D.R., Paoli, L., Salazar, G., Ruscheweyh, H.-J., Cuenca, M., Hingamp, P., Alves, R., Costea, P.I, Coelho, L.P., Schmidt, T.S.B., Almeida, A., Mitchell, A.L., Finn, R.D., Huearta-Cepas, J., Bork, P., Zeller, G., Sunagawa, S., Microbial abundance, activity and population of genomic profiling with mOTUs2, Nat. Commun., 10, 1014, (2019), https://doi.org/10.1038/s41467-019-08844-4
  • Mitov, V., Stadler, T., Parallel Likelihood Calculation for Phylogenetic Comparative Models: The SPLITT C++ Library, Methods Ecol. Evol., 10(4), (2019), 493-506, https://doi.org/10.1111/2041-210X.13136
  • Mueller, J., Matlack, K.H., Shea, K., Daraio, Ch., Energy Absorption Properties of Periodic and Stochastic 3D Lattice Materials, Adv. Theory Simul., 2019, 1900081, (2019), https://doi.org/10.1002/adts.201900081
  • Paidikondala, M., Rangasami, V.K., Nawale, G.N., Casalini, T., Perale, G., Kadekar, S., Mohanty, G., Salminen, T., Oommen, O.P., Varghese, O.P, An Unexpected Role of Hyaluronic Acid in Trafficking siRNA Across the Cellular Barrier: The First Biomimetic, Anionic, Non‐Viral Transfection Method, Angew. Chem. Int. Ed., 58, (2019), 2815-2819, https://doi.org/10.1002/anie.201900099
  • Parmigiani, A., Di Palma, P.R., Leclaire, S., Habib, F., Kong, X.-Z., Characterization of Transport-Enhanced Phase Separation in Porous Media Using a Lattice-Boltzmann Method, Geofluids, 2019, 5176410, (2019), https://doi.org/10.1155/2019/5176410
  • Perraudin, N., Srivastava, A., Lucchi, A., Kacprzak, T., Hofmann, Th., Réfrégier, A., Cosmological N-Body Simulations: A Challenge for Scalable Generative Models, Comput. Astrophys. Cosmol., 6, 5, (2019), https://doi.org/10.1186/s40668-019-0032-1
  • Polino, D., Parrinello, M., Kinetics of Aqueous Media Reactions via Ab Initio Enhanced Molecular Dynamics: The Case of Urea Decomposition, J. Phys. Chem. B, 123, (2019), 6851-6856, https://doi.org/10.1021/acs.jpcb.9b05271
  • Preuss, S., Herrendörfer, R. Gerya, T., Ampuero, J.-P., van Dinther, Y., Seismic and Aseismic Fault Growth Lead to Different Fault Orientations, J. Geophys. Res. Sol. Ea., 124, (2019), 8867-8889, https://doi.org/10.1029/2019JB017324
  • Ramirez, M.O., Lummen, T.A., Carrasco, I., Barnes, E., Aschauer, U., Stefanska, D., Gupta, A.S., de las Heras, C., Akamatsu, H., Holt, M., Molina, P., Barnes, A., Haislmaier, R.C., Deren, P.J., Prieto, C., Bausá, L.E., Spaldin, N.A., Gopalan, V., Emergent Room Temperature Polar Phase in CaTiO3 Nanoparticles and Single Crystals, APL Mater., 7, 011103, (2019), https://doi.org/10.1063/1.5078706
  • Rizzi, V., Mendels, D., Sicilia, E., Parrinello, M., Blind Search for Complex Chemical Pathways Using Harmonic Linear Discriminant Analysis, J. Chem. Theory Comput., 15(8), (2019), 4507-4515, https://doi.org/10.1021/acs.jctc.9b00358
  • Rizzi, V., Polino, D., Sicilia, E., Russo, N., Parrinello, M., The Onset of Dehydrogenation in Solid Ammonia Borane: An Ab Initio Metadynamics Study, Angew. Chem. Int. Ed., 58, (2019), 3976-3980, https://doi.org/10.1002/anie.201900134
  • Saito, F., Trapp, N., Bode, J.W., Iterative Assembly of Polycyclic Saturated Heterocycles from Monomeric Building Blocks, J. Am. Chem. Soc., 141, (2019), 5544-5554, https://doi.org/10.1021/jacs.9b01537
  • Schneider, T., Kaul, C.M., Pressel, K.G., Possible Climate Transitions from Breakup of Stratocumulus Decks Under Greenhouse Warming, Nat. Geosci., 12, (2019), 163-167, https://doi.org/10.1038/s41561-019-0310-1
  • Sesterhenn, F., Galloux, M., Vollers, S.S., Csepregi, L., Yang, C., Descamps, D., Bonet, J., Friedensohn, S., Gainza, P., Corthésy, P., Chen, M., Rosset, S., Rameix-Welti, M.-A., Éléouët, J.-F., Reddy, S.T., Graham, B.S., Riffault, S., Correia, B.E., Boosting Subdominant Neutralizing Antibody Responses With a Computationally Designed Epitope-Focused Immunogen, PLoS Biol., 17(2), e3000164, (2019), https://doi.org/10.1371/journal.pbio.3000164
  • Skjærvø, S.H, Meier, Q.N., Feygenson, M., Spaldin, N.A., Billinge, S.J.L., Bozin, E.S., Selbach, S.M., Unconventional Continuous Structural Disorder at the Order-Disorder Phase Transition in the Hexagonal Manganites, Phys. Rev. X, 9, 031001, (2019), https://doi.org/10.1103/PhysRevX.9.031001
  • Tröndle, T., Pfenninger, S., Lilliestam, J., Home-Made or Imported: On the Possibility for Renewable Electricity Autarky on All Scales in Europe, Energy Strateg. Rev., 26, 100388, (2019), https://doi.org/10.1016/j.esr.2019.100388
    (article does not explicitly mention the Euler cluster but the author T. Tröndle informed us that the cluster was intensively used for this work)
  • van Zelst, I., Wollherr, S., Gabriel, A.-A., Madden, E.H., van Dinther, Y., Modeling Megathrust Earthquakes Across Scales: One-way Coupling From Geodynamics and Seismic Cycles to Dynamic Rupture, J. Geophys. Res. Sol. Ea., 124, (2019), 11414-11446, https://doi.org/10.1029/2019JB017539
  • Varma, N., Mutt, E., Mühle, J., Lesca, E., Crystal Structure of Jumping Spider Rhodopsin-1 as a Light Sensitive GPCR, PNAS, 116(29), (2019), 14547-14556, https://doi.org/10.1073/pnas.1902192116
  • Weiss, Ph., Oberle, D., Meyer, D.W., Jenny, P., Impact of Turbulence Forcing Schemes on Particle Clustering, Phys. Fluids 31, 061703, (2019), https://doi.org/10.1063/1.5110241
  • Yu, Zh., Shea, K., Stanković, T., A Computational Method for the Design of an Additively Manufactured Personalized Artificial Spinal Disc With Physiological Stiffness Under Multiple Loading Conditions, J. Mech. Des., 141(10), 101406, (2019), https://doi.org/10.1115/1.4043931
  • Zhang, Y.-Y., Niu, H., Piccini, G.M., Mendels, D., Parrinello, M., Improving Collective Variables: The Case of Crystallization, J. Chem. Phys., 150, 094509, (2019), https://doi.org/10.1063/1.5081040
  • Zoller, S., Koepf, E., Roos, P., Steinfeld, A., Heat Transfer Model of a 50 kW Solar Receiver–Reactor for Thermochemical Redox Cycling Using Cerium Dioxide, J. Sol. Energy Eng., 141(2), 021014, (2019), https://doi.org/10.1115/1.4042059

2018

  • Altenhoff, A.M., Glover, N.M., Train, C.-M., Kaleb, K., Vesztrocy, A.W., Dylus, D., de Farias, T.M., Zile, K., Stevenson, Ch., Long, J., Redestig, H., Gonnet, G.H., Dessimoz, Ch., The OMA Orthology Database in 2018: Retrieving Evolutionary Relationships Among All Domains of Life Through Richer Web and Programmatic Interfaces, Nucleic Acids Res., 46(D1), (2018), D477-D485, https://doi.org/10.1093/nar/gkx1019
  • Bachmann, B.J., Giampietro, C., Bayram, A., Stefopoulos, G., Michos, Ch., Graeber, G., Falk, M.V., Poulikakos, D., Ferrari, A., Honeycomb-Structured Metasurfaces for the Adaptive Nesting of Endothelial Cells Under Hemodynamic Loads, Biomater. Sci., 6, (2018), 2726-2737, https://doi.org/10.1039/C8BM00660A
  • Balázs, A., Matenco, L., Vogt, K., Cloetingh, S., Gerya, T., Extensional Polarity Change in Continental Rifts: Inferences From 3-D Numerical Modeling and Observations, J. Geophys. Res. Sol. Ea., 123, (2018), 8073-8094, https://doi.org/10.1029/2018JB015643
  • Bissig, F., Khan, A., van Driel, M., Stähler, S.C., Giardini, D., Panning, M., Drilleau, M., Lognonné, P., Gudkova, T.V., Zharkov, V.N., Plesa, A.-C., Banerdt, W.B., On the Detectability and Use of Normal Modes for Determining Interior Structure of Mars, Space Sci. Rev., 214, 114, (2018), https://doi.org/10.1007/s11214-018-0547-9
  • Blume, S.O.P, Sansavini, G., The Influence of Load Characteristics on Early Warning Signs in Power Systems, Critical Information Infrastructures Security, CRITIS 2017, LNCS, vol 10707, (2018), https://doi.org/10.1007/978-3-319-99843-5_7
  • Böhm, J., Georgoudis, A., Larsen, K.J., Schönemann, H., Zhang, Y., Complete Integration-by-Parts Reductions of the Non-Planar Hexagon-Box via Module Intersections, J. High Energ. Phys., 2018, 24, (2018), https://doi.org/10.1007/JHEP09(2018)024
  • Bourgeois, Y., Stritt, C., Walser, J.-C., Gordon, S.P., Vogel, J.P., Roulin, A.C., Genome‐wide Scans of Selection Highlight the Impact of Biotic and Abiotic Constraints in Natural Populations of the Model Grass Brachypodium Distachyon, Plant J., 96(2), (2018), 438-451, https://doi.org/10.1111/tpj.14042
  • Colón, D.P., Bindeman, I.N., Gerya, T.V., Thermomechanical Modeling of the Formation of a Multilevel, Crustal-Scale Magmatic System by the Yellowstone Plume, Geophys. Res. Lett., 45, (2018), 3873-3879, https://doi.org/10.1029/2018GL077090
  • Dal Zilio, L., van Dinther, Y., Gerya, T.V., Pranger, C.C., Seismic Behaviour of Mountain Belts Controlled by Plate Convergence Rate, Earth Planet. Sci. Lett., 482, (2018), 81-92, https://doi.org/10.1016/j.epsl.2017.10.053
  • de Souza, G.F., Khatiwala, S.P., Hain, M.P., Little, S.H., Vance, D., On the Origin of the Marine Zinc–Silicon Correlation, Earth Planet. Sci. Lett., 492, (2018), 22-34, https://doi.org/10.1016/j.epsl.2018.03.050
  • Dunnett, K., Narayan, A., Spaldin, N.A., Balatsky, A.V., Strain and Ferroelectric Soft-Mode Induced Superconductivity in Strontium Titanate, Phys. Rev. B, 97, 1440506, (2018), https://doi.org/10.1103/PhysRevB.97.144506
  • Feulner, P.G.D., Schwarzer, J., Häsler, M.P., Meier, J.I., Seehausen, O., A Dense Linkage Map of Lake Victoria Cichlids Improved the Pundamilia Genome Assembly and Revealed a Major QTL for Sex-Determination, G3 Genes Genom. Genet., 8(7), (2018), 2411-2420, https://doi.org/10.1534/g3.118.200207
  • Frässle, S., Lomakina, E.I., Kasper, L., Manjaly, Z.M., Leff, A., Pruessmann, K.P., Buhmann, J.M., Stephan, K.E., A Generative Model of Whole-Brain Effective Connectivity, NeuroImage, 179, (2018), 505-529, https://doi.org/10.1016/j.neuroimage.2018.05.058
  • García-López, V., Milić, J.V., Zalibera, M., Neshchadin, D., Kuss-Petermann, M., Ruhlmann, L., Nomrowski, J., Trapp, N., Boudone, C., Gescheidt, G., Wenger, O.S., Diederich, F., Light-Actuated Resorcin[4]Arene Cavitands, Tetrahedron, 74(39), (2018), 5615-5626, https://doi.org/10.1016/j.tet.2018.08.002
  • Gasparini, B., Meyer, A., Neubauer, D., Münch, S., Lohmann, U., Cirrus Cloud Properties as Seen by the CALIPSO Satellite and ECHAM-HAM Global Climate Model, J. Climate, 31(5), (2018), 1983-2003, https://doi.org/10.1175/JCLI-D-16-0608.1
  • Hirsch, A.L., Prestele, R., Davin, E.L., Seneviratne, S.I., Thiery, W., Verburg, P.H., Modelled Biophysical Impacts of Conservation Agriculture on Local Climates, Glob. Change Biol., 24, (2018), 4758-4774, https://doi.org/10.1111/gcb.14362
  • Huang, W.T.K, Ickes, L., Tegen, I., Rinaldi, M., Ceburnis, D., Lohmann, U., Global Relevance of Marine Organic Aerosol as Ice Nucleating Particles, Atmos. Chem. Phys., 18, (2018), 11423-11445, https://doi.org/10.5194/acp-18-11423-2018
  • Hunt, A.C., Cook, D.L., Lichtenberg, T., Reger, P.M., Ek, M., Golabek, G.J., Schönbächler, M., Late Metal–silicate Separation on the IAB Parent Asteroid: Constraints from Combined W and Pt Isotopes and Thermal Modelling, Earth Planet. Sci. Lett., 482, (2018), 490-500, https://doi.org/10.1016/j.epsl.2017.11.034
  • Jain, Sh., Tiso, P., Simulation-Free Hyper-Reduction for Geometrically Nonlinear Structural Dynamics: A Quadratic Manifold Lifting Approach, J. Comput. Nonlin. Dyn., 13(7), 071003, (2018), https://doi.org/10.1115/1.4040021
  • Kahn, A., Liebske, C., Rozel, A., Rivoldini, A., Nimmo, F., Connolly, J.A.D., Plesa, A.-C., Giardini, D., A Geophysical Perspective on the Bulk Composition of Mars, J. Geophys. Res. Planet., 123, (2018), 575-611, https://doi.org/10.1002/2017JE005371
  • Kranjčević, M., Arbenz, P., Adelmann, A., Multi-Level Preconditioning and Eigenvector Approximation for Axisymmetric Maxwell Eigenproblems, Proc. Appl. Math. Mech., 18, e201800091, (2018), https://doi.org/10.1002/pamm.201800091
  • Leonardi, F., A Projection Method for the Computation of Admissible Measure Valued Solutions of the Incompressible Euler Equations, Discrete Cont. Dyn.-S, 11(5), (2018), 941-961, https://doi.org/10.3934/dcdss.2018056
  • Lichtenberg, T., Golabek, G.J., Dullemond, C.P., Schönbächler, M., Gerya, T.V., Meyer, M.R., Impact Splash Chondrule Formation During Planetesimal Recycling, Icarus, 302, (2018), 27-43, https://doi.org/10.1016/j.icarus.2017.11.004
  • Lovecchio, E., Gruber, N., Münnich, M., Mesoscale Contribution to the Long-Range Offshore Transport of Organic Carbon from the Canary Upwelling System to the Open North Atlantic, Biogeosciences, 15, (2018), 5061-5091, https://doi.org/10.5194/bg-15-5061-2018
  • Matlack, K.H., Serra-Garcia, M., Palermo, A., Huber, S.D., Daraio, Ch., Designing Perturbative Metamaterials from Discrete Models, Nat. Mat., 17, (2018), 323-328, https://doi.org/10.1038/s41563-017-0003-3
  • Meier, J.I., Marques, D.A., Wagner, C.E., Excoffier, L., Seehausen, O., Genomics of Parallel Ecological Speciation in Lake Victoria Cichlids, Mol. Biol. Evol., 35(6), (2018), 1489-1506, https://doi.org/10.1093/molbev/msy051
  • Milella, F., Gazzani, M., Sutter, D., Mazzotti, M., Process Synthesis, Modeling and Optimization of Continuous Cooling Crystallization with Heat Integration—Application to the Chilled Ammonia CO2 Capture Process, Ind. Eng. Chem. Res., 57(34), (2018), 11712-11727, https://doi.org/10.1021/acs.iecr.8b01993
  • Nissen, C., Vogt, M., Münnich, M., Gruber, N., Haumann, F.A., Factors Controlling Coccolithophore Biogeography in the Southern Ocean, Biogeosciences, 15, (2018), 6997-7024, https://doi.org/10.5194/bg-15-6997-2018
  • Oldenburg, F.J., Bon, M., Schmidt, T.J., Perego, D., Polino, D., Laino, T., Gubler, L.,Schmidt, T.J., Revealing the Role of Phosphoric Acid in All-Vanadium Redox Flow Batteries with DFT Calculations and in Situ Analysis, Phys. Chem. Chem. Phys., 20, (2018), 23664-23673, https://doi.org/10.1039/C8CP04517H
  • Pang, Y., Zhang, H., Gerya, T.V., Liao, J., Cheng, H., Shi, Y., The Mechanism and Dynamics of N-S Rifting in Southern Tibet: Insight From 3-D Thermomechanical Modeling, J. Geophys. Res. Sol. Ea., 123, (2018), 859-877, https://doi.org/10.1002/2017JB014011
  • Porer, M., Fechner, M., Bothschafter, E.M., Rettig, L., Savoini, M., Esposito, V., Rittmann, J., Kubli, M., Neugebauer, M.J., Abreu, E., Kubacka, T., Huber, T., Lantz, G., Parchenko, S., Grübel, S., Paarmann, A., Noack, J., Beaud, P., Ingold, G., Aschauer, U., Johnson, S.L., Staub, U., Ultrafast Relaxation Dynamics of the Antiferrodistortive Phase in Ca Doped SrTiO3, Phys. Rev. Lett., 121, 055701, (2018), https://doi.org/10.1103/PhysRevLett.121.055701
  • Ramrath, D.J., Niemann, M., Leibundgut, M., Bieri, Ph., Prange, C., Horn, E.K., Leitner, A., Boehringer, D., Schneider, A., Ban, N., Evolutionary Shift Toward Protein-Based Architecture in Trypanosomal Mitochondrial Ribosomes, Science, 362, eaau7735, (2018), https://doi.org/10.1126/science.aau7735
  • Remondi, F., Kirchner, J.W., Burlando, P., Fatichi, S., Water Flux Tracking With a Distributed Hydrological Model to Quantify Controls on the Spatio temporal Variability of Transit Time Distributions, Water Resour. Res., 54, (2018), 3081-3099, https://doi.org/10.1002/2017WR021689
  • Roche, V., Sternai, P., Guillou-Frottier, L., Menant, A., Jolivet, L., Bouchot, V., Gerya, T., Emplacement of Metamorphic Core Complexes and Associated Geothermal Systems Controlled by Slab Dynamics, Earth Planet. Sci. Lett., 498, (2018), 322-333, https://doi.org/10.1016/j.epsl.2018.06.043
  • Rodríguez, A.C., Kacprzak, T., Lucchi, A., Amara, A., Sgier, R., Fluri, J., Hofmann, Th., Réfrégier, A., Fast Cosmic Web Simulations With Generative Adversarial Networks, Comput. Astrophys. Cosmol., 5, 4, (2018), https://doi.org/10.1186/s40668-018-0026-4
  • Schilling, Ch., Altunbulak, M., Knecht, S., Lopes, A., Whitfield, J.D., Christandl, M., Gross, D., Reiher, M., Generalized Pauli constraints in small atoms, Phys. Rev. A, 97, 052503, (2018), https://doi.org/10.1103/PhysRevA.97.052503
  • Signorell, R.D., Papachristodoulou, A., Xiao, J., Arpagaus, B., Casalini, T., Grandjean, J., Thamm, J., Steiniger, F., Luciani, P., Brambilla, D., Werner, B., Martin, E., Weller, M., Roth, P., Leroux, J.-C., Preparation of PEGylated Liposomes Incorporating Lipophilic Lomeguatrib Derivatives for the Sensitization of Chemo-Resistant Gliomas, Int. J. Pharm., 536, (2018), 388-396, https://doi.org/10.1016/j.ijpharm.2017.11.070
  • Soetbeer, J., Gast, P., Walish, J.J., Zhao, Y., George, Ch., Yang, Ch., Swager, T.M., Griffin, R.G., Nathies, G., Conformation of Bis-Nitroxide Polarizing Agents by Multi-Frequency EPR Spectroscopy, Phys. Chem. Chem. Phys., 20, 25506, (2018), https://doi.org/10.1039/C8CP05236K
  • Taddio, M.F., Mu, L., Keller, C., Schibli, R., Krämer, S.D., Physiologically Based Pharmacokinetic Modelling with Dynamic PET Data to Study the In Vivo Effects of Transporter Inhibition on Hepatobiliary Clearance in Mice, Contrast Media Mol. I., 2018, 5849047, (2018), https://doi.org/10.1155/2018/5849047
  • Tan, Zh., Kaul, C.M., Pressel, K., Cohen, Y., Schneider, T., Teixeira, J., An Extended Eddy‐Diffusivity Mass‐Flux Scheme for Unified Representation of Subgrid‐Scale Turbulence and Convection, J. Adv. Model. Earth Sy., 10, (2018), 770-800, https://doi.org/10.1002/2017MS001162
  • Weiss, Ph., Meyer, D.W., Jenny, P., Evaporating Droplets in Turbulence Studied with Statistically Stationary Homogeneous Direct Numerical Simulation, Phys. Fluids, 30, 083304, (2018), https://doi.org/10.1063/1.5047270
  • Wills, R.C.J., Schneider, T., Mechanisms Setting the Strength of Orographic Rossby Waves across a Wide Range of Climates in a Moist Idealized GCM, J. Climate, 31(18), (2018), 7679-7700, https://doi.org/10.1175/JCLI-D-17-0700.1
  • Yan, H.J., Casalini, T., Hulsart-Billström, G., Wang, S., Oommen O.P., Salvalaglio, M., Larsson, S., Hilborn, J., Varghese, O.P., Synthetic Design of Growth Factor Sequestering Extracellular Matrix Mimetic Hydrogel for Promoting in Vivo Bone Formation, Biomaterials, 161, (2018), 190-202, https://doi.org/10.1016/j.biomaterials.2018.01.041

2017

  • Balsara, D.S., Käppeli, R., Von Neumann Stability Analysis of Globally Divergence-Free RKDG Schemes for the Induction Equation Using Multidimensional Riemann Solvers, J. Comput. Phys., 336, (2017), 104-127, https://doi.org/10.1016/j.jcp.2017.01.056
  • Bettler, S., Simutis, G., Perren, G., Blosser, D., Gvasaliya, S., Zheludev, A., High-pressure Raman Study of the Quantum Magnet (C4H12N2)Cu2Cl6, Phys. Rev. B, 96, 174431, (2017), https://doi.org/10.1103/PhysRevB.96.174431
  • Bieri, Ph., Leibundgut, M., Saurer, M., Böhringer, D., Ban, N., The Complete Structure of the Chloroplast 70S Ribosome in Complex with Translation Factor pY, EMBO J., 36, (2017), 475-486, https://doi.org/10.15252/embj.201695959
  • Blume, S.O.P., Sansavini, G., Effects of Stressor Characteristics on Early Warning Signs of Critical Transitions and "critical Coupling" in Complex Dynamical Systems, Chaos, 27, 121101, (2017), https://doi.org/10.1063/1.5008315
  • Chandrasena, R.U., Yang, W., Lei, Q., Delgado-Jaime, M.U., Wijesekara, K.D., Golalikhani, M., Davidson, B.A., Arenholz, E., Kobayashi, K., Kobata, M., de Groot, F.M.F, Aschauer, U., Spaldin, N.A., Xi, X., Gray, A.X., Strain-Engineered Oxygen Vacancies in CaMnO3 Thin Films, Nano Lett., 17, (2017), 794-799, https://doi.org/10.1021/acs.nanolett.6b03986
  • Charrier, D.E., May, D.A., Schnepp, S.M., Symmetric Interior Penalty Discontiuous Galerkin Discretizations and Block Preconditioning for Heterogeneous Stokes Flow, SIAM J. Sci. Comput., 39(6), (2017), B1021-B1042, https://doi.org/10.1137/16M1084912
  • Chowdhury, P., Gerya, T., Chakraborty, S., Emergence of Silicic Continents as the Lower Crust Peels Off on a Hot Plate-Tectonic Earth, Nature Geosci., 10, (2017), 698-703, https://doi.org/10.1038/ngeo3010
  • Dorostkar, O., Guyer, R.A., Johnson, P.A., Marone, Ch., Carmeliet, J., On the Role of Fluids in Stick-Slip Dynamics of Saturated Granular Fault Gouge Using a Coupled Computational Fluid Dynamics-Discrete Element Approach, J. Geophys. Res. Sol. Ea., 122, (2017), 3689–3700, http://dx.doi.org/10.1002/2017JB014099
  • Freitag, L., Knecht, S., Angeli, C., Reiher, M., Multireference Perturbation Theory with Cholesky Decomposition for the Density Matrix Renormalization Group, J. Chem. Theory Comput., 13(2), (2017), 451-459, https://doi.org/10.1021/acs.jctc.6b00778
  • Gamboa-Carballo, J.J., Rana, V.K., Levalois-Grützmacher, J., Gaspard, S., Jáuregui-Haza, U., Structures and Stabilities of Naturally Occurring Cyclodextrins: a Theoretical Study of Symmetrical Conformers, J. Mol. Model., 23(11), 318, (2017), https://doi.org/10.1007/s00894-017-3488-4
  • Gasparini, B., Münch, S., Poncet, L., Feldmann, M., Lohmann, U., Is Increasing Ice Crystal Sedimentation Velocity in Geoengineering Simulations a Good Proxy for Cirrus Cloud Seeding?, Atmos. Chem. Phys., 17, (2017), 4871-4885, https://doi.org/10.5194/acp-17-4871-2017
  • Grohs, Ph., Hiptmair, R., Pintarelli, S., Tensor-Product Discretization for the Spatially Inhomogeneous and Transient Boltzmann Equation in Two Dimensions, SMAI-JCM, 3, (2017), 219-248, https://doi.org/10.5802/smai-jcm.26
  • Gusev, A.A., Optimum Microstructural Design of Coated Sphere Filled Viscoelastic Composites for Structural Noise and Vibration Damping Applications, Int. J. Solids Struct., 128, (2017), 1-10, https://doi.org/10.1016/j.ijsolstr.2017.07.005
  • Hample, A., Ederer, C., Interplay Between Breathing Mode Distortion and Magnetic Order in Rare-Earth Nickelates R NiO3 Within DFT+U, Phys. Rev. B, 96, 165130, (2017), https://doi.org/10.1103/PhysRevB.96.165130
  • Hernández-Valdés, D., Blanco-González, A., García-Fleitas, A., Rodríguez-Riera, Z., Meola, G., Alberto, R., Jáuregui-Haza, U., Insight into the Structure and Stability of Tc and Re DMSA Complexes: A Computational Study, J. Mol. Graph. Model., 71, (2017), 167-175, https://doi.org/10.1016/j.jmgm.2016.11.014
  • Hirsch, A.L., Wilhelm, M., Davin, E.L., Thiery, W., Seneviratne, S.I., Can Climate‐effective Land Management Reduce Regional Warming?, J. Geophys. Res. Atmos., 122, (2017), 2269-2288, https://doi.org/10.1002/2016JD026125
  • Küchlin, S., Jenny, P., Parallel Fokker–Planck-DSMC Algorithm for Rarefied Gas Flow Simulation in Complex Domains at All Knudsen Numbers, J. Comput. Phys., 328, (2017), 258-277, https://doi.org/10.1016/j.jcp.2016.10.018
  • Kumar, P.V., Norris, D.J., Tailoring Energy Transfer from Hot Electrons to Adsorbate Vibrations for Plasmon-Enhanced Catalysis, ACS Catal., 7(12), (2017), 8343-8350, https://doi.org/10.1021/acscatal.7b03174
  • Liang, S., Hemberger, P., Levalois-Grützmacher, J., Grützmacher, H., Gaan, S., Probing Phosphorus Nitride (P/N) and Other Elusive Species Formed upon Pyrolysis of Dimethyl Phosphoramidate, Chem. Eur. J., 23, (2017), 5595-5601, http://dx.doi.org/10.1002/chem.201700402
  • Lovecchio, E., Gruber, N., Münnich, M., Lachkar, Z., On the Long-Range Offshore Transport of Organic Carbon from the Canary Upwelling System to the Open North Atlantic, Biogeosciences, 14, (2017), 3337-3369, https://doi.org/10.5194/bg-14-3337-2017
  • Luciani, P. Estella-Hermoso de Mendoza, A., Casalini, T., Lang, S., Atrott, K., Spalinger, M.R., Pratsinis, A., Sobek, J., Frey-Wagner, I., Schumacher, J., Leroux, J.-Ch., Rogler, G., Gastroresistant Oral Peptide for Fluorescence Imaging of Colonic Inflammation, J. Control. Release, 262, (2017), 118-126, https://doi.org/10.1016/j.jconrel.2017.07.024
  • Maffei, S., Jackson, A., Livermore, Ph.W., Characterization of Columnar Inertial Modes in Rapidly Rotating Spheres and Spheroids, Proc. R. Soc. A, 473, 20170181, (2017), https://doi.org/10.1098/rspa.2017.0181
  • Marques, D.A., Lucek, K., Haesler, M.Ph., Feller, A.F., Meier, J.I., Wagner, C.E., Excoffier, L., Seehausen, O., Genomic Landscape of Early Ecological Speciation Initiated by Selection on Nuptial Colour, Mol. Ecol., 26(1), (2017), 7-24, https://doi.org/10.1111/mec.13774
  • Meier, J.I., Sousa, V.C., Marques, D.A., Selz, O.M., Wagner, C.E., Excoffier, L., Seehause, O., Demographic Modelling with Whole-Genome Data Reveals Parallel Origin of Similar Pundamilia Cichlid Species after Hybridization, Mol. Ecol., 26, (2017), 123-141, https://doi.org/10.1111/mec.13838
  • Muhich, Ch.L., Re-Evaluating CeO2 Expansion Upon Reduction: Noncounterpoised Forces, Not Ionic Radius Effects, Are the Cause, J. Phys. Chem. C, 121(14), (2017), 8052-8059, https://doi.org/10.1021/acs.jpcc.6b12373
  • Ott, F.D., Riedlinger, A., Ochsenbein, D.R., Knüsel, P.N., Erwin, S.C., Mazzotti, M, Norris, D.J., Ripening of Semiconductor Nanoplatelets, Nano. Lett., 17, (2017), 6870-6877, https://doi.org/10.1021/acs.nanolett.7b03191
  • Parmigiani, A., Degruyter, W., Leclaire, S., Huber, C., Bachmann, O., The Mechanics of Shallow Magma Reservoir Outgassing, Geochem. Geophys. Geosyst., 18, (2017), 2887-2905, https://doi.org/10.1002/2017GC006912
  • Pournaras, E., Brandt, B.-E., Thapa, M., Acharya, D., Espejo-Uribe, J., Ballandies, M., Helbing, D., SFINA - Simulation Framework for Intelligent Network Adaptations, Simul. Model. Pract. Th., 72, (2017), 34-50, https://doi.org/10.1016/j.simpat.2016.12.007
  • Prakash, M.K., Lang, B., Heinrich, H., Valli, P.V., Bauerfeind, P., Sonnenberg, A., Beerenwinkel, N., Misselwitz, B., CMOST: An Open-Source Framework for the Microsimulation of Colorectal Cancer Screening Strategies, BMC Med. Inform. Decis., 17, 80, (2017), https://doi.org/10.1186/s12911-017-0458-9
  • Riedinger, A., Ott, F.D., Mule, A., Mazzotti, S., Knüsel, P.N., Kress, S.J.P., Prins, F., Erwin, S.C., Norris, D.J., An Intrinsic Growth Instability in Isotropic Materials Leads to Quasi-Two-Dimensional Nanoplatelets, Nature Mater., 16, (2017), 743-748, https://doi.org/10.1038/nmat4889
  • Tan, Z., Schneider, T., Teixeira, J., Pressel, K.G., Large-Eddy Simulation of Subtropical Cloud-Topped Boundary Layers: 2. Cloud Response to Climate Change, J. Adv. Model. Earth Syst., 9, (2017), 19-38, https://doi.org/10.1002/2016MS000804
  • Thiery, W., Davin, E.L., Lawrence, D.M., Hirsch, A.L., Hauser, M., Seneviratne, S.I., Present‐day Irrigation Mitigates Heat Extremes, J. Geophys. Res. Atmos., 122, (2017), 1403-1422, https://doi.org/10.1002/2016JD025740

2016

  • Aschauer, U., Spaldin, N.A., Interplay Between Strain, Defect Charge State, and Functionality in Complex Oxides, Appl. Phys. Lett., 109, 031901, (2016), https://doi.org/10.1063/1.4958716
  • Greber, B.J., Gerhardy, S., Leitner, A., Leibundgut, M., Salem, M., Boheringer, D., Leulliot, N., Aebersold, R., Panse, V.G., Ban, N., Insertion of the Biogenesis Factor Rei1 Probes the Ribosomal Tunnel During 60S Maturation, Cell, 162, (2016), 91-102, https://doi.org/10.1016/j.cell.2015.11.027
  • Häner, T., Steiger, D.S., Troyer, M., High Performance Emulation of Quantum Circuits, SC16: International Conference for High Performance Computing, Networking, Storage and Analysis, (2016), 866-874, http://dx.doi.org/10.1109/SC.2016.73
  • Khan, T.A., Friedensohn, S., Gorter de Vries, A.R., Straszewski, J., Ruscheweyh, H.-J., Reddy, S.T., Accurate and Predictive Antibody Repertoire Profiling by Molecular Amplification Fingerprinting, Sci. Adv., 2(3), e1501371, (2016), https://doi.org/10.1126/sciadv.1501371
  • Lichtenbert, T., Golabek, G.J., Gerya, T.V., Meyer, M.R., The Effects of Short-Lived Radionuclides and Porosity on the Early Thermo-Mechanical Evolution of Planetesimals, Icarus, 274, (2016), 350-365, https://doi.org/10.1016/j.icarus.2016.03.004
  • Lichtenberg, T., Parker, R.J., Meyer, M.R., Isotopic Enrichment of Forming Planetary Systems from Supernova Pollution, MNRAS, 462, (2016), 3979-3992, https://doi.org/10.1093/mnras/stw1929
  • Mühlfellner, P., Bürki, M., Bosse, M., Derendarz, W., Philippsen, R., Furgale, P., Summary Maps for Lifelong Visual Localization, J. Field. Robot., 33(5), (2016), 561-590, https://doi.org/10.1002/rob.21595
  • Parmigiani, A., Faroughi, S., Huber, C., Bachmann, O., Su, Y., Bubble Accumulation and Its Role in the Evolution of Magma Reservoirs in the Upper Crust, Nature, 532, (2016), 492-495, https://doi.org/10.1038/nature17401
  • Saletti, M., Molnar, P., Hassan, M.A., Burlando, P., A Reduced-Complexity Model for Sediment Transport and Step-Pool Morphology, Earth Surf. Dynam., 4, (2016), 549-566, https://doi.org/10.5194/esurf-4-549-2016
  • Sclauzero, G., Dymkowski, K., Ederer, C., Tuning the Metal-Insulator Transition in d1 and d2 Perovskites by Epitaxial Strain: A First-Principles-Based Study, Phys. Rev. B, 94, 245109, (2016), https://doi.org/10.1103/PhysRevB.94.245109
  • Skjærvø, S.H., Wefring, E.T., Nesdal, S.K., Gaukås, N.H., Interstitial Oxygen as a Source of p-Type Conductivity in Hexagonal Manganites, Nat. Commun., 7, (2016), 13745, https://doi.org/10.1038/ncomms13745
  • Tan, Z.H., Schneider, T., Teixeira, J., Pressel, K.G., Large‐eddy Simulation of Subtropical Cloud‐topped Boundary Layers: 1. A Forcing Framework with Closed Surface Energy Balance, J. Adv. Model. Earth Syst., 8, (2016), 1565-1585, https://doi.org/10.1002/2016MS000655
  • Tirla, A., Rivera-Fuentes, P., Development of a Photoactivatable Phosphine Probe for Induction of Intracellular Reductive Stress with Single‐Cell Precision, Angew. Chem. Int. Ed., 55 (2016), 14709-14712, https://doi.org/10.1002/anie.201608779
  • Turi, G., Lachkar, Z., Gruber, N., Münnich, M., Climatic Modulation of Recent Trends in Ocean Acidification in the California Current System, Environ. Res. Lett., 11, 014007, (2016), https://doi.org/10.1088/1748-9326/11/1/014007
  • Wills, R.C., Schneider, T., How Stationary Eddies Shape Changes in the Hydrological Cycle: Zonally Asymmetric Experiments in an Idealized GCM, J. Climate, 29(9), (2016), 3161-3179, https://doi.org/10.1175/JCLI-D-15-0781.1

2015

  • Frischknecht, M., Münnich, M., Gruber, N., Remote Versus Local Influence of ENSO on the California Current System, J. Geophys. Res. Oceans, 120, (2015), 1353-1374, https://doi.org/10.1002/2014JC010531
  • Katzgraber, H.G., Hamze, F., Zhu, Zh., Ochoa, A.J.,, Munoz-Bauza, H., Seeking Quantum Speedup Through Spin Glasses: The Good, the Bad, and the Ugly, Phys. Rev. X, 5, 031026, (2015), https://doi.org/10.1103/PhysRevX.5.031026
  • Wang, W., Machta, J., Katzgraber, H.G., Comparing Monte Carlo Methods for Finding Ground States of Ising Spin Glasses: Population Annealing, Simulated Annealing, and Parallel Tempering, Phys. Rev. B, 92, 013303, (2015), https://doi.org/10.1103/PhysRevE.92.013303

2014

  • Wang, W., Machta, J., Katzgraber, H.G., Evidence Against a Mean-Field Description of Short-Range Spin Glasses Revealed Through Thermal Boundary Conditions, Phys. Rev. B, 90, 184412, (2014), https://doi.org/10.1103/PhysRevB.90.184412

Leonhard Open cluster (2017-2021) sorted by year

2022

  • Liu, M., Gerya, T., Rozel, A.B., Self-Organization of Magma Supply Controls Crustal Thickness Variation and Tectonic Pattern Along Melt-Poor Mid-Ocean Ridges, Earth Planet. Sci. Lett., 584, 117482, (2022), https://doi.org/10.1016/j.epsl.2022.117482

2021

  • Balázs, A., Faccenna, C., Kosuke, U., Funiciello, F., Boutoux, A., Blanc, E. J.-P., Gerya, T., Oblique Subduction and Mantle Flow Control on Upper Plate Deformation: 3D Geodynamic Modeling, Earth Planet. Sci. Lett., 569, 117056, (2021), https://doi.org/10.1016/j.epsl.2021.117056
  • Crysnanto, D., Leonhard, A.S., Fang, Z.-H., Pausch, H., Novel Functional Sequences Uncovered Through a Bovine Multiassembly Graph, PNAS, 118(20), (2020), e2101056118, https://doi.org/10.1073/pnas.2101056118
  • Gökmen, D.E., Ringel, Z., Huber, S.D., Koch-Janusz, M., Symmetries and Phase Diagrams with Real-Space Mutual Information Neural Estimation, Phys. Rev. E, 104, 064106, (2021), https://doi.org/10.1103/PhysRevE.104.064106
  • Jiménez-Luna, J., Skalic, M., Weskamp, N., Schneider, G., Coloring Molecules with Explainable Artificial Intelligence for Preclinical Relevance Assessment, J. Chem., Inf. Model., 61, (2021), 1083-1094, https://doi.org/10.1021/acs.jcim.0c01344

2020

  • Alexeev, D., Amoudrouz, L., Litvinov, S., Koumoutsakos, P., Mirheo: High-Performance Mesoscale Simulations for Microfluidics, Comput. Phys. Commun., 254, 107298, (2020), https://doi.org/10.1016/j.cpc.2020.107298
  • Jaskolowski, M., Ramrath, D.J.F., Bieri, P., Niemann, M., Mattei, S., Calderaro, S., Leibundgut, M., Horn, E.K., Böhringer, D., Schneider, A., Ban, N., Structural Insights into the Mechanism of Mitoribosomal Large Subunit Biogenesis, Mol. Cell, 79, (2020), 629-644, https://doi.org/10.1016/j.molcel.2020.06.030
  • Mattei, S., Ban, A., Picenoni, A., Leibundgut, M., Glockshuber, R., Böhringer, D., Structure of Native Glycolipoprotein Filaments in Honeybee Royal Jelly, Nat. Commun., 11, 6267, (2020), https://doi.org/10.1038/s41467-020-20135-x
  • Preuss, S., Ampuero, J.P., Gerya, T., van Dinther, Y., Characteristics of Earthquake Ruptures and Dynamic Off-Fault Deformation on Propagating Faults, Solid Earth, 11, (2020), 1333-1360, https://doi.org/10.5194/se-11-1333-2020
  • Sanan, P., May, D.A., Bollhöfer, M., Schenk, O., Pragmatic Solvers for 3D Stokes and Elasticity Problems with Heterogeneous Coefficients: Evaluating Modern Incomplete LDLT Preconditioners, Solid Earth, 11, (2020), https://doi.org/10.5194/se-11-2031-2020
  • Yan, J., Ballmer, M.D., Tackley, P.J., The Evolution and Distribution of Recycled Oceanic Crust in the Earth's Mantle: Insight from Geodynamic Models, Earth Planet. Sci. Lett., 537, 116171, (2020), https://doi.org/10.1016/j.epsl.2020.116171

2019

  • Milanese, A., Mende, D.R., Paoli, L., Salazar, G., Ruscheweyh, H.-J., Cuenca, M., Hingamp, P., Alves, R., Costea, P.I, Coelho, L.P., Schmidt, T.S.B., Almeida, A., Mitchell, A.L., Finn, R.D., Huearta-Cepas, J., Bork, P., Zeller, G., Sunagawa, S., Microbial abundance, activity and population of genomic profiling with mOTUs2, Nat. Commun., 10, 1014, (2019), https://doi.org/10.1038/s41467-019-08844-4
  • Perraudin, N., Srivastava, A., Lucchi, A., Kacprzak, T., Hofmann, Th., Réfrégier, A., Cosmological N-Body Simulations: A Challenge for Scalable Generative Models, Comput. Astrophys. Cosmol., 6, 5, (2019), https://doi.org/10.1186/s40668-019-0032-1
  • Preuss, S., Herrendörfer, R. Gerya, T., Ampuero, J.-P., van Dinther, Y., Seismic and Aseismic Fault Growth Lead to Different Fault Orientations, J. Geophys. Res. Sol. Ea., 124, (2019), 8867-8889, https://doi.org/10.1029/2019JB017324

2018

  • Rodríguez, A.C., Kacprzak, T., Lucchi, A., Amara, A., Sgier, R., Fluri, J., Hofmann, Th., Réfrégier, A., Fast Cosmic Web Simulations With Generative Adversarial Networks, Comput. Astrophys. Cosmol., 5, 4, (2018), https://doi.org/10.1186/s40668-018-0026-4

Brutus cluster (2007-2016) sorted by year

2021

2020

  • Bakowies, D., Estimating Systematic Error and Uncertainty in Ab Initio Thermochemistry: II. ATOMIC(hc) Enthalpies of Formation for a Large Set of Hydrocarbons, J. Chem. Theory Comput., 16, (2020), 399-426, https://doi.org/10.1021/acs.jctc.9b00974
  • Kries, H., Bloch, J.S., Bunzel, H.A., Pinkas, D.M., Hilvert, D., Contribution of Oxyanion Stabilization to Kemp Eliminase Efficiency, ACS Catal., 10(8), (2020), 4460-4464, https://doi.org/10.1021/acscatal.0c00575
  • Piluski, M., Shiroka, T., Casola, F., Reyes, A.P., Kuhns, Ph.L., Wang, Sh., Ott, H.-R., Mesot, J., Two Coupled Chains Are Simpler Than One: Field-Induced Chirality in a Frustrated Spin Ladder, Sci. Rep., 10, 15862, (2020), https://doi.org/10.1038/s41598-020-72215-z
  • Rellstab, Ch., Zoller, S., Sailer, Ch., Tedder, A., Gugerli, F., Shimizu, K.K., Holderegger, R., Widmer, A., Fischer, M.C., Genomic Signatures of Convergent Adaptation to Alpine Environments in Three Brassicaceae Species, Mol. Ecol., 29(22), (2020), 4350-4365, https://doi.org/10.1111/mec.15648
  • Rocca, R., Palazzesi, F., Amato, J., Costa, G., Ortuso, F., Pagano, B., Randazzo, A., Novellino, E., Alcaro, S., Moraca, F., Artese, A., Folding Intermediate States of the Parallel Human Telomeric G-Quadruplex DNA Explored Using Well-Tempered Metadynamics, Sci. Rep., 10, 3176, (2020), https://doi.org/10.1038/s41598-020-59774-x

2019

  • Bakowies, D., Estimating Systematic Error and Uncertainty in Ab Initio Thermochemistry. I. Atomization Energies of Hydrocarbons in the ATOMIC(hc) Protocol, J. Chem. Theory Comput., 15, (2019), 5230-5251, https://doi.org/10.1021/acs.jctc.9b00343
  • Beaussier, S.J., Gerya, T.V., Burg, J.-P., Near-Ridge Initiation of Intraoceanic Subduction: Effects of Inheritance in 3D Numerical Models of the Wilson Cycle, Tectonophysics, 763, (2019), 1-13, https://doi.org/10.1016/j.tecto.2019.04.011
  • Galinski, H., Wyss, A., Seregni, M., Ma, H., Schnabel, V., Sologubenko, A., Spolenak, R., Disordered Zero-Index Metamaterials Based on Metal-Induced Crystallization, NPG Asia Mater., 11, 58, (2019), https://doi.org/10.1038/s41427-019-0157-3
  • Gülcher, A.J.P., Beaussier, S.J., Gerya, T.V., On the Formation of Oceanic Detachment Faults and Their Influence on Intra-Oceanic Subduction Initiation: 3D Thermomechanical Modeling, Earth Planet. Sci. Lett., 506, (2019), 195-208, https://doi.org/10.1016/j.epsl.2018.10.042
  • Núñez Valdez, M., Spaldin, N.A., Origin and Evolution of Ferroelectricity in the Layered Rare-Earth-Titanate, R2Ti2O7, Carpy-Galy phases, Polyhedron, 171, (2019), 181-192, https://doi.org/10.1016/j.poly.2019.07.018
  • Sheng, J., Li, C., Liao, J., Yang, Z., Jian, Sh., Dynamics of Back-Arc Extension Controlled by Subducting Slab Retreat: Insights from 2D Thermo-Mechanical Modelling, Geol. J., 54(6), (2019), 3376-3388, https://doi.org/10.1002/gj.3336
  • Sizova, E., Hauzenberger, C., Fritz, H., Faryad, S.W., Gerya, T., Late Orogenic Heating of (Ultra)High Pressure Rocks: Slab Rollback vs. Slab Breakof, Geosciences, 9(12), 499, (2019), https://doi.org/10.3390/geosciences9120499

2018

  • de Groot, R., Lüthi, J., Lindsay, H., Holtackers, R., Pelkmans, L., Large-Scale Image-Based Profiling of Single-Cellphenotypes in Arrayed CRISPR-Cas9 Gene Perturbation Screens, Mol. Syst. Biol., 14, e8064, (2018), https://doi.org/10.15252/msb.20178064
  • Popovic, D., Koch, B., Kueblbeck, M., Ellenberg, J., Pelkmans, J., Multivariate Control of Transcript to Protein Variability in Single Mammalian Cells, Cell Systems, 7, (2018), 398-411, https://doi.org/10.1016/j.cels.2018.09.001
  • Roche, V., Sternai, P., Guillou-Frottier, L., Menant, A., Jolivet, L., Bouchot, V., Gerya, T., Emplacement of Metamorphic Core Complexes and Associated Geothermal Systems Controlled by Slab Dynamics, Earth Planet. Sci. Lett., 498, (2018), 322-333, https://doi.org/10.1016/j.epsl.2018.06.043
  • Santos-Cottin, D., Klein, P., Werner, Ph., Miyake, T., de' Medici, L., Gauzzi, A., Lobo, R.P.S.M., Casula, M., Linear Behavior of the Optical Conductivity and Incoherent Charge Transport in BaCoS2, Phys. Rev. Materials, 2, 105001, (2018), https://doi.org/10.1103/PhysRevMaterials.2.105001
  • Scaramucci, A., Shinaoka, H., Mostovoy, M.V., Müller, M., Mudry, C., Troyer, M., Spaldin, N.A., Multiferroic Magnetic Spirals Induced by Random Magnetic Exchanges, Phys. Rev. X, 8, 011005, (2018), https://doi.org/10.1103/PhysRevX.8.011005
  • Schilling, Ch., Altunbulak, M., Knecht, S., Lopes, A., Whitfield, J.D., Christandl, M., Gross, D., Reiher, M., Generalized Pauli constraints in small atoms, Phys. Rev. A, 97, 052503, (2018), https://doi.org/10.1103/PhysRevA.97.052503
  • Sizova, E., Gerya, T., Brown, M., Stüwe, K., What Drives Metamorphism in Early Archean Greenstone Belts? Insights from Numerical Modeling, Tectonophysics, 746, (2018), 587-601, https://doi.org/10.1016/j.tecto.2017.07.020
  • Vogt, K., Willingshofer, E., Matenco, L., Sokoutis, D., Gerya, T., Cloetingh, S., The Role of Lateral Strength Contrasts in Orogenesis: A 2D Numerical Study, Tectonophysics, 746, (2018), 549-561, https://doi.org/10.1016/j.tecto.2017.08.010
  • Wu, S., Angelikopoulos, P., Papadimitriou, C., Koumoutsakos, P., Bayesian Annealed Sequential Importance Sampling: An Unbiased Version of Transitional Markov Chain Monte Carlo, ASME J. Risk Uncertainty Part B, 4(1), 011008, (2018), https://doi.org/10.1115/1.4037450
  • Yan, H.J., Casalini, T., Hulsart-Billström, G., Wang, S., Oommen O.P., Salvalaglio, M., Larsson, S., Hilborn, J., Varghese, O.P., Synthetic Design of Growth Factor Sequestering Extracellular Matrix Mimetic Hydrogel for Promoting in Vivo Bone Formation, Biomaterials, 161, (2018), 190-202, https://doi.org/10.1016/j.biomaterials.2018.01.041

2017

  • Andersen, J.C., Katzgraber, H.G., Schechter, M., Random-Field-Induced Disordering Mechanism in a Disordered Ferromagnet: Between the Imry-Ma and the Standard Disordering Mechanism, Phys. Rev. B, 96, 214414, (2017), https://doi.org/10.1103/PhysRevB.96.214414
  • Balsara, D.S., Käppeli, R., Von Neumann Stability Analysis of Globally Divergence-Free RKDG Schemes for the Induction Equation Using Multidimensional Riemann Solvers, J. Comput. Phys., 336, (2017), 104-127, https://doi.org/10.1016/j.jcp.2017.01.056
  • Bartl, J., Palazzesi, F., Parrinello, M., Hommers, L., Riederer, P., Walitza, S., Grünblatt, E., The Impact of Methylphenidate and Its Enantiomers on Dopamine Synthesis and Metabolism In Vitro, Prog. Neuropsychopharmacol. Biol. Psychiatry, 79(B), (2017), 281-288, https://doi.org/10.1016/j.pnpbp.2017.07.002
  • Charrier, D.E., May, D.A., Schnepp, S.M., Symmetric Interior Penalty Discontiuous Galerkin Discretizations and Block Preconditioning for Heterogeneous Stokes Flow, SIAM J. Sci. Comput., 39(6), (2017), B1021-B1042, https://doi.org/10.1137/16M1084912
  • Chowdhury, P., Gerya, T., Chakraborty, S., Emergence of Silicic Continents as the Lower Crust Peels Off on a Hot Plate-Tectonic Earth, Nature Geosci., 10, (2017), 698-703, https://doi.org/10.1038/ngeo3010
  • Custodis, V.B.F., Hemberger, P., van Bokhoven, J.A., How Inter- and Intramolecular Reactions Dominate the Formation of Products in Lignin Pyrolysis, Chem. Eur. J., 23, (2017), 8658-8668, https://doi.org/10.1002/chem.201700639
  • Doppelbauer, M.J., Schullian, O, Loreau, J., Vaeck, N., van der Avoird, A., Rennick, C.J., Softley, T.P., Heazlewood, B.R., Using a Direct Simulation Monte Carlo Approach to Model Collisions in a Buffer Gas Cell, J. Chem. Phys., 146, 044302, (2017), https://doi.org/10.1063/1.4974253
  • Dorostkar, O., Guyer, R.A., Johnson, P.A., Marone, Ch., Carmeliet, J., On the Role of Fluids in Stick-Slip Dynamics of Saturated Granular Fault Gouge Using a Coupled Computational Fluid Dynamics-Discrete Element Approach, J. Geophys. Res. Sol. Ea., 122, (2017), 3689–3700, http://dx.doi.org/10.1002/2017JB014099
  • Duprat-Oualid, S., Yamato, Ph., On the Meaning of Peak Temperature Profiles in Inverted Metamorphic Sequences, Geophys. J. Int., 210, (2017), 130-147, https://doi.org/10.1093/gji/ggx129
  • Gamboa-Carballo, J.J., Rana, V.K., Levalois-Grützmacher, J., Gaspard, S., Jáuregui-Haza, U., Structures and Stabilities of Naturally Occurring Cyclodextrins: a Theoretical Study of Symmetrical Conformers, J. Mol. Model., 23(11), 318, (2017), https://doi.org/10.1007/s00894-017-3488-4
  • Giberti, F., Salvalaglio, M., Mazzotti, M., Parrinello, M., 1,3,5-tris(4-bromophenyl)-benzene Nucleation: From Dimers to Needle-like Clusters, Cryst. Growth Des., 17(8), (2017), 4137-4143, https://doi.org/10.1021/acs.cgd.7b00410
  • Gusev, A.A., Optimum Microstructural Design of Coated Sphere Filled Viscoelastic Composites for Structural Noise and Vibration Damping Applications, Int. J. Solids Struct., 128, (2017), 1-10, https://doi.org/10.1016/j.ijsolstr.2017.07.005
  • Hernández-Valdés, D., Blanco-González, A., García-Fleitas, A., Rodríguez-Riera, Z., Meola, G., Alberto, R., Jáuregui-Haza, U., Insight into the Structure and Stability of Tc and Re DMSA Complexes: A Computational Study, J. Mol. Graph. Model., 71, (2017), 167-175, https://doi.org/10.1016/j.jmgm.2016.11.014
  • Kamer, Y., Kissling, E., Ouillon, G., Sornette, D., KaKiOS‐16: A Probabilistic, Nonlinear, Absolute Location Catalog of the 1981–2011 Southern California Seismicity, B. Seismol. Soc. Am., 107(5), (2017), 1994-2007, https://doi.org/10.1785/0120160146
  • Kelevitz, K., Houlié, N., Giardini, D., Rothacher, M., Performance of High‐Rate GPS Waveforms at Long Periods: Moment Tensor Inversion of the 2003 Mw 8.3 Tokachi‐Oki Earthquake, B. Seismol. Soc. Am., 107(4), (2017), 1891-1903, https://doi.org/10.1785/0120160338
  • Keller, T., Katz, R.F., Hirschmann, M.M., Volatiles Beneath Mid-Ocean Ridges: Deep Melting, Channelised Transport, Focusing, and Metasomatism, Earth Planet. Sci. Lett., 465, (2017), 55-68, https://doi.org/10.1016/j.epsl.2017.02.006
  • Kulakova, L., Arampatzis, G., Angelikopoulos, P., Hadjidoukas, P., Papadimitriou, C., Koumoutsakos, P., Data Driven Inference for the Repulsive Exponent of the Lennard-Jones Potential in Molecular Dynamics Simulations, Sci. Rep., 7, 16576, (2017), https://doi.org/10.1038/s41598-017-16314-4
  • Kumar, P.V., Norris, D.J., Tailoring Energy Transfer from Hot Electrons to Adsorbate Vibrations for Plasmon-Enhanced Catalysis, ACS Catal., 7(12), (2017), 8343-8350, https://doi.org/10.1021/acscatal.7b03174
  • Luciani, P. Estella-Hermoso de Mendoza, A., Casalini, T., Lang, S., Atrott, K., Spalinger, M.R., Pratsinis, A., Sobek, J., Frey-Wagner, I., Schumacher, J., Leroux, J.-Ch., Rogler, G., Gastroresistant Oral Peptide for Fluorescence Imaging of Colonic Inflammation, J. Control. Release, 262, (2017), 118-126, https://doi.org/10.1016/j.jconrel.2017.07.024
  • Muhich, Ch.L., Re-Evaluating CeO2 Expansion Upon Reduction: Noncounterpoised Forces, Not Ionic Radius Effects, Are the Cause, J. Phys. Chem. C, 121(14), (2017), 8052-8059, https://doi.org/10.1021/acs.jpcc.6b12373
  • Ni, Q.Z., Markhasin, E., Can, T.V., Corzilius, B., Tan, K.O., Barnes, A.B., Daviso, E., Su, Y., Herzfeld, J., Griffin, R.G., Peptide and Protein Dynamics and Low-Temperature/DNP Magic Angle Spinning NMR, J. Phys. Chem. B, 121(19), (2017), 4997-5006, https://doi.org/10.1021/acs.jpcb.7b02066
  • Pelliciari, J., Huang, Y., Ishii, K., Zhang, C., Dai, P., Chen, G.F., Xing, L., Wang, X., Jin, C., Ding, H., Werner, Ph., Schmitt, T., Magnetic Moment Evolution and Spin Freezing in Doped BaFe2As2, Sci. Rep., 7, 8003, (2017), https://doi.org/10.1038/s41598-017-07286-6
  • Pournaras, E., Brandt, B.-E., Thapa, M., Acharya, D., Espejo-Uribe, J., Ballandies, M., Helbing, D., SFINA - Simulation Framework for Intelligent Network Adaptations, Simul. Model. Pract. Th., 72, (2017), 34-50, https://doi.org/10.1016/j.simpat.2016.12.007
  • Prakash, M.K., Lang, B., Heinrich, H., Valli, P.V., Bauerfeind, P., Sonnenberg, A., Beerenwinkel, N., Misselwitz, B., CMOST: An Open-Source Framework for the Microsimulation of Colorectal Cancer Screening Strategies, BMC Med. Inform. Decis., 17, 80, (2017), https://doi.org/10.1186/s12911-017-0458-9
  • Rosenberger, G., Liu, Y., Röst, H.L., Ludwig, Ch., Buil, A., Bensimon, A., Soste, M., Spector, T.D., Dermitzakis, E.T., Collins, B.C., Malmström, L., Aebersold, R., Inference and Quantification of Peptidoforms in Large Sample Cohorts by SWATH-MS, Nat. Biotech., 35, (2017), 781-788, https://doi.org/10.1038/nbt.3908
  • Schopfer, S., Tiefenbeck, V., Fleisch, E., Staake, Th., Providing Primary Frequency Control with Residential scale Photovoltaic-Battery Systems, Comput. Sci. Res. Dev., 32, (2017), 105-115, https://doi.org/10.1007/s00450-016-0318-3
  • Verona, M.D., Verdolino, V., Palazzesi, F.., Corradini, R., Focus on PNA Flexibility and RNA Binding Using Molecular Dynamics and Metadynamics, Sci. Rep., 7, 42799, (2017), https://doi.org/10.1038/srep42799
  • Vogt, K., Matenco, L., Cloetingh, S., Crustal Mechanics Control the Geometry of Mountain Belts. Insights from Numerical Modelling, Earth Planet. Sci. Lett., 460, (2017), 12-21, https://doi.org/10.1016/j.epsl.2016.11.016

2016

  • Andresen, J.C., Pramudya, Y., Katzgraber, H.G., Thomas, C.K., Zimanyi, G.T., Dobrosavljevic, V., Charge Avalanches and Depinning in the Coulomb Glass: The Role of Long-Range Interactions, Phys. Rev. B, 93, 094429, (2016), https://doi.org/10.1103/PhysRevB.93.094429
  • Andrist, R.S., Katzgraber, H.G., Bombin, H., Martin-Delgado, M.A., Error Tolerance of Topological Codes with Independent Bit-Flip and Measurement Errors, Phys. Rev. A, 94, 012318, (2016), https://doi.org/10.1103/PhysRevA.94.012318
  • Aspelmeier, T., Katzgraber, H.G., Larson, D., Moore, M.A., Wittmann, M., Yeo, J., Finite-Size Critical Scaling in Ising Spin Glasses in the Mean-Field Regime, Phys. Rev. E, 93, 032123, (2016), https://doi.org/10.1103/PhysRevE.93.032123
  • Berry, T.M., Defraeye, T., Nicolaï, B.M., Opara, U.L., Multiparameter Analysis of Cooling Efficiency of Ventilated Fruit Cartons using CFD: Impact of Vent Hole Design and Internal Packaging, Food Bioprocess Technol., 9(9), (2016), 1481-1493, https://doi.org/10.1007/s11947-016-1733-y
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  • Gupta, A., Hepp, B., Khammash, M., Noise Induces the Population-Level Entrainment of Incoherent, Uncoupled Intracellular Oscillators, Cell Systems, 3(6), (2016), 521-531, https://doi.org/10.1016/j.cels.2016.10.006
  • Hässig, M., Duretz, T., Rolland, Y., Sosson, M., Obduction of Old Oceanic Lithosphere Due to Reheating and Plate Reorganization: Insights from Numerical Modelling and the NE Anatolia – Lesser Caucasus Case Example, J. Geodyn., 96, (2016), 35-49, https://doi.org/10.1016/j.jog.2016.02.007
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  • Khan, A., van Driel, M., Böse, M., Giardini, D., Ceylan, S., Yan, J., Clinton, J., Euchner, F., Lognonné, P., Murdoch, N., Mimoun, D., Panning, M., Knapmeyer, M., Banerdt, W.B., Single-Station and Single-Event Marsquake Location and Inversion for Structure Using Synthetic Martian Waveforms, Phys. Earth Planet. In., 258, (2016), 28-42, https://doi.org/10.1016/j.pepi.2016.05.017
  • Kim, J.A., Casalini, T., Brambilla, D., Leroux, J.-C., Presumed LRP1-Targeting Transport Peptide Delivers β-Secretase Inhibitor to Neurons in Vitro with Limited Efficiency, Sci. Rep., 6, 34297, (2016), https://doi.org/10.1038/srep34297
  • Kruglyakov, M., Geraskin, A., Kuvshinov, A., Novel Accurate and Scalable 3-D MT Forward Solver Based on a Contracting Integral Equation Method, Comp. Geosci., 96, (2016), 208-217, https://doi.org/10.1016/j.cageo.2016.08.017
  • Li, Y., Deschamps, F., Tackley, P.J., Small Post‐perovskite Patches at the Base of Lower Mantle Primordial Reservoirs: Insights from 2‐D Numerical Modeling and Implications for ULVZs, Geophys. Res. Lett., 43, (2016), 3215-3225, https://doi.org/10.1002/2016GL067803
  • Lichtenbert, T., Golabek, G.J., Gerya, T.V., Meyer, M.R., The Effects of Short-Lived Radionuclides and Porosity on the Early Thermo-Mechanical Evolution of Planetesimals, Icarus, 274, (2016), 350-365, https://doi.org/10.1016/j.icarus.2016.03.004
  • Lichtenberg, T., Parker, R.J., Meyer, M.R., Isotopic Enrichment of Forming Planetary Systems from Supernova Pollution, MNRAS, 462, (2016), 3979-3992, https://doi.org/10.1093/mnras/stw1929
  • McCarty, J., Valsson, O., Parrinello, M., Bespoke Bias for Obtaining Free Energy Differences within Variationally Enhanced Sampling, J. Chem. Theory Comput., 12(5), (2016), 2162-2169, https://doi.org/10.1021/acs.jctc.6b00125
  • Milias-Argeitis, A., Oliveira, A.P., Gerosa, L., Falter, L., Sauer, U., Lygeros, J., Elucidation of Genetic Interactions in the Yeast GATA-Factor Network Using Bayesian Model Selection, PLoS Comput. Biol., 12(3), e1004784, https://doi.org/10.1371/journal.pcbi.1004784
  • Núñes Valdez, M., Spanke, H. Th., Spaldin, N.A., Ab Initio Study of the Ferroelectric Strain Dependence and 180° Domain Walls in the Barium Metal Fluorides BaMgF4 and BaZnF4, Phys. Rev. B, 93, 064112, (2016), https://doi.org/10.1103/PhysRevB.93.064112
  • Oreshenko, M., Heng, K., Demory, B.-O., Optical Phase Curves as Diagnostics for Aerosol Composition in Exoplanetary Atmospheres, MNRAS, 457, (2016), 3420-3429, https://doi.org/10.1093/mnras/stw133
  • Orts, J., Wälti, M.A., Marsh, M., Vera, L., Gossert, A.D., Güntert, P., Riek, R., NMR-Based Determination of the 3D Structure of the Ligand–Protein Interaction Site without Protein Resonance Assignment, J. Am. Chem. Soc., 138(13), (2016), 4393-4400, https://doi.org/10.1021/jacs.5b12391
  • Poulikakos, L.V., Gutsche, Ph., McPeak, K.M., Burger, S., Niegemann, J., Hafner, C., Norris, D.J., Optical Chirality Flux as a Useful Far-Field Probe of Chiral Near Fields, ACS Photonics, 3(9), (2016), 1619-1625, https://doi.org/10.1021/acsphotonics.6b00201
  • Ruminy, M., Núñez Valdez, B., Wehringer, B., Bosak, A., Adroja, D.T., Stuhr, U., Iida, K., Kamazawa, K., Pomjakushina, E., Prabakharan, D., Haas, M.K., Bovo, L., Sheptyakov, D., Cervellino, A., Cava, R.J., Kenzelmann, M., Spaldin, N.A., Fennel, T., First-Principles Calculation and Experimental Investigation of Lattice Dynamics in the Rare-Earth Pyrochlores R2Ti2O7 (R=Tb,Dy,Ho), Phys. Rev. B, 93', 214308, (2016), https://doi.org/10.1103/PhysRevB.93.214308
  • Salvalaglio, M., Tiwary, P., Maggioni, G.M., Mazzotti, M., Parrinello, M., Overcoming Time Scale and Finite Size Limitations to Compute Nucleation Rates from Small Scale Well Tempered Metadynamics Simulations, J. Chem. Phys., 145, 211925, https://doi.org/10.1063/1.4966265
  • Schmidiger, D., Povarov, K.Y., Galeski, S., Reynolds, N., Bewley, R., Guidi, T., Ollivier, J., Zheludev, A., Emergent Interacting Spin Islands in a Depleted Strong-Leg Heisenberg Ladder, Phys. Rev. Lett., 116, 257203, (2016), https://doi.org/10.1103/PhysRevLett.116.257203
  • Shao, Sh., Guo, T., Gross, V., Lazare, A., Koh, Ch.Ch., Gillessen, S., Joerger, M., Jochum, W., Aebersold, R., Reproducible Tissue Homogenization and Protein Extraction for Quantitative Proteomics Using MicroPestle-Assisted Pressure-Cycling Technology, J. Proteome Res., 15(6), (2016), 1821-1829, https://doi.org/10.1021/acs.jproteome.5b01136
  • Sheng, J., Liao, J., Gerya, T., Numerical Modeling of Deep Oceanic Slab Dehydration: Implications for the Possible Origin of Far Field Intra-Continental Volcanoes in Northeastern China, J. Asian Earth Sc., 116, (2016), 328-336, https://doi.org/10.1016/j.jseaes.2015.12.022
  • Turi, G., Lachkar, Z., Gruber, N., Münnich, M., Climatic Modulation of Recent Trends in Ocean Acidification in the California Current System, Environ. Res. Lett., 11, 014007, (2016), https://doi.org/10.1088/1748-9326/11/1/014007
  • Valla, M., Wischert, R., Comas-Vives, A., Conley, M.P., Verel, R., Copéret, Ch., Sautet, Ph., Role of Tricoordinate Al Sites in CH3ReO3/Al2O3 Olefin Metathesis Catalysts, J. Am. Chem. Soc., 138(21), (2016), 6774-6785, https://doi.org/10.1021/jacs.6b00447
  • Zintchenko, I., Wang, L., Troyer, M., Ferromagnetism of the Repulsive Atomic Fermi Gas: Three-Body Recombination and Domain Formation, Eur. Phys. J. B, 89, 180, (2016), https://doi.org/10.1140/epjb/e2016-70302-5

2015

  • Altantzis, C., Frouzakis, C.E., Tomboulides, A.G., Boulouchos, K., Direct Numerical Simulation of Circular Expanding Premixed Flames in a Lean Quiescent Hydrogen-Air Mixture: Phenomenology and Detailed Flame Front Analysis, Combust. Flame, 162, (2015), 331-344, https://doi.org/10.1016/j.combustflame.2014.08.005
  • Bellafard, A., Chakravarty, S., Troyer, M., Katzgraber, H.G., The Effect of Quenched Bond Disorder on First-Order Phase Transitions, Ann. Phys., 357, (2015), 66-78, https://doi.org/10.1016/j.aop.2015.03.026
  • Brambilla, A., Schultze, M., Frouzakis, C.E., Mantzaras, J., Bombach, R., Boulouchos, K., An Experimental and Numerical Investigation of Premixed Syngas Combustion Dynamics in Mesoscale Channels with Controlled Wall Temperature Profiles, P. Combus. Inst., 35, (2015), 3429-3437, https://doi.org/10.1016/j.proci.2014.06.131
  • Chang, C., Busha, M.T., Wechsler, R.H., Refregier, A., Amara, A., Rykoff, E., Becker, M.R., Bruderer, C., Gamper, L., Leistedt, B., Peiris, H., Abbott, T., Abdalla, F.B., Balbinot, E., Banerji, M., Bernstein, R.A., Bertin, E., Brooks, D., Carnero, A., Desai, S, da Costa, L.N., Cunha, C.E., Eifler, T., Evrard, A.E., Fausti Neto, A., Gerdes, D., Gruen, D., James, D., Kuehn, K., Maia, M.A.G., Makler, M., Ogando, R., Plazas, A., Sanchez, E., Santiago, B., Schubnell, M., Sevilla-Noarbe, I., Smith, C., Soares-Santos, M., Suchyta, E., Swanson, M.E.C., Tarle, G., Zuntz, J., Modelling the Transfer Function for the Dark Energy Survey, ApJ, 801, (2015), 73
  • Colombo, C., Gatti, S., Ferrari, R., Casalini, T., Cuccato, D., Morosi, L., Zucchetti, M., Moscatelli, D., Self-Assembling Amphiphilic PEGylated Block Copolymers Obtained through RAFT Polymerization for Drug-Delivery Applications, J. Appl. Polym. Sci., 133, 43084, (2015), https://doi.org/10.1002/app.43084
  • Crameri, F., Tackley, P.J., Parameters Controlling Dynamically Self-Consistent Plate Tectonics and Single-Sided Subduction in Global Models of Mantle Convection, J. Geophys. Res. Sol. Ea., 120, (2015), 3680-3706, https://doi.org/10.1002/2014JB011664
  • Duprat-Oualid, S., Yamato, Ph., Schmalholz, S.M., A Dimensional Analysis to Quantify the Thermal Budget Around Lithospheric-Scale Shear Zones, Terra Nova, 27, (2015), 163-168, https://doi.org/10.1111/ter.12144
  • Frouzakis, C.E., Fogla, N., Tomboulides, A.G., Altantzis, C., Matalon, M., Numerical Study of Unstable Hydrogen/air Flames: Shape and Propagation Speed, P. Combus. Inst., 35(1), 1087-1095, https://doi.org/10.1016/j.proci.2014.05.132
  • Furler, Ph., Steinfeld, A., Heat Transfer and Fluid Flow Analysis of a 4 kW Solar Thermochemical Reactor for Ceria Redox Cycling, Chem. Eng. Sci., 137, (2015), 373-383, https://doi.org/10.1016/j.ces.2015.05.056
  • Gerya, T.V., Stern, R.J., Baes, M., Sobolev, S.V., Whattam, S.A., Plate Tectonics on the Earth Triggered by Plume-Induced Subduction Initiation, Nature, 527, (2015), 221-225, https://doi.org/10.1038/nature15752
  • Gukelberger, J., Huang, L., Werner, Ph., On the Dangers of Partial Diagrammatic Summations: Benchmarks for the Two-Dimensional Hubbard Model in the Weak-Coupling Regime, Phys. Rev. B, 91, 235114, (2015), https://doi.org/10.1103/PhysRevB.91.235114
  • Guo, T., Kouvonen, P., Koh, Ch.Ch., Gillet, L.C., Wolski, W.E., Röst, H.L., Rosenberger, G., Collins, B.C., Blum, L.C., Gillessen, S., Joerger, M., Jochum, W., Aebersold, R., Rapid Mass Spectrometric Conversion of Tissue Biopsy Samples into Permanent Quantitative Digital Proteome Maps, Nat. Med., 21, (2015), https://doi.org/10.1038/nm.3807
  • Hagen, O., Hartmann, K., Steel, M., Stadler, T., Age-Dependent Speciation Can Explain the Shape of Empirical Phylogenies, Syst. Biol., 64(3), (2015), 432-440, https://doi.org/10.1093/sysbio/syv001
  • Herrendörfer, R., van Dinther, Y., Gerya, T., Dalguer, L.A., Earthquake Supercycle in Subduction Zones Controlled by the Width of the Seismogenic Zone, Nature Geosci., 8, (2015), 471-471, https://doi.org/10.1038/ngeo2427
  • Husson, L., Yamato, Ph., Bézos, A., Ultraslow, Slow, or Fast Spreading Ridges: Arm Wrestling Between Mantle Convection and Far-Field Tectonics, Earth Planet. Sci. Lett., 429, (2015), 205-215, https://doi.org/10.1016/j.epsl.2015.07.052
  • Katzgraber, H.G., Hamze, F., Zhu, Zh., Ochoa, A.J.,, Munoz-Bauza, H., Seeking Quantum Speedup Through Spin Glasses: The Good, the Bad, and the Ugly, Phys. Rev. X, 5, 031026, (2015), https://doi.org/10.1103/PhysRevX.5.031026
  • Kunszt, P., Blum, L., Hullár, B., Schmid, E., Srebniak, A., Wolski, W., Rinn, B., Elmer, F.-J., Ramakrishnan, Ch., Quandt, A., Malmström, L., iPortal: The Swiss Grid Proteomics Portal: Requirements and New Features Based on Experience and Usability Considerations, Concurr. Comp.-Pract. E., 27, (2015), 433-445, https://doi.org/10.1002/cpe.3294
  • Li, Y., Deschamps, F., Tackley, P.J., Effects of the Post-Perovskite Phase Transition Properties on the Stability and Structure of Primordial Reservoirs in the Lower Mantle of the Earth, Earth Planet. Sci. Lett., 432, (2015), 1-12, https://doi.org/10.1016/j.epsl.2015.09.040
  • Lyngvi, E., Sanhueza, I.A., Schönebeck, F., Dispersion Makes the Difference: Bisligated Transition States Found for the Oxidative Addition of Pd(PtBu3)2 to Ar-OSO2R and Dispersion-Controlled Chemoselectivity in Reactions with Pd[P(iPr)(tBu2)]2, Organometallics, 34(5), (2015), 805-812, https://doi.org/10.1021/om501199t
  • Malmström, L., Bakochi, A., Svensson, G., Kilsgård, O., Lantz, H., Petersson, A.C., Hauri, S., Karlsson, Ch., Malmström, J., Quantitative Proteogenomics of Human Pathogens Using DIA-MS, J. Proteomics, 129, (2015), 98-107, https://doi.org/10.1016/j.jprot.2015.09.012
  • Mirsky, A., Kazandjian, L., Anisimova, M., Antibody-Specific Model of Amino Acid Substitution for Immunological Inferences from Alignments of Antibody Sequences, Mol. Biol. Evol., 32(3), (2014), 806-819, https://doi.org/10.1093/molbev/msu340
  • Nava, M., Quhe, R., Palazzesi, F., Tiwary, P., Parrinello, M., de Broglie Swapping Metadynamics for Quantum and Classical Sampling, J. Chem. Theory Comput., 11, (2015), 5114-5119, https://doi.org/10.1021/acs.jctc.5b00818
  • Opilik, L., Payamyar, P., Szczerbinski, J., Schütz, A.P., Servalli, M., Hungerland, T., Schlüter, A.D., Zenobi, R., Minimally Invasive Characterization of Covalent Monolayer Sheets Using Tip-Enhanced Raman Spectroscopy, ACS Nano, 9(4), (2015), 4252-4259, https://doi.org/10.1021/acsnano.5b00629
  • Owczarz, M., Casalini, T., Motta, A.C., Morbidelli, M., Arosio, P., Contribution of Electrostatics in the Fibril Stability of a Model IonicComplementary Peptide, Biomacromolecules, 16(12), (2015), 3792-3801, https://doi.org/10.1021/acs.biomac.5b01092
  • Paranjape, A., Kovač, K., Hartley, W.G. Pahwa, I., Correlating Galaxy Colour and Halo Concentration: A Tunable Halo Model of Galactic Conformity, MNRAS, 454, (2015), 3030-3048, https://doi.org/10.1093/mnras/stv2137
  • Perego, C., Salvalaglio, M., Parrinello, M., Molecular Dynamics Simulations of Solutions at Constant Chemical Potential, J. Chem. Phys., 142, 144113, (2015), https://doi.org/10.1063/1.4917200
  • Polino, D., Parrinello, M., Combustion Chemistry via Metadynamics: Benzyl Decomposition Revisited, J. Phys. Chem. A, 119(6), (2015), https://doi.org/10.1021/jp5118807
  • Prentner, R., Quack, M., Stohner, J., Willeke, M., Wavepacket Dynamics of the Axially Chiral Molecule Cl–O–O–Cl under Coherent Radiative Excitation and Including Electroweak Parity Violation, J. Phys. Chem. A, 119(51), (2015), 12805-12822, https://doi.org/10.1021/acs.jpca.5b08958
  • Protesescu, L., Yakunin, S., Bodnarchuk, M.I., Krieg, F., Caputo, R., Hendon, Ch. H., Yang, R.X., Walsh, A., Kovalenko, M.V., Nanocrystals of Cesium Lead Halide Perovskites (CsPbX3, X = Cl, Br, and I): Novel Optoelectronic Materials Showing Bright Emission with Wide Color Gamut, Nano Lett., 15(6), (2015), 3692-3696, https://doi.org/10.1021/nl5048779
  • Rapsomaniki, M.A., Cinquemani, E., Giakoumakis, N.N., Kotsantis, P., Lygeros, J., Lygerou, Z., Inference of Protein Kinetics by Stochastic Modeling and Simulation of Fluorescence Recovery after Photobleaching Experiments, Bioinformatics, 31(3), (2015), 355-362, https://doi.org/10.1093/bioinformatics/btu619
  • Reimer, J., Steele-MacInnis, M., Wambach, J.M., Vogel, F., Ion Association in Hydrothermal Sodium Sulfate Solutions Studied by Modulated FT-IR-Raman Spectroscopy and Molecular Dynamics, J. Phys. Chem. B, 119(30), (2015), 9847-9857, https://doi.org/10.1021/acs.jpcb.5b03192
  • Rossinelli, D., Hejazialhosseini, B., van Rees, W., Gazzola, M., Bergdorf, M., Koumoutsakos, P., MRAG-I2D: Multi-Resolution Adapted Grids for Remeshed Vortex Methods on Multicore Architectures, J. Comput. Phys., 288, (2015), 1-18, https://doi.org/10.1016/j.jcp.2015.01.035
  • Salvalaglio, M., Mazzotti, M., Parrinello, M., Urea Homogeneous Nucleation Mechanism Is Solvent Dependent, Faraday Discuss., 179, (2015), 291-307, https://doi.org/10.1039/C4FD00235K
  • Salvalaglio, M., Perego, C., Giberti, F., Mazzotti, M., Parrinello, M., Molecular-Dynamics Simulations of Urea Nucleation from Aqueous Solution, PNAS, 112(1), (2015), E6-E14, https://doi.org/10.1073/pnas.1421192111
  • Shao, Sh., Guo, T., Koh, Ch.Ch., Gillessen, S., Joerger, M., Jochum, W., Aebersold, R., Minimal Sample Requirement for Highly Multiplexed Protein Quantification in Cell Lines and Tissues by PCT-SWATH Mass Spectrometry, Proteomics, 15(21), (2015), 3711-3721, https://doi.org/10.1002/pmic.201500161
  • Shinaoka, H., Hoshino, Sh., Troyer, M., Werner, Ph., Phase Diagram of Pyrochlore Iridates: All-in–All-out Magnetic Ordering and Non-Fermi-Liquid Properties, Phys. Rev. Lett., 115, 156401, (2015), https://doi.org/10.1103/PhysRevLett.115.156401
  • Shinaoka, H., Nomura, Y., Biermann, S., Troyer, M., Werner, Ph., Negative Sign Problem in Continuous-Time Quantum Monte Carlo: Optimal Choice of Single-Particle Basis for Impurity Problems, Phys. Rev. B, 92, 195126, (2015), https://doi.org/10.1103/PhysRevB.92.195126
  • Tiwary, P., Limongelli, V., Salvalaglio, M., Parrinello, M., Kinetics of Protein–ligand Unbinding: Predicting Pathways, Rates, and Rate-Limiting Steps, PNAS, 112(5),(2015), E386-E391, https://doi.org/10.1073/pnas.1424461112
  • Uehara, A., Shinaoka, H., Motome, Y., Analysis of Charge-Spin-Orbital Fluctuations by Ab Initio Calculation and Random Phase Approximation: Application to Non-coplanar Antiferromagnet Cd2Os2O7, Physcs. Proc., 75, (2015), 495-502, https://doi.org/10.1016/j.phpro.2015.12.062
  • van Driel, M., Krischer, L., Stähler, S.C., Hosseini, K., Nissen-Meyer, T., Instaseis: Instant Global Seismograms Based on a Broadband Waveform Database, Solid Earth, 6, (2015), 701-717, https://doi.org/10.5194/se-6-701-2015
  • van Driel, M., Wassermann, J., Pelties, C., Schiemenz, A., Igel, H., Tilt Effects on Moment Tensor Inversion in the Near Field of Active Volcanoes, Geophys. J. Int., 202, (2015), 1711-1721, https://doi.org/10.1093/gji/ggv209
  • Wang, L., Iazzi, M., Corboz, P., Troyer, M., Efficient Continuous-Time Quantum Monte Carlo Method for the Ground State of Correlated Fermions, Phys. Rev. B, 91, 235151, (2015), https://doi.org/10.1103/PhysRevB.91.235151
  • Wang, L., Liu, Y.-H., Imriška, J., Ma, P.N., Troyer, M., Fidelity Susceptibility Made Simple: A Unified Quantum Monte Carlo Approach, Phys. Rev. X, 5, 031007, (2015), https://doi.org/10.1103/PhysRevX.5.031007
  • Wilhelm, M., Davin, E.L., Seneviratne, S.I., Climate Engineering of Vegetated Land for Hot Extremes Mitigation: An Earth System Model Sensitivity Study, J. Geophys. Res. Atmos., 120, (2015), 2612-2623, https://doi.org/10.1002/2014JD022293

2014

  • Allen, S.E., Hsieh, S.-Y., Gutierrez, O., Bode, J.W., Kozlowski, M.C., Concerted Amidation of Activated Esters: Reaction Path and Origins of Selectivity in the Kinetic Resolution of Cyclic Amines via N‑Heterocyclic Carbenes and Hydroxamic Acid Cocatalyzed Acyl Transfer, J. Am. Chem. Soc., 136, (2014), 11783-11791, https://doi.org/10.1021/ja505784w
  • Andresen, J.C., Katzgraber, H.G., Oganesyan, V., Schechter, M., Existence of a Thermodynamic Spin-Glass Phase in the Zero-Concentration Limit of Anisotropic Dipolar Systems, Phys. Rev. X, 4, 041016, (2014), https://doi.org/10.1103/PhysRevX.4.041016
  • Boixo, S., Rønnow, T.F., Isakov, S.V., Wang, Z., Wecker, D., Lidar, D.A., Martinis, J.M., Troyer, M., Evidence for Quantum Annealing with More Than One Hundred Qubits, Nat. Phys., 10, (2014), 218-224, https://doi.org/10.1038/nphys2900
  • Brambilla, A., Frouzakis, C.E., Mantzaras, J., Tomboulides, A., Kerkemeier, S., Boulouchos, K., Detailed Transient Numerical Simulation of H2/air Hetero-/homogeneous Combustion in Platinum-Coated Channels with Conjugate Heat Transfer, Combust. Flame, 161, (2014), 2692-2707, https://doi.org/10.1016/j.combustflame.2014.04.003
  • Carvalho, R., Buzna, L., Bono, F., Masera, M., Arrowsmith, D.K., Helbing, D., Resilience of Natural Gas Networks during Conflicts, Crises and Disruptions, PLoS ONE, 9(3), e90265, (2014), https://doi.org/10.1371/journal.pone.0090265
  • Chen, J., Walther, J.H., Koumoutsakos, P., Strain Engineering of Kapitza Resistance in Few-Layer Graphene, Nano Lett., 14(2), (2014), 819-825, https://doi.org/10.1021/nl404182k
  • Colombi, A., Nissen-Meyer, T., Boschi, L., Giardini, D., Seismic Waveform Inversion for Core–mantle Boundary Topography, Geophys. J. Int., 198, (2014), 55-71, https://doi.org/10.1093/gji/ggu112
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  • Cruz-Chu, E.R., Malafeev, A., Pajarskas, T., Pivkin, I.V., Koumoutsakos, P., Structure and Response to Flow of the Glycocalyx Layer, Biophys. J., 106(1), (2014), 232-243, https://doi.org/10.1016/j.bpj.2013.09.060
  • Fox, M., Shuster, D.L., The Influence of Burial Heating on the (U–Th)/He System in Apatite: Grand Canyon Case Study, Earth Planet. Sci. Lett., 397, (2014), 174-183, https://doi.org/10.1016/j.epsl.2014.04.041
  • Giovannetti, G., Casula, M., Werner, Ph., Mauri, F., Capone, M., Downfolding Electron-Phonon Hamiltonians from Ab-Initio Calculations: Application to K3Picene, Phys. Rev. B, 90, 115435, (2014), https://doi.org/10.1103/PhysRevB.90.115435
  • Gukelberger, J., Kozi, E., Pollet, L., Prokof'ev, N., Sigrist, M., Svistunov, B., Troyer, M., p-Wave Superfluidity by Spin-Nematic Fermi Surface Deformation, Phys. Rev. Lett., 113, 195301, (2014), https://doi.org/10.1103/PhysRevLett.113.195301
  • Holme, M.N., Schulz, G., Deyhle, H., Weitkamp, T., Beckmann, F., Lobrinus, J.A., Rikhtegar, F., Kurcuoglu, V., Zanette, I., Saxer, T., Müller, B., Complementary X-Ray Tomography Techniques for Histology-Validated 3D Imaging of Soft and Hard Tissues Using Plaque-Containing Blood Vessels as Examples, Nat. Protoc., 9, (2014), 1401-1415, https://doi.org/10.1038/nprot.2014.091
  • Hung, H.-H., Chua, V., Wang, L., Fiete, G.A., Interaction Effects on Topological Phase Transitions via Numerically Exact Quantum Monte Carlo Calculations, Phys. Rev. B, 89, 235104, (2014), https://doi.org/10.1103/PhysRevB.89.235104
  • Imriška, J., Iazzi, M., Wang, L., Gull, E., Greif, D., Uehlinger, T., Jotzu, G., Tarruell, L., Esslinger, T., Troyer, M., Thermodynamics and Magnetic Properties of the Anisotropic 3D Hubbard Model, Phys. Rev. Lett., 112, 115301, (2014), https://doi.org/10.1103/PhysRevLett.112.115301
  • Iregui, J.O., Corboz, Ph., Troyer, M., Probing the Stability of the Spin-Liquid Phases in the Kitaev-Heisenberg Model Using Tensor Network Algorithms, Phys. Rev. B, 90, 195102, (2014), https://doi.org/10.1103/PhysRevB.90.195102
  • Khan, A., Connolly, J.A.D., Pommier, A., Noir, J., Geophysical Evidence for Melt in the Deep Lunar Interior and Implications for Lunar Evolution, J. Geophys. Res. Planet, 119(10), (2014), 2197-2221, https://doi.org/10.1002/2014JE004661
  • Koyama, T., Khan, A., Kuvshinov, A., Three-Dimensional Electrical Conductivity Structure Beneath Australia from Inversion of Geomagnetic Observatory Data: Evidence for Lateral Variations in Transition-Zone Temperature, Water Content and Melt, Geophys. J. Int, 196, (2014), 1330-1350, https://doi.org/10.1093/gji/ggt455
  • Li, Y., Deschamps, F., Tackley, P.J., Effects of Low-Viscosity Post-Perovskite on the Stability and Structure of Primordial Reservoirs in the Lower Mantle, Geophys. Rev. Lett., 41, (2014), 7089-7097, https://doi.org/10.1002/2014GL061362
  • Li, Y., Deschamps, F., Tackley, P.J., The Stability and Structure of Primordial Reservoirs in the Lower Mantle: Insights from Models of Thermochemical Convection in Three-Dimensional Spherical Geometry, Geophys. J. Int., 199, (2014), 914-930, https://doi.org/10.1093/gji/ggu295
  • Luo, G., Hou, Th.Y., Toward the Finite-Time Blowup of the 3D Axisymmetric Euler Equations: A Numerical Investigation, Multiscale Model. Simul., 12(4), (2014), 1722-1776, https://doi.org/10.1137/140966411
  • Meng, Z.Y.., Hung, H.-H., Lang, Th.C., The Characterization of Topological Properties in Quantum Monte Carlo Simulations of the Kane-Mele-Hubbard Model, Mod. Phys. Lett. B, 28(1), 1430001, (2014), https://doi.org/10.1142/S0217984914300014
  • Parker, R.J., Church, R.P., Davies, M.B., Meyer, M.R., Supernova Enrichment and Dynamical Histories of Solar-Type Stars in Clusters, MNRAS, 437, (2014), 946-958, https://doi.org/10.1093/mnras/stt1957
  • Ren, Zh., Kalscheuer, Th., Greenhalgh, S., Maurer, H., A Finite-Element-Based Domain-Decomposition Approach for Plane Wave 3D Electromagnetic Modeling, Geophysics, 79(6), (2014), E255-E268, https://doi.org/10.1190/geo2013-0376.1
  • Röst, H.L., Rosenberger, G., Navarro, P., Gillet, L., Miladinović, S.M., Schubert, O.T., Wolski, W., Collins, B.C., Malmström, J., Malmström, L., Aebersold, R., OpenSWATH Enables Automated, Targeted Analysis of Data-Independent Acquisition MS Data, Nat. Biotech., 32, (2014), 219-223, https://doi.org/10.1038/nbt.2841
  • Roten D., Fäh, D., Bonilla, F., Quantification of Cyclic Mobility Parameters in Liquefiable Soils from Inversion of Vertical Array Records, B. Seismol. Soc. Am., 104(6), (2014), 3115-3138, https://doi.org/10.1785/0120130329
  • Salvalaglio, M., Tiwary, P., Parrinello, M., Assessing the Reliability of the Dynamics Reconstructed from Metadynamics, J. Chem. Theory Comput., 10(4), (2014), 1420-1425, https://doi.org/10.1021/ct500040r
  • Sternai, P., Jolivet, L., Menant, A., Gerya, T., Driving the Upper Plate Surface Deformation by Slab Rollback and Mantle Flow, Earth Planet. Sci. Lett., 405, (2014), 110-118, https://doi.org/10.1016/j.epsl.2014.08.023
  • Turi, G., Lachkar, Z., Gruber, N., Spatiotemporal Variability and Drivers of pCO2 and Air–sea CO2 Fluxes in the California Current System: An Eddy-Resolving Modeling Study, Biogeosciences, Biogeosciences, 11, (2014), 671-690, https://doi.org/10.5194/bg-11-671-2014
  • van Driel, M., Nissen-Meyer, T., Optimized Viscoelastic Wave Propagation for Weakly Dissipative Media, Geophys. J. Int., 199, (2014), 1078-1093, https://doi.org/10.1093/gji/ggu314
  • van Driel, M., Nissen-Meyer, T., Seismic Wave Propagation in Fully Anisotropic Axisymmetric Media, Geophys. J. Int., 199, (2014), 880-893, https://doi.org/10.1093/gji/ggu269
  • Wang, W., Machta, J., Katzgraber, H.G., Evidence Against a Mean-Field Description of Short-Range Spin Glasses Revealed Through Thermal Boundary Conditions, Phys. Rev. B, 90, 184412, (2014), https://doi.org/10.1103/PhysRevB.90.184412
  • Wischert, R., Florian, P., Copéret, Ch., Massiot, D., Sautet, Ph., Visibility of Al Surface Sites of γ‑Alumina: A Combined Computational and Experimental Point of View, J. Phys. Chem. C, 118(28), (2014), 15292−15299, https://doi.org/10.1021/jp503277m
  • Wisniewska, M., Happonen, L., Kahn, F., Varjosalo, M., Malmström, L., Rosenberger, G., Karlsson, Ch., Cazzamali, G., Pozdnyakova, I., Frick, I.-M., Björck, L., Streicher, W., Malmström, J., Wikström, M., Functional and Structural Properties of a Novel Protein and Virulence Factor (Protein Ship) In Streptococcus Pyogenes, J. Biol. Chem., 289, (2014), 18175-18188, https://doi.org/10.1074/jbc.M114.565978
  • Wittmann, M., Yucesoy, B., Katzgraber, H.G., Machta, J., Young, A.P., Low-Temperature Behavior of the Statistics of the Overlap Distribution in Ising Spin-Glass Models, Phys. Rev. B, 90, 134419, (2014), https://doi.org/10.1103/PhysRevB.90.134419

2013

  • Ahrens, B., Xiao, J., Hartmann, A.K., Katzgraber, H.G., Diluted Antiferromagnets in a Field Seem to Be in a Different Universality Class Than the Random-Field Ising Model, Phys. Rev. B, 88, 174408, (2013), https://doi.org/10.1103/PhysRevB.88.174408
  • Andresen, J.C., Thomas, C.K., Katzgraber, H.G., Schechter, M., Novel Disordering Mechanism in Ferromagnetic Systems with Competing Interactions, Phys. Rev. Lett., 111, 177202, (2013), https://doi.org/10.1103/PhysRevLett.111.177202
  • Andresen, J.C., Zhu, Z., Andrist, R.S., Katzgraber, H.G., Dobrosavljevic, V., Zimanyi, G.T., Self-Organized Criticality in Glassy Spin Systems Requires a Diverging Number of Neighbors, Phys. Rev. Lett., 111, 097203, (2013), https://doi.org/10.1103/PhysRevLett.111.097203
  • Ayral, Th., Biermann, S., Werner, Ph., Screening and Nonlocal Correlations in the Extended Hubbard Model from Self-Consistent Combined GW and Dynamical Mean Field Theory, Phys. Rev. B, 87, 125149, (2013), https://doi.org/10.1103/PhysRevB.87.125149
  • Battich, N., Stoeger, Th., Pelkmans, L., Image-Based Transcriptomics in Thousands of Single Human Cells at Single-Molecule Resolution, Nat. Methods, 10, (2013), 1127-1133, https://doi.org/10.1038/nmeth.2657
  • Bonney, K.J., Proutiere, F., Schoenebeck, F., Dinuclear Pd(i) Complexes—solely Precatalysts? Demonstration of Direct Reactivity of a Pd(i) Dimer with an Aryl Iodide, Chem. Sci., 4, (2013), 4434-4439, https://doi.org/10.1039/C3SC52054D
  • Caputo, R., Exploring the Structure–composition Phase Space of Lithium Borocarbide, LixBC for x ≤ 1, RSC Adv., 3, (2013), 10230-10241, https://doi.org/10.1039/C3RA41396A
  • Chen, L., Gerya, T.V., Zhang, Z.-J., Aitken, A., Li, Z.-H., Liang, X.-F., Formation Mechanism of Steep Convergent Intracontinental Margins: Insights from Numerical Modeling, Geophys. Res. Lett., 40(10), (2013), 2000-2005, https://doi.org/10.1002/grl.50446
  • Chen, L., Gerya, T.V., Zhang, Z., Zhu, G., Duretz, T., Jacoby, W.R., Numerical Modeling of Eastern Tibetan-Type Margin: Influences of Surface Processes, Lithospheric Structure and Crustal Rheology, Gondwana Res., 24, (2013), 1091-1107, https://doi.org/10.1016/j.gr.2013.01.003
  • Coltice, N., Seton, M., Rolf, T., Müller, D.R., Tackley, P.J., Convergence of Tectonic Reconstructions and Mantle Convection Models for Significant Fluctuations in Seafloor Spreading, Earth Planet. Sci. Lett., 383, (2013), 92-100, https://doi.org/10.1016/j.epsl.2013.09.032
  • Corboz, Ph., Lajkó, M., Penc, K., Mila, F., Läuchli, A.M., Competing States in the SU(3) Heisenberg Model on the Honeycomb Lattice: Plaquette Valence-Bond Crystal Versus Dimerized Color-Ordered State, Phys. Rev. B, 87, 195113, (2013), https://doi.org/10.1103/PhysRevB.87.195113
  • Dalquen, D.A., Altenhoff, A.M., Gonnet, G.H., Dessimoz, Ch., The Impact of Gene Duplication, Insertion, Deletion, Lateral Gene Transfer and Sequencing Error on Orthology Inference: A Simulation Study, PLoS ONE, 8(2), e56925, (2013), https://doi.org/10.1371/journal.pone.0056925
  • Duprat-Oualid, S., Yamato, P., Pitra, P., Major Role of Shear Heating in Intracontinental Inverted Metamorphism: Inference from a Thermo-Kinematic Parametric Study, Tectonophysics, 608, (2013), 812-831, https://doi.org/10.1016/j.tecto.2013.07.037
  • Embrechts, P., Hofer, M., Statistical Inference for Copulas in High Dimensions: A Simulation Study, Astin Bull., 43(2), (2013), 81-95, https://doi.org/10.1017/asb.2013.6
  • Gatto, A., Fraternali, F., Read, J.I., Marinacci, F., Lux, H., Walch, S., Unveiling the Corona of the Milky Way via Ram-Pressure Stripping of Dwarf Satellites, MNRAS, 433, (2013), 2749-2763, https://doi.org/10.1093/mnras/stt896
  • Guralnik, B., Jain, M., Herman, F., Paris, R.B., Harrison, T.M., Murray, A.S., Valla, P.G., Rhodes, E.J., Effective Closure Temperature in Leaky And/or Saturating Thermochronometers, Earth Planet. Sci. Lett., 384, (2013), 209-218, https://doi.org/10.1016/j.epsl.2013.10.003
  • He, M., Bode, J.W., E Pluribus Unum: Isolation, Structure Determination, Network Analysis and DFT Studies of a Single Metastable Structure from a Shapeshifting Mixture of 852 Bullvalene Structural Isomers, Org. Biomol. Chem., 11, (2013), 1306-1317, https://doi.org/10.1039/C2OB26954F
  • Hollerbach, R., Nore, C., Marti, P., Vantieghem, S., Luddens, F., Léorat, J., Parity-Breaking Flows in Precessing Spherical Containers, Phys. Rev. E, 87, 0503020, (2013), https://doi.org/10.1103/PhysRevE.87.053020
  • Horný, L., Schaefer, H.F., Ünlü, F., Willeke, M., Theoretical Investigation of the Cyclopropene Radical Cation c-C3H+•4 : Structure, Energetics and Spectroscopic Properties, Mol. Phys., 111, (2013), 2306-2313, https://doi.org/10.1080/00268976.2013.806684
  • Hung, H.-H., Wang, L., Gu, Z.-C., Fiete, G.A., Topological Phase Transition in a Generalized Kane-Mele-Hubbard Model: A Combined Quantum Monte Carlo and Green’s Function Study, Phys. Rev. B, 121113(R), (2013), https://doi.org/10.1103/PhysRevB.87.121113
  • Keller, T., May, D.A., Kaus, B.J.P., Numerical Modelling of Magma Dynamics Coupled to Tectonic Deformation of Lithosphere and Crust, Geophys. J. Int., 195(3), (2013), 1406-1442, https://doi.org/10.1093/gji/ggt306
  • Khan, A., Zunino, A., Deschamps, F., Upper Mantle Compositional Variations and Discontinuity Topography Imaged Beneath Australia from Bayesian Inversion of Surface-Wave Phase Velocities and Thermochemical Modeling, J. Geophys. Res. Sol. Ea., 118(10), (2013), 5285-5306, https://doi.org/10.1002/jgrb.50304
  • Kozik, E., Burovski, E., Scarola, V.W., Troyer, M., Néel Temperature and Thermodynamics of the Half-Filled Three-Dimensional Hubbard Model by Diagrammatic Determinant Monte Carlo, Phys. Rev. B, 87, 205102, (2013), https://doi.org/10.1103/PhysRevB.87.205102
  • Lachkar, Z., Effects of Upwelling Increase on Ocean Acidification in the California and Canary Current Systems, Geophys. Res. Lett., 41, (2013), 90-95, https://doi.org/10.1002/2013GL058726
  • Lachkar, Z., Gruber, N., Response of Biological Production and Air–sea CO2 Fluxes to Upwelling Intensification in the California and Canary Current Systems, J. Marine Syst., 109-110, (2013), 149-160, https://doi.org/10.1016/j.jmarsys.2012.04.003
  • Lacy, A.R., Vogt, A., Boudon, C., Gisselbrecht, J.-P., Schweizer, W.B., Diederich, F., Post-Cycloaddition–Retroelectrocyclization Transformations of Polycyanobutadienes, Eur. J. Org. Chem., 2013, (2013), 869-879, https://doi.org/10.1002/ejoc.201201371
  • Larson, D., Katzgraber, H.G., Moore, M.A., Young, A.P., Spin Glasses in a Field: Three and Four Dimensions as Seen from One Space Dimension, Phys. Rev. B, 87, 024414, (2013), https://doi.org/10.1103/PhysRevB.87.024414
  • Lyngvi, E., Schoenebeck, F., Oxidative Addition Transition States of Pd(0) Complexes in Polar Solvent—a DFT Study Involving Implicit and Explicit Solvation, Tetrahedron, 69, (2013), 5715-5718, https://doi.org/10.1016/j.tet.2013.03.095
  • Matsuda, Y.H., Takeyama, N.A.S., Kageyama, H., Corboz, P., Honecker, A., Manmana, S.R., Foltin, G.R., Schmidt, K.P., Mila, F., Magnetization of SrCu2(BO3)2 in Ultrahigh Magnetic Fields up to 118 T, Phys. Rev. Lett., 111, 137204, (2013), https://doi.org/10.1103/PhysRevLett.111.137204
  • Moonen, P., Gromke, C., Dorer, V., Performance Assessment of Large Eddy Simulation (LES) for Modeling Dispersion in an Urban Street Canyon with Tree Planting, Atmos. Environ., 75, (2013), 66-76, https://doi.org/10.1016/j.atmosenv.2013.04.016
  • Nielsen, M.C., Lyngvi, E., Schoenebeck, F., Chemoselectivity in the Reductive Elimination from High Oxidation State Palladium Complexes – Scrambling Mechanism Uncovered, J. Am. Chem. Soc., 135(5), (2013), 1978-1985, https://doi.org/10.1021/ja312047b
  • Palazzesi, F., Barducci, A., Tollinger, M., Parrinello, M., The Allosteric Communication Pathways in KIX Domain of CBP, PNAS, 110(35), (2013), 14237–14242, https://doi.org/10.1073/pnas.1313548110
  • Parker, R.J., Reggiani, M.M., The Binary Companion Mass Ratio Distribution: An Imprint of the Star Formation Process?, MNRAS, 432, (2013), 2378-2384, https://doi.org/10.1093/mnras/stt600
  • Pavan, G.M., Barducci, A., Albertazzi, L., Parrinello, M., Combining Metadynamics Simulation and Experiments to Characterize Dendrimers in Solution, Soft Matter, 9, (2013), 2593-2597, https://doi.org/10.1039/C3SM27706B
  • Püthe, Ch., Kuvshinov, A., Determination of the 3-D Distribution of Electrical Conductivity in Earth’s Mantle from Swarm Satellite Data: Frequency Domain Approach Based on Inversion of Induced Coefficients, Earth, Planets Sp., 65, 6, (2013), https://doi.org/10.5047/eps.2013.09.004
  • Salvalaglio, M., Vetter, T., Mazzotti, M., Parrinello, M., Controlling and Predicting Crystal Shapes: The Case of Urea, Angew. Chem. Int. Ed., 52, (2013), 13369-13372, https://doi.org/10.1002/anie.201304562
  • Sanhueza, I.A., Wagner, A.M., Sanford, M.S., Schoenebeck, F., On the Role of Anionic Ligands in the Site-Selectivity of Oxidative C–H Functionalization Reactions of Arenes, Chem. Sci., 4, (2013), 2767-2775, https://doi.org/10.1039/C3SC00017F
  • Turi, G., Lachkar, Z., Gruber, N., Spatiotemporal Variability and Drivers of pCO2 and Air–Sea CO2 Fluxes in the California Current System: An Eddy-Resolving Modeling Study, Biogeosciences Disc., 10, (2013), 14043-14091, https://doi.org/10.5194/bgd-10-14043-2013
  • Uehlinger, T., Greif, D., Jotzu, G., Tarruell, L., Esslinger, T., Wang, L., Troyer, M., Double Transfer through Dirac Points in a Tunable Honeycomb Optical Lattice, Eur. Phys. J. Special Topics, 217, (2013), 121-133, https://doi.org/10.1140/epjst/e2013-01761-y
  • Valsson, O., Parrinello, M., Thermodynamical Description of a Quasi-First-Order Phase Transition from the Well-Tempered Ensemble, J. Chem. Theory Comput., 9, (2013), 5267-5276, https://doi.org/10.1021/ct400859f
  • van Dinther, Y., Gerya, T.V., Dalguer, L.A., Mai, P.M., Morra, G., Giardini, D., The Seismic Cycle at Subduction Thrusts: Insights from Seismo-Thermo-Mechanical Models, J. Geophys. Res. Sol. Ea, 118 , (2013), 6183-6202, https://doi.org/10.1002/2013JB010380
  • Wiesinger, J., Sornette, D., Satinover, J., Reverse Engineering Financial Markets with Majority and Minority Games Using Genetic Algorithms, Comput. Econ., 41, (2013), 475-492, https://doi.org/10.1007/s10614-011-9312-9
  • Yarema, M., Caputo, R., Kovalenko, M.V., Precision Synthesis of Colloidal Inorganic Nanocrystals Using Metal and Metalloid Amides, Nanoscale, 5, (2013), 8398-8410, https://doi.org/10.1039/C3NR02076B
  • Yucesoy, B., Machta, J., Katzgraber, H.G., Correlations Between the Dynamics of Parallel Tempering and the Free-Energy Landscape in Spin Glasses, Phys. Rev. E, 87, 012104, (2013), https://doi.org/10.1103/PhysRevE.87.012104

2012

  • Aufiero, M., Proutiere, F., Schoenebeck, F., Redox Reactions in Palladium Catalysis: On the Accelerating and/or Inhibiting Effects of Copper and Silver Salt Additives in CrossCoupling Chemistry Involving Electron-rich Phosphine Ligands, Angew. Chem. Int. Ed., 51, (2012), 7226-7230, https://doi.org/10.1002/anie.201202504
  • Ayral, Th., Werner, Ph., Biermann, S., Spectral Properties of Correlated Materials: Local Vertex and Nonlocal Two-Particle Correlations from Combined GW and Dynamical Mean Field Theory, Phys. Rev. Lett., 109, 226401, (2012), https://doi.org/10.1103/PhysRevLett.109.226401
  • Barylyuk, K., Fritsche, L., Balabin, R.M., Nieckarz, R., Zenobi, R., Gas-Phase Basicity of Several Common MALDI Matrices Measured by a Simple Experimental Approach, RSC Adv., 2, (2012), 1962-1969, https://doi.org/10.1039/C1RA01117K
  • Bauer, B., Corboz, Ph., Läuchli, A.M., Messio, L., Penc, K., Troyer, M., Mila, F., Three-Sublattice Order in the SU(3) Heisenberg Model on the Square and Triangular Lattice, Phys. Rev. B, 85, 125116, (2012), https://doi.org/10.1103/PhysRevB.85.125116
  • Bismuto, A., Terazzi, R., Hinkov, B., Beck, M., Faist, J., Fully Automatized Quantum Cascade Laser Design by Genetic Optimization, Appl. Phys. Lett., 101, 021103, (2012), https://doi.org/10.1063/1.4734389
  • Bombin, H., Andrist, R.S., Ohzeki, M., Katzgraber, H.G., Martin-Delgado, M.A, Strong Resilience of Topological Codes to Depolarization, Phys. Rev. X, 2, 021004, (2012), https://doi.org/10.1103/PhysRevX.2.021004
  • Cincotti, S., Sornette, D., Treleaven, P., Battiston, S., Caldarelli, G, Hommes, C., Kirman, A., An Economic and Financial Exploratory, Eur. Phys. J. Special Topics, 214, (2012), 361-400, https://doi.org/10.1140/epjst/e2012-01699-6
  • Corboz, Ph., Capponi, S., Läuchli, A.M., Bauer, B., Orús, R., Comment on “Topological Quantum Phase Transitions of Attractive Spinless Fermions in a Honeycomb Lattice” By Poletti D. et al., EPL, 98, 27005, (2012), https://doi.org/10.1209/0295-5075/98/27005
  • Corboz, Ph., Penc, K., Mila, F., Läuchli, A.M., Simplex Solids in SU(N) Heisenberg Models on the Kagome and Checkerboard Lattices, Phys. Rev. B, 86, 041106(R), (2012), https://doi.org/10.1103/PhysRevB.86.041106
  • Deschamps, F., Yao, Ch., Tackley, P.J., Sanchez-Valle, C., High Rayleigh Number Thermal Convection in Volumetrically Heated Spherical Shells, J. Geophys. Res. Planet, 117, E09006, (2012), https://doi.org/10.1029/2012JE004090
  • Glöss, A., Brändler, M.P., Klopper, W., Lüthi, H.P., The MP2 Binding Energy of the Ethene Dimer and Its Dependence on the Auxiliary Basis Sets: A Benchmark Study Using a Newly Developed Infrastructure for the Processing of Quantum Chemical Data, Mol. Phys., 110, (2012), 2523-2534, https://doi.org/10.1080/00268976.2012.708793
  • Gonnet, P., Pairwise Verlet Lists: Combining Cell Lists and Verlet Lists to Improve Memory Locality and Parallelism, J. Comput. Chem., 33(1), (2012), 76-81, https://doi.org/10.1002/jcc.21945
  • Hafermann, H., Patton, K.R., Werner, Ph., Improved Estimators for the Self-Energy and Vertex Function in Hybridization-Expansion Continuous-Time Quantum Monte Carlo Simulations, Phys. Rev. B, 85, 205106, (2012), https://doi.org/10.1103/PhysRevB.85.205106
  • Haussener, S., Jerjen, I., Wyss, P., Steinfeld, A., Tomography-Based Determination of Effective Transport Properties for Reacting Porous Media, J. Heat Transf., 134(1), 012601, (2012), https://doi.org/10.1115/1.4004842
  • Hiroi, N., Klann, M., Iba, K., de Heras Ciechomski, P., Yamashita, Sh., Tabira, A., Okuhara, T., Kubojima, T., Okada, Y., Oka, K., Mange, R., Unger, M., Funahashi, A., Koeppl, H., From Microscopy Data to In Silico Environments for In Vivo-Oriented Simulations, J. Bioninform. Sys. Biology, 2012, 7, (2012), https://doi.org/10.1186/1687-4153-2012-7
  • Katzgraber, H.G., Janzen, K., Thomas, C.K., Boolean Decision Problems with Competing Interactions on Scale-Free Networks: Critical Thermodynamics, Phys. Rev. E, 86, 031116, (2012), https://doi.org/10.1103/PhysRevE.86.031116
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  • Peleg, O., Savin, Th., Kolmakov, G.V., Salib, I.G., Balazs, A.C., Kröger, M., Fibers with Integrated Mechanochemical Switches: Minimalistic Design Principles Derived from Fibronectin, Biophys. J., 103(9), (2012), 1909-1918, https://doi.org/10.1016/j.bpj.2012.09.028
  • Proutiere, F., Aufiero, M., Schoenebeck, F., Reactivity and Stability of Dinuclear Pd(I) Complexes: Studies on the Active Catalytic Species, Insights into Precatalyst Activation and Deactivation, and Application in Highly Selective Cross-Coupling Reactions, J. Am. Chem. Soc., 134(1), (2012), 606-612, https://doi.org/10.1021/ja209424z
  • Rolf, T., Coltice, N., Tackley, P.J., Linking Continental Drift, Plate Tectonics and the Thermal State of the Earth’s Mantle, Earth Planet. Sci. Lett., 351-352, (2012), 134-146, https://doi.org/10.1016/j.epsl.2012.07.011
  • Salvalaglio, M., Vetter, Th., Giberti, F., Mazzotti, M., Parrinello, M., Uncovering Molecular Details of Urea Crystal Growth in the Presence of Additives, J. Am. Chem. Soc., 134(41), (2012), 17221-17233, https://doi.org/10.1021/ja307408x
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    (Reference to Brutus is in the supplementary material)
  • Werner, Ph., Casula, M., Miyake, T., Aryasetiawan, F., Millis, A.J., Biermann, S., Satellites and Large Doping and Temperature Dependence of Electronic Properties in Hole-Doped BaFe2As2, Nature Phys., 8, (2012), 331-337, https://doi.org/10.1038/nphys2250
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  • Zhang, X., Hu, M., Poulikakos, D., A Low-Frequency Wave Motion Mechanism Enables Efficient Energy Transport in Carbon Nanotubes at High Heat Fluxes, Nano Lett., 12(7), (2012), 3410-3416, https://doi.org/10.1021/nl300261r
  • Zhou, L., Li, Z., Zou, Y., Wang, Q., Sanhueza, I.A., Schoenebeck, F., Goeke, A., Tandem Nucleophilic Addition/Oxy-2-azonia-Cope Rearrangement for the Formation of Homoallylic Amides and Lactams: Total Synthesis and Structural Verification of Motuporamine G, J. Am. Chem. Soc., 134(49), (2012), https://doi.org/10.1021/ja310002m

2011

  • Andanson, J.-M., Beier, M.J., Baiker, A., Binary Ionic Liquids with a Common Cation: Insight into Nanoscopic Mixing by Infrared Spectroscopy, J. Phys. Chem. Lett., 2, (2011), 2959-2964, https://doi.org/10.1021/jz201323a
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  • Dessimoz, Ch., Zoller, S., Manousaki, T., Qiu, H., Meyer, A., Kuraku, Sh., Comparative Genomics Approach to Detecting Split-Coding Regions in a Low-Coverage Genome: Lessons from the Chimaera Callorhinchus Milii (Holocephali, Chondrichthyes), Brief. Bioinofm., 12(5), (2011), 474-484, https://doi.org/10.1093/bib/bbr038
  • Endres, M., Cheneau, M., Fukuhara, T., Weitenberg, C., Schauss, P., Gross, C., Mazza, L., Bañuls, M.C., Pollet, L., Bloch, I., Kuhr, S., Observation of Correlated Particle-Hole Pairs and String Order in Low-Dimensional Mott Insulators, Science, 334, (2011), 200-203, https://doi.org/10.1126/science.1209284
  • Fuchs, S., Gull, E., Pollet, L., Burovski, E., Kozik, E., Pruschke, Th., Troyer, M., Thermodynamics of the 3D Hubbard Model on Approaching the Néel Transition, Phys. Rev. Lett., 106, 030401, (2011), https://doi.org/10.1103/PhysRevLett.106.030401
  • Ganesh, R., Isakov, S.V., Paramekanti, A., Néel to Dimer Transition in Spin-S Antiferromagnets: Comparing Bond Operator Theory with Quantum Monte Carlo Simulations for Bilayer Heisenberg Models, Phys. Rev. B, 84, 214412, (2011), https://doi.org/10.1103/PhysRevB.84.214412
  • Goicochea, J.V., Hu, M., Michel, B., Poulikakos, D., Surface Functionalization Mechanisms of Enhancing Heat Transfer at Solid-Liquid Interfaces, J. Heat Transf., 133(8), 082401, (2011), https://doi.org/10.1115/1.4003533
  • Grasso, G.I., Arena, G., Bellia, F., Maccarrone, G., Parinello, M., Pietropaolo, A., Vecchio, G., Rizzarelli, E., Intramolecular Weak Interactions in the Thermodynamic Stereoselectivity of Copper(II) Complexes with Carnosine–Trehalose Conjugates, Chem. Eur. J., 17, (2011), 9448-9455, https://doi.org/10.1002/chem.201100313
  • Gull, E., Staar, P., Fuchs, S., Nukala, Ph., Summers, M.S., Pruschke, T., Schulthess, T.C., Maier, Th., Submatrix Updates for the Continuous-Time Auxiliary-Field Algorithm, Phys. Rev. B, 83, 075122, (2011), https://doi.org/10.1103/PhysRevB.83.075122
  • Helmuth, J.A., Reboux, S., Sbalzarini, I.F., Exact Stochastic Simulations of Intra-Cellular Transport by Mechanically Coupled Molecular Motors, J. Comput. Sci., 2(4), (2011), 324-334, https://doi.org/10.1016/j.jocs.2011.08.006
  • Horta, B.A.C., Fuchs, P.F.J., van Gunsteren, W.F., Hünenberger, Ph.H., New Interaction Parameters for Oxygen Compounds in the GROMOS Force Field: Improved Pure-Liquid and Solvation Properties for Alcohols, Ethers, Aldehydes, Ketones, Carboxylic Acids, and Esters, J. Chem. Theory Comput., 7(4), (2011), 1016-1031, https://doi.org/10.1021/ct1006407
  • Hu, M., Giapis, K.P., Goicochea, J.V., Zhang, X., Poulikakos, D., Significant Reduction of Thermal Conductivity in Si/Ge Core−Shell Nanowires, Nano Lett., 11(2), (2011), 618-623, https://doi.org/10.1021/nl103718a
  • Hu, M., Giapis, K.P., Poulikakos, D., Interfacial Mixing During Annealing of Zinc Oxide Nanoparticle Junctions, Appl. Phys. Lett., 98, 211904, (2011), http://dx.doi.org/10.1063/1.3593487
  • Hutter, C., Zenklusen, A., Kuhn, S., von Rohr, Ph.R., Large Eddy Simulation of Flow Through a Streamwise-Periodic Structure, Chem. Eng. Soc., 66(3), (2011), 519-529, https://doi.org/10.1016/j.ces.2010.11.015
  • Isakov, S.V., Hastings, M.B., Melko, R.G., Topological Entanglement Entropy of a Bose–Hubbard Spin Liquid, Nature Phys., 7, (2011), 772-775, https://doi.org/10.1038/nphys2036
  • Kappeler, R., Kaspar, P., Jackel, H., Loss-Relevant Structural Imperfections in Substrate-Type Photonic Crystal Waveguides, J. Lightwave Technol., 29(21), (2011), 3156-3166, https://doi.org/10.1109/JLT.2011.2167218
  • Khan, A, Zunino, A., Deschamps, F., The Thermo-Chemical and Physical Structure Beneath the North American Continent from Bayesian Inversion of Surface-Wave Phase Velocities, J. Geophys. Res. Sol. Ea., 116(9), JB008380, (2011), http://dx.doi.org/10.1029/2011JB008380
  • Lachkar, Z., Gruber, N., What Controls Biological Production in Coastal Upwelling Systems? Insights from a Comparative Modeling Study, Biogeosciences, 8, (2011), 2961-2976, https://doi.org/10.5194/bg-8-2961-2011
  • Misselwitz, B., Dilling, S., Vonaesch, P., Sacher, R., Snijder, B., Schlumberger, M., Rout, S., Stark, M., von Mering, Ch., Pelkmans, L., Hardt, W.-D., RNAi Screen of Salmonella Invasion Shows Role of COPI in Membrane Targeting of Cholesterol and Cdc42, Mol. Syst. Biol., 7(1), 474, (2011), https://doi.org/10.1038/msb.2011.7
  • Misselwitz, B., Kreibich, S.K., Rout, S., Stecher, B., Periaswamy, B., Hardt, W.-D., Salmonella Enterica Serovar Typhimurium Binds to HeLa Cells via Fim-Mediated Reversible Adhesion and Irreversible Type Three Secretion System 1-Mediated Docking, Infect. Immun., 79(1), (2011), 330-341, https://doi.org/10.1128/IAI.00581-10
  • Nakagawa, T., Effect of a Stably Stratified Layer Near the Outer Boundary in Numerical Simulations of a Magnetohydrodynamic Dynamo in a Rotating Spherical Shell and Its Implications for Earth’s Core, Phys. Earth Planet. In., 187, (2011), 342-352, https://doi.org/10.1016/j.pepi.2011.06.001
  • Nakagawa, T., Tackley, P.J., Effects of Low-Viscosity Post-Perovskite on Thermo-Chemical Mantle Convection in a 3-D Spherical Shell, Geophys. Rev. Lett., 38(4), L04309, (2011), https://doi.org/10.1029/2010GL046494
  • Ohzeki, M., Thomas, C.K., Katzgraber, H.G., Bombin, H., Martin-Delgado, M.A., Universality in Phase Boundary Slopes for Spin Glasses on Self-Dual Lattices, J. Stat. Mech., 2011, P02004, (2011), https://doi.org/10.1088/1742-5468/2011/02/P02004
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  • Proutiere, F., Schoenebeck, F., Solvent Effect on Palladium-Catalyzed Cross-Coupling Reactions and Implications on the Active Catalytic Species, Angew. Chem. Int. Ed., 50, (2011), 8192-8195, http://dx.doi.org/10.1002/anie.201101746
  • Rossinelli, D., Conti, Ch., Koumoutsakos, P., Mesh–Particle Interpolations on Graphics Processing Units and Multicore Central Processing Units, Phil. Trans. R. Soc. A, 369, (2011), 2164-2175, https://doi.org/10.1098/rsta.2011.0074
  • Rossinelli, D., Hejazialhosseini, B., Spampinato, D.G., Koumoutsakos, P., Multicore/Multi-GPU Accelerated Simulations of Multiphase Compressible Flows Using Wavelet Adapted Grids, SIAM J. Sci. Comput., 33(2), 512-540, https://doi.org/10.1137/100795930
  • Yang, K.-Y., Kozik, E., Wang, X., Troyer, M., Diagrammatic Quantum Monte Carlo Solution of the Two-Dimensional Cooperon-Fermion Model, Phys. Rev. B, 93, 214516, (2011), https://doi.org/10.1103/PhysRevB.83.214516

2010

  • Bakr, W.S., Peng, A., Tai, M.E., Ma, R., Simon, J., Gillen J.I., Fölling, S., Pollet, L., Greiner, M., Probing the Superfluid–to–Mott Insulator Transition at the Single-Atom Level, Science, 329, (2010), 547-550, https://doi.org/10.1126/science.1192368
  • Bauer, B., Gull, E., Trebst, S., Troyer, M., Huse, D.A., Optimized Broad-Histogram Simulations for Strong First-Order Phase Transitions: Droplet Transitions in the Large-Q Potts Model, J. Stat. Mech.-Theory E., 2010, P01020, (2010), https://doi.org/10.1088/1742-5468/2010/01/P01020
  • Eckstein, M., Kollar, M., Werner, Ph., Interaction Quench in the Hubbard Model: Relaxation of the Spectral Function and the Optical Conductivity, Phys. Rev. B, 81, 115131, (2010), https://doi.org/10.1103/PhysRevB.81.115131
  • Eckstein, M., Werner, Ph., Nonequilibrium Dynamical Mean-Field Calculations Based on the Noncrossing Approximation and Its Generalizations, Phys. Rev. B, 82, 115115, (2010), https://doi.org/10.1103/PhysRevB.82.115115
  • Gull, E., Ferrero, M., Parcollet, O., Georges, A., Millis, A.J., Momentum-Space Anisotropy and Pseudogaps: A Comparative Cluster Dynamical Mean-Field Analysis of the Doping-Driven Metal-Insulator Transition in the Two-Dimensional Hubbard Model, Phys. Rev. B, 82, 155101, (2010), https://doi.org/10.1103/PhysRevB.82.155101
  • Gull, E., Reichman, D.R., Millis, A.J., Bold-Line Diagrammatic Monte Carlo Method: General Formulation and Application to Expansion Around the Noncrossing Approximation, Phys. Rev. B, 82, 075109, (2010), https://doi.org/10.1103/PhysRevB.82.075109
  • Hu, M., Giapis, K.P., Goicochea, J.V., Poulikakos, D., Surface Segregation of Bimetallic Alloys in Nanoscale Confinement, Appl. Phys. Lett., 97, 153107, (2010), https://doi.org/10.1063/1.3500825
  • Hu, M., Goicochea, J.V., Michel, B., Poulikakos, D., Water Nanoconfinement Induced Thermal Enhancement at Hydrophilic Quartz Interfaces, Nano Lett., 10(1), (2010), 279-285, https://doi.org/10.1021/nl9034658
  • Hu, M., Poulikakos, D., Grigoropoulos, C.P., Pan, H., Recrystallization of Picosecond Laser-Melted ZnO Nanoparticles in a Liquid: A Molecular Dynamics Study, J. Chem. Phys., 132, 164504, (2010), https://doi.org/10.1063/1.3407438
  • Katzgraber, H.G., Bombin, H., Andrist, R.S., Martin-Delgado, M.A., Topological Color Codes on Union Jack Lattices: a Stable Implementation of the Whole Clifford Group, Phys. Rev. A, 81, 012319, (2010), https://doi.org/10.1103/PhysRevA.81.012319
  • Larson, D., Katzgraber, H.G., Moore, M.A., Young, A.P., Numerical Studies of a One-Dimensional Three-Spin Spin-Glass Model with Long-Range Interactions, Phys. Rev. B, 81, 064415, https://doi.org/10.1103/PhysRevB.81.064415
  • Lin, N., Gull, E., Millis, A.J., Physics of the Pseudogap in Eight-Site Cluster Dynamical Mean-Field Theory: Photoemission, Raman Scattering, and In-Plane and c-Axis Conductivity, Phys. Rev. B, 82, 045104, (2010), https://doi.org/10.1103/PhysRevB.82.045104
  • Ma, P.N., Pollet, L., Troyer, M., Measuring the Equation of State of Trapped Ultracold Bosonic Systems in an Optical Lattice with in Situ Density Imaging, Phys. Rev. A, 82, 033627, (2010), https://doi.org/10.1103/PhysRevA.82.033627
  • Mayer, L., Kazantzidis, S., Escala, A., Callegari, S., Direct Formation of Supermassive Black Holes via Multi-Scale Gas Inflows in Galaxy Mergers, Nature, 466, (2010), 1082-1084, https://doi.org/10.1038/nature09294
  • Misselwitz, B., Strittmatter, G., Periaswamy, B., Schlumberger, M.C., Rout, S., Horvath, P., Kozak, K., Hardt, W.-D., Enhanced CellClassifier: a Multi-Class Classification Tool for Microscopy Images, BMC Bioinformatics, 11, 30, (2010), https://doi.org/10.1186/1471-2105-11-30
  • Nakagawa, T., Tackley, P.J., Influence of Initial Cmb Temperature and Other Parameters on the Thermal Evolution of Earth’s Core Resulting From Thermochemical Spherical Mantle Convection, Geochem. Geophys. Geosyst., 11(6), Q06001, (2010), https://doi.org/10.1029/2010GC003031
  • Nakagawa, T., Tackley, P.J., Deschamps, F., Connolly, J.A.D., The Influence of MORB and Harzburgite Composition on Thermo-Chemical Mantle Convection in a 3-D Spherical Shell with Self-Consistently Calculated Mineral Physics, Earth Planet. Sci. Lett., 296, (2010), 403-412, https://doi.org/10.1016/j.epsl.2010.05.026
  • Rossinelli, D., Hejazialhosseini, B., Bergdorf, M., Koumoutsakos, P., Wavelet-Adaptive Solvers on Multi-Core Architectures for the Simulation of Complex Systems, Concurr. Comp. Pract. E., 23(2), (2010), 172-186, https://doi.org/10.1002/cpe.1639
  • Trotzky, S., Pollet, L., Gerbier, F., Schnorrberger, U., Bloch, I., Prokof'ev, N.V., Svistunov, B., Troyer, M., Suppression of the Critical Temperature for Superfluidity Near the Mott Transition, Nat. Phys., 6, (2010), 998-1004, https://doi.org/10.1038/nphys1799
  • Valla, P.G., Herman, F., van der Beek, P.A., Braun, J., Inversion of Thermochronological Age-Elevation Profiles to Extract Independent Estimates of Denudation and Relief History — I: Theory and Conceptual Model, Earth Planet. Sc. Lett., 295, (2010), 511-522, https://doi.org/10.1016/j.epsl.2010.04.033
  • Werner, Ph., Millis, A.J., Dynamical Screening in Correlated Electron Materials, Phys. Rev. Lett., 104, 146401, (2010), https://doi.org/10.1103/PhysRevLett.104.146401
  • Werner, Ph., Oka, T., Eckstein, M., Millis, A.J., Weak-Coupling Quantum Monte Carlo Calculations on the Keldysh Contour: Theory and Application to the Current-Voltage Characteristics of the Anderson Model, Phys. Rev. B, 81, 035108, (2010), https://doi.org/10.1103/PhysRevB.81.035108
  • Yamada, M., Schweizer, W.B., Schönebeck, F., Diederich, F., Unprecedented Thermal Rearrangement of Push–pull-Chromophore–[60]fullerene Conjugates: Formation of Chiral 1,2,9,12-Tetrakis-Adducts, Chem. Commun., 46, (2010), 5334-5336, https://doi.org/10.1039/C0CC00881H

2009

  • Belina, F.A., Ernst, J.R., Holliger, K., Inversion of Crosshole Seismic Data in Heterogeneous Environments: Comparison of Waveform and Ray-Based Approaches, J. Appl. Geophys., 68(1), (2009), 85-94, https://doi.org/10.1016/j.jappgeo.2008.10.012
  • Bonomi, M., Barducci, A., Parrinello, M., Reconstructing the Equilibrium Boltzmann Distribution from Well-Tempered Metadynamics, J. Comput. Chem., 30, (2009), 1615-1621, https://doi.org/10.1002/jcc.21305
  • Feldmann, R., Carollo, C.M., Mayer, L., Renzini, A., Lake, G., Quinn, T., Stinson, G.S., Yepes, G., The Evolution of Central Group Galaxies in Hydrodynamical Simulations, ApJ, 709(1), 218, (2009), https://doi.org/10.1088/0004-637X/709/1/218
  • Golabek, G.J., Gerya, T.V., Kaus, B.J.P., Ziethe, R., Tackley, P.J., Rheological Controls on the Terrestrial Core Formation Mechanism, Geochem. Geophys. Geosyst., 10(11), Q11007, (2009), https://doi.org/10.1029/2009GC002552
  • Gull, E., Parcollet, O., Werner, Ph., Millis, A.J., Momentum-Sector-Selective Metal-Insulator Transition in the Eight-Site Dynamical Mean-Field Approximation to the Hubbard Model in Two Dimensions, Phys. Rev. B, 80, 245102, (2009), https://doi.org/10.1103/PhysRevB.80.245102
  • Hu., M., Goicochea, J.V., Michel, B., Poulikakos, D., Thermal Rectification at Water/Functionalized Silica Interfaces, Appl. Phys. Lett., 95, 151903, (2009), https://doi.org/10.1063/1.3247882
  • Läuchli, A.M., Werner, Ph., Krylov Implementation of the Hybridization Expansion Impurity Solver and Application to 5-Orbital Models, Phys. Rev. B, 80, 235117, (2009), https://doi.org/10.1103/PhysRevB.80.235117
  • Li, Zh., Gerya, T.V., Polyphase Formation and Exhumation of High- To Ultrahigh-Pressure Rocks in Continental Subduction Zone: Numerical Modeling and Application to the Sulu Ultrahigh-Pressure Terrane in Eastern China, J. Geophys. Res. Sol. Ea., 114(B9), B09406, (2009), https://doi.org/10.1029/2008JB005935
  • Lin, N., Gull, E., Millis, A.J., Optical Conductivity from Cluster Dynamical Mean-Field Theory: Formalism and Application to High-Temperature Superconductors, Phys. Rev. B, 80, 161105(R), (2009), https://doi.org/10.1103/PhysRevB.80.161105
  • Pollet, L., Prokof'ev, N.V., Svistunov, B.V., Troyer, M., Absence of a Direct Superfluid to Mott Insulator Transition in Disordered Bose Systems, Phys. Rev. Lett., 103, 140402, (2009), https://doi.org/10.1103/PhysRevLett.103.140402
  • Söyler, Ş.G., Kuklov, A.B., Pollet, L., Prokof'ev, N.V., Svistunov, B.V., Underlying Mechanism for the Giant Isochoric Compressibility of Solid 4He: Superclimb of Dislocations, Phys. Rev. Lett., 103, 175301, (2009), https://doi.org/10.1103/PhysRevLett.103.175301
  • Werner, Ph., Gull, E., Millis, A.J., Metal-Insulator Phase Diagram and Orbital Selectivity in Three-Orbital Models with Rotationally Invariant Hund Coupling, Phys. Rev. B, 79, 115119, (2009), https://doi.org/10.1103/PhysRevB.79.115119
  • Werner, Ph., Gull, E., Parcollet, O., Millis, A.J., Momentum-Selective Metal-Insulator Transition in the Two-Dimensional Hubbard Model: An 8-Site Dynamical Cluster Approximation Study, Phys. Rev. B, 80, 045120, (2009), https://doi.org/10.1103/PhysRevB.80.045120

2008

  • Gerbier, F., Trotzky, S., Fölling, S., Schnorrberger, U., Thompson, J.D., Widera, A., Bloch, I., Pollet, L., Troyer, M., Capogrosso-Sansone, B., Prokof'ev, N.V., Svistunov, B.V., Expansion of a Quantum Gas Released from an Optical Lattice, Phys. Rev. Lett., 101, 155303, (2008), https://doi.org/10.1103/PhysRevLett.101.155303
  • Gull, E., Werner, Ph., Wang, X., Troyer, M., Millis, A.J., Local Order and the Gapped Phase of the Hubbard Model: A Plaquette Dynamical Mean-Field Investigation, EPL, 84, 37009, (2008), https://doi.org/10.1209/0295-5075/84/37009

HPC team without specifying a cluster (2007-now)

2024

  • Arcieri, G., Hoelzl, C., Schwery, O., Straub, D., Papakonstantinou, K.G., POMDP Inference and Robust Solution via Deep Reinforcement Learning: An Application to Railway Optimal Maintenance, Mach. Learn., 113, (2024), 7967-7995, https://doi.org/10.1007/s10994-024-06559-2
  • Gehrmann-De Ridder, A., Gehrmann, T., Glover, E.W.N., Huss, A., Ridriguez Garcia, A., Stagnitto, G., Precise QCD Predictions for W-Boson Production in Association with a Charm Jet, Eur. Phys. J. C., 84, 361, (2024), https://doi.org/10.1140/epjc/s10052-024-12715-8

2023

  • Gauld, R., Gehrmann-De Ridder, A., Glover, E.W.N., Huss, A., Rodriguez Garcia, A., Stagnitto, G., NNLO QCD Predictions for Z-Boson Production in Association with a Charm Jet within the LHCb Fiducial Region, Eur. Phys. J. C, 83, 336, (2023), https://doi.org/10.1140/epjc/s10052-023-11530-x
  • Gehrmann-De Ridder, A., Gehrmann, T., Glover, E.W.N., Huss, A., Preuss, C.T., Walker, D.M., Precision Phenomenology With Fiducial Cross Sections In the Triple-Differential Drell-Yan Process, J. High Energy Phys., 2023, 2, (2023), https://doi.org/10.1007/JHEP05(2023)002

2022

  • Cai, Zh.-F., Käser, T., Kumar, N., Zenobi, R., Visualizing On-Surface Decomposition Chemistry at the Nanoscale Using Tip-Enhanced Raman Spectroscopy, J. Phys. Chem. Lett., 13, (2022), 4864-4870, https://doi.org/10.1021/acs.jpclett.2c01112
  • Cai, Zh.-F., Merino, J.P., Fang, W., Kumar, N., Richardson, J.O., De Feyter, S., Zenobi, R., Molecular-Level Insights on Reactive Arrangement in On-Surface Photocatalytic Coupling Reactions Using Tip-Enhanced Raman Spectroscopy, J. Am. Chem. Soc., 144, (2022), 538-546, https://doi.org/10.1021/jacs.1c11263
  • Shao, F., Zheng, L., Lan, J., Zenobi, R., Nanoscale Chemical Imaging of Coadsorbed Thiolate Self-Assembled Monolayers on Au(111) by Tip-Enhanced Raman Spectroscopy, Anal. Chem., 94, (2022), 1645-1653, https://doi.org/10.1021/acs.analchem.1c03968
  • Zheng, L.-Q., Yang, S., Krähenbühl, S., Rybkin, V.V, Lan, J., Aprahamian, I., Zenobi, R., Effect of the Alkyl Linker Length on the Photoisomerization of Hydrazone Switches on Metal Surfaces, Mater. Today Chem., 24, 100797, (2022)

2021

  • Bartolomeo, G.L., Zhang, Y., Kumar, N., Zenobi, R., Molecular Perturbation Effects in AFM-Based Tip-Enhanced Raman Spectroscopy: Contact versus Tapping Mode, Anal. Chem., 93, (2021), 15358-15364, https://doi.org/10.1021/acs.analchem.1c03004
  • Cai, Zh.-F., Zheng, L.-Q., Zhang, Y., Zenobi, R., Molecular-Scale Chemical Imaging of the Orientation of an OnSurface Coordination Complex by Tip-Enhanced Raman Spectroscopy, J. Am. Chem. Soc., 143, (2021), 12380-12386, https://doi.org/10.1021/jacs.1c06366
  • Klose, D., Holla, A., Gmeiner, Ch., Nettels, D., Ritsch, I., Bross, N., Yulikov, M., Allain, F.H.-T., Schuler, B., Jeschke, G., Resolving Distance Variations by Single-Molecule FRET and EPR Spectroscopy Using Rotamer Libraries, Biophys. J., 120(21), (2021), 4842-4858, https://doi.org/10.1016/j.bpj.2021.09.021
  • Thiery, W., Lange, St., Rogelj, J., Schleussner, C.-F., Gudmundsson, L., Seneviratne, S.I., Andrijevic, M., Frieler, K., Emanuel, K., Geiger, T., Bresch, D.N., Zhao, F., Willner, S.V., Büchner, M., Volkholz, J., Bauer, N., Chang, J., Ciais, Ph., Dury, M., François, L., Grillakis, M., Gosling, S.N., Hanasaki, N., Hickler, Th., Huber, V., Ito, A., Jägermeyr, J., Khabarov, N., Koutroulis, A., Liu, W., Lutz, W., Mengel, M., Müller, Ch., Ostberg, S., Reyer, Ch.P.O., Stacke, T., Wada, Y., Intergenerational Inequities in Exposure to Climate Extremes, Science, 374(6564), (2021), 158-160, https://doi.org/10.1126/science.abi7339

2020

  • Thiery, W., Visser, A.J., Fischer, E.M., Hauser, M., Hirsch, A.L., Lawrence, D.M., Lejeune, Q., Davin, E.L., Seneviratne, S.I., Warming of Hot Extremes Alleviated by Expanding Irrigation, Nat. Commun., 11, 290, (2020), https://doi.org/10.1038/s41467-019-14075-4
  • Yin, H., Zhen, L.-Q., Fang, W., Lai, Y.-H., Porenta, N., Goubert, G., Zhang, H., Su, H.-Sh., Ren, B., Richardson, J.O., Li, J.-F., Zenobi, R., Nanometre-Scale Spectroscopic Visualization of Catalytic Sites During a Hydrogenation Reaction on a Pd/Au Bimetallic Catalyst, Nat. Catal., 3, (2020), 834-842, https://doi.org/10.1038/s41929-020-00511-y

2019

  • Grimmel, S.A., Reiher, M., The Electrostatic Potential as a Descriptor for the Protonation Propensity in Automated Exploration of Reaction Mechanisms, Faraday Discuss., 2019, (2019), 443-463, https://doi.org/10.1039/c9fd00061e
  • Zheng, L.-Q., Servalli, M., Schlüter, A.D., Zenobi, R., Tip-Enhanced Raman Spectroscopy for Structural Analysis of Two-Dimensional Covalent Monolayers Synthesized on Water and on Au (111), Chem. Sci., 10, (2019), 9673-9678, https://doi.org/10.1039/C9SC03296G
  • Zheng, L.-Q., Lan, J., Gyr, L., Goubert, G., Qian, H., Aprahamian, I., Zenobi, R., Solution Phase and Surface Photoisomerization of a Hydrazone Switch with a Long Thermal Half-Life, J. Am. Chem. Soc., 141, (2019), 17637-17645, https://doi.org/10.1021/jacs.9b07057

2018

  • Zheng, L.-Q., Wang, X., Shao, F., Hegner, M., Zenobi, R., Nanoscale Chemical Imaging of Reversible Photoisomerization of an Azobenzene-Thiol Self-Assembled Monolayer by Tip-Enhanced Raman Spectroscopy, Angew. Chem., 130(4), (2018), 1037-1041, https://doi.org/10.1002/ange.201710443

2016

  • Dai, W., Shao, F., Szczerbiński, J., McCaffrey, R., Zenobi, R., Jin, Y., Schlüter, A.D., Zhang, W., Synthesis of a Two-Dimensional Covalent Organic Monolayer through Dynamic Imine Chemistry at the Air/Water Interface, Angew. Chem., 128(1), (2016), 221-225, https://doi.org/10.1002/ange.201508473

2014

2013

  • Latouche, C., Kahlal, S., Furet, E., Liao, P.-K., Lin, Y.-R., Fang, Ch.-Sh., Cuny, J., Liu, C.W., Saillard, J.-Y., Shape Modulation of Octanuclear Cu(I) or Ag(I) Dichalcogeno Template Clusters with Respect to the Nature of their Encapsulated Anions: A Combined Theoretical and Experimental Investigation, Inorg. Chem., 52(13), (2013), 7752-7765, https://doi.org/10.1021/ic400959a

2012

  • Belina, F., Irving, J., Ernst, J., Holliger, K., Evaluation of the Reconstruction Limits of a Frequency-Independent Crosshole Georadar Waveform Inversion Scheme in the Presence of Dispersion, J. Appl. Geophys., 78, (2012), 9-19, https://doi.org/10.1016/j.jappgeo.2011.03.003
  • Eshet, H., Khaliullin, R.Z., Kühne, Th.D., Behler, J., Parrinello, M., Microscopic Origins of the Anomalous Melting Behavior of Sodium under High Pressure, Phys. Rev. Lett., 108, 115701, (2012), https://doi.org/10.1103/PhysRevLett.108.115701
  • Hassanali, A., Cuny, J., Ceriotti, M., Pickard, Ch.J., Parrinello, M., The Fuzzy Quantum Proton in the Hydrogen Chloride Hydrates, J. Am. Chem. Soc., 134, (2012), 8557-8569, https://doi.org/10.1021/ja3014727
  • Muñoz-Santiburcio, D., Kosa, M., Hernández-Laguna, A., Sainz-Díaz, C.I., Parrinello, M., Ab Initio Molecular Dynamics Study of the Dehydroxylation Reaction in a Smectite Model, J. Phys. Chem. C, 116, 12203-12211, (2012), https://doi.org/10.1021/jp301366r

2011

  • Khaliullin, R.Z., Eshet, H., Kühne, Th.D., Behler, J., Parrinello, M., Nucleation Mechanism for the Direct Graphite-To-Diamond Phase Transition, Nat. Mater., 10, (2011), 693-697, https://doi.org/10.1038/nmat3078
  • Prakash, M.K., Barducci, A., Parrinello, M., Replica Temperatures for Uniform Exchange and Efficient Roundtrip Times in Explicit Solvent Parallel Tempering Simulations, J. Chem. Theory Comput., 7(7), (2011), 2025-2027, https://doi.org/10.1021/ct200208h
  • Mischo, B., Burdet, A., Abhari, R.S., Influence of Stator-Rotor Interaction on the Aerothermal Performance of Recess Blade Tips, J. Turbomach., 133(1), 011023, (2011), https://doi.org/10.1115/1.4001134
  • Schaefer, J.F., Boschi, L., Kissling, E., Adaptively Parametrized Surface Wave Tomography: Methodology and a New Model of the European Upper Mantle, Geophys. J. Int., 186, (2011), 1431-1453, https://doi.org/10.1111/j.1365-246X.2011.05135.x

2010

  • Awile, O., Demirel, Ö., Sbalzarini, I.F., Toward an Object-Oriented Core of the PPM Library, AIP Conf. Proc., 1281, 1313, (2010), https://doi.org/10.1063/1.3497957
  • Khaliullin, R.Z., Eshet, H., Kühne, Th.D., Behler, J., Parrinello, M., Graphite-Diamond Phase Coexistence Study Employing a Neural-Network Mapping of the Ab Initio Potential Energy Surface, Phys. Rev. B, 81, 100103(R), (2010), https://doi.org/10.1103/PhysRevB.81.100103

2008

Conference contributions referencing HPC clusters of ETH or the HPC team

Euler (2014-now)

2024

  • Ilter, O., Armeni, I., Pollefeys, M., Barath, D., Semantically Guided Feature Matching for Visual SLAM, 2024 IEEE International Conference on Robotics and Automation (ICRA), (2024), 12013-12019, https://doi.org/10.1109/ICRA57147.2024.10610238
  • Nobar, M., Keller, J., Rupenyan, Khosravi, M., Lygeros, J., Guided Bayesian Optimization: Data-Efficient Controller Tuning With Digital Twin, IEEE Transactions on Automation Science and Engineering, (2024), 1-14, https://doi.org/10.1109/TASE.2024.3454176
  • Pagonakis, I.Gr., Genoud, J., Hogge, J.-Ph., Barnes, A.B., Thorough Simulation of High-Power Gyrotron Cavity Interaction in the Hard Excitation Regime, 2024 Joint International Vacuum Electronics Conference and International Vacuum Electron Sources Conference (IVEC + IVESC), 01-02, (2024), https://doi.org/10.1109/IVECIVESC60838.2024.10694883

2023

  • Elmorsy, M., Vassiliou, M.F., GROUND MOTION PROCESSING IN ROCKING STRUCTURES, COMPDYN 2023, 9th ECCOMAS Thematic Conference on Computational Methods in Structural Dynamics and Earthquake Engineering, Athenes, Greece, (2023), https://doi.org/10.3929/ethz-b-000615923
  • Kagho, G.O., Balac, M., Identifying and Planning for Group Travellers in On-Demand Mobility Models, IEEE Open Journal of Intelligent Transportation Systems, 4, (2023), 785-799, https://doi.org/10.1109/OJITS.2023.3328492
  • Kanellopoulos, C., Jeremic, B., Anastasopoulos, I., Stojadinovic, B., Resonant Metamaterials for highfrequency vibration mitigation in Nuclear Power Plants, EURODYN 2023, Proceedings of the XI International Conference on Structural Dynamics, (2023), https://doi.org/10.3929/ethz-b-000644716
  • Kaufmann, M., Song, J., Guo, Ch., Shen, K., Jiang, T., Tang, Ch., Zarate, J., Hilliges, O., EMDB: The Electromagnetic Database of Global 3D Human Pose and Shape in the Wild, ICCV 2023, (2023), https://arxiv.org/pdf/2308.16894.pdf

2022

  • Gote, Ch., Mavrodiev, P., Schweitzer, F., Scholtes, I., Big Data = Big Insights? Operationalising Brooks' Law in a Massive GitHub Data Set, ACM 44th International Conference on Software Engineering, ICSE, (2022), 262-273, https://doi.org/10.1145/3510003.3510619
  • Kraus, M.A., Bischof, R., Kaufmann, W., Thoma, K., Artificial intelligence - finite element method - hybrids for efficient nonlinear analysis of concrete structures, Acta Polytechnica CTU Proceedings, 36, (2022), 99-108, https://doi.org/10.14311/APP.2022.36.0099
  • Pagonakis, I.Gr., Genoud, J., Gao, Ch., Sirigiri, J.R., Alaniva, N.H., Alberti, St., Angehn, F.N., Björgvinsdóttir, S., Chen, P.-H., Däpp, A., Gunzenhauser, R., Hogge, J.-Ph., Käser, T., Millen, M., Urban, M., Barnes, A.B., Development of Kilowatt THz Gyrotrons for Pulsed Dynamic Nuclear Polarization - Cavity Design Code Phaedra, 47th International Conference on Infrared, Millimeter and Terahertz Waves, IRMMW-THz, (2022), 1-2, https://doi.org/10.1109/IRMMW-THz50927.2022.9895907
  • Paulus, M.B., Zarpellon, G., Krause, A., Charlin, L., Maddison, Ch., Learning to Cut by Looking Ahead: Cutting Plane Selection via Imitation Learning, Proceedings of the 39th International Conference on Machine Learning, PMLR 162, (2022), 17584-17600, https://proceedings.mlr.press/v162/paulus22a.html
  • Stai, E., Stanojev, O., De Nardis Di Prata, R., Hug, G., Distributed Reinforcement Learning for Real-Time Batteries Control Using Lagrangian Decomposition, 2022 International Conference on Smart Energy Systems and Technologies (SEST), (2022), 1-6, https://doi.org/10.1109/SEST53650.2022.9898504

2021

  • Accaputo, G., Derlet, P.M., Arbenz, P., Solving Large-Scale Interior Eigenvalue Problems to Investigate the Vibrational Properties of the Boson Peak Regime in Amorphous Materials, High Performance Computing in Science and Engineering, HPCSE 2019, LNCS, vol 12456, (2021), 80-98, https://doi.org/10.1007/978-3-030-67077-1_5
  • Keskinen, K., Giannakopoulos, G., Bolla, M., Koch, J., Wright, Y.M., Frouzakis, Ch., Boulouchos, K., Schmidt, M., Böhm, B, Dreizler, A., Novel Insight into Engine Near-Wall Flows and Wall Heat Transfer Using Direct Numerical Simulations and High-Fidelity Experiments 21. Internationales Stuttgarter Symposium, Proceedings, (2021), 377-394, https://doi.org/10.1007/978-3-658-33521-2_26
  • Rossinelli, D., Fourestey, G., Schmidt, F., Busse, B., Kurtcuoglu, V., High-Throughput Lossy-to-Lossless 3D Image Compression, IEEE Transactions on Medical Imaging, 40(2), (2021), 607-620, https://doi.org/10.1109/TMI.2020.3033456

2020

  • Wu, R., Sansavini, G., Parameter Estimation for Distribution Grid Reliability Assessment, 2020 International Conference on Probabilistic Methods Applied to Power Systems (PMAPS), (2020), 1-6, https://doi.org/10.1109/PMAPS47429.2020.9183408

2019

  • Franckié, M., Bosco, L., Beck, M., Mavrona, E., Faist, J., Optimization and Fabrication of Two-Quantum Well THz QCLs Operating Above 200 K, 2019 Conference on Lasers and Electro-Optics, CLEO, (2019), 1-2, https://doi.org/10.1364/CLEO_SI.2019.SW4F.1
  • Geissmann, B., Gianinazzi, L., Routing in Stochastic Public Transit Networks, 19th Symposium on Algorithmic Approaches for Transportation Modelling, Optimization, and Systems (ATMOS 2019), (2019), 4:1-4:18, https://doi.org/10.4230/OASIcs.ATMOS.2019.4
  • Michau, G., Fink, O., Unsupervised Fault Detection in Varying Operating Conditions, 2019 IEEE International Conference on Prognostics and Health Management (ICPHM), (2019), 1-10, https://doi.org/10.1109/ICPHM.2019.8819383
  • Nikolić, J., Schöengens, M., Pournaras, E., Train Global, Test Local: Privacy-Preserving Learning of Cost-Effectiveness in Decentralized Systems, Advances in Intelligent Networking and Collaborative Systems, INCoS 2018, LNDECT, vol 23, (2019), 88-102, https://doi.org/10.1007/978-3-319-98557-2_9
  • Sferrazza, C., Wahlsten, A., Trueeb, C., D’Andrea, R., Ground Truth Force Distribution for Learning-Based Tactile Sensing: A Finite Element Approach, IEEE Access, 7, (2019), 173438-173449, https://doi.org/10.1109/ACCESS.2019.2956882
  • Wenk, Ph., Gotovos, A., Bauer, St., Gorbach, N.S., Krause, A., Buhmann, J.M., Fast Gaussian Process Based Gradient Matching for Parameter Identification in Systems of Nonlinear ODEs, Proceedings of the Twenty-Second International Conference on Artificial Intelligence and Statistics, PMLR 89, (2019), 1351-1360, https://doi.org/10.3929/ethz-b-000385688

2018

  • Arbenz, P., Hupp, D., Obrist, D., Comparison of Parallel Time-Periodic Navier-Stokes Solvers, Parallel Processing and Applied Mathematics, PPAM 2017, LNCS, vol 10777, (2018), 57-67, https://doi.org/10.1007/978-3-319-78024-5_6
  • Blume, S.O.P., Sansavini, G., The Influence of Load Characteristics on Early Warning Signs in Power Systems, Critical Information Infrastructures Security, CRITIS 2017, LNCS 10707, (2018), 72-83, https://doi.org/10.1007/978-3-319-99843-5_7
  • Chen, Y.Q., Fink, O., Sansavini, G., Combined Fault Location and Classification for Power Transmission Lines Fault Diagnosis With Integrated Feature Extraction, IEEE Trans. Ind. Electron., 65(1), (2018), 561-569, https://doi.org/10.1109/TIE.2017.2721922
  • Herrmann, L., Schwab, C., QMC Algorithms with Product Weights for Lognormal-Parametric, Elliptic PDEs, Monte Carlo and Quasi-Monte Carlo Methods, MCQMC 2016, Springer Proceedings in Mathematics & Statistics, vol 241., (2018), 313-330, https://doi.org/10.1007/978-3-319-91436-7_17
  • Kranjčević, M., Adelmann, A., Arbenz, P., Gorgi Zadeh, S., van Rienen, U., Constrained Multi-Objective Shape Optimization of Superconducting RF Cavities to Counteract Dangerous Higher Order Modes, 13th Int. Computational Accelerator Physics Con, (2018), 293-296, https://doi.org/10.18429/JACoW-ICAP2018-TUPAG14
  • Yu, Zh., Stanković, Shea, K., Computational Design of a Personalized Artificial Spinal Disc for Additive Manufacturing With Physiological Rotational Motions, Proceedings of the ASME 2018 International Design Engineering Technical Conferences and Computers and Information in Engineering Conference, IDETC/CIE 2018, (2018), 1-10, https://doi.org/10.1115/DETC2018-85921

2017

  • Paden, B., Nager, Y., Frazzoli, E., Landmark guided probabilistic roadmap queries, IEEE/RSJ International Conference on Intelligent Robots and Systems (IROS), (2017), 4828-4834, https://doi.org/10.1109/IROS.2017.8206358
  • Pilgerstorfer, P., Pournaras, E., Self-Adaptive Learning in Decentralized Combinatorial Optimization - A Design Paradigm for Sharing Economies, 2017 IEEE/ACM 12th International Symposium on Software Engineering for Adaptive and Self-Managing Systems (SEAMS), (2017), 54-64, https://doi.org/10.1109/SEAMS.2017.8
  • Pournaras, E., Nikolić, J., On-demand self-adaptive data analytics in large-scale decentralized networks, 2017 IEEE 16th International Symposium on Network Computing and Applications (NCA), (2017), 1-10, https://doi.org/10.1109/NCA.2017.8171353
  • Pournaras, E., Nikolić, J., Self-Corrective Dynamic Networks via Decentralized Reverse Computations, 2017 IEEE International Conference on Autonomic Computing (ICAC), (2017), 11-20, https://doi.org/10.1109/ICAC.2017.30
  • Pournaras, E., Nikolić, J., Omerzel, A., Helbing, D., Engineering Democratization in Internet of Things Data Analytics, 2017 IEEE 31st International Conference on Advanced Information Networking and Applications (AINA), (2017), 994-1003, https://doi.org/10.1109/AINA.2017.15

2016

  • Benedusi, P., Hupp, D., Arbenz, P., Krause, R., A Parallel Multigrid Solver for Time-Periodic Incompressible Navier–Stokes Equations in 3D, Numerical Mathematics and Advanced Applications ENUMATH 2015, LNCSE, vol 112, (2018), 265-273, https://doi.org/10.1007/978-3-319-39929-4_26
  • Häner, T., Steiger, D.S., Smelyanskiy, M., Troyer, M., High Performance Emulation of Quantum Circuits, SC’16: Proceedings of the International Conference for High Performance Computing, Networking, Storage and Analysis, (2016), 866-874, http://dl.acm.org/citation.cfm?id=3014904.3015003
  • Zhou, C., Wieser, A., Application of Backpropagation Neural Networks to Both Stages of Fingerprinting Based WIPS, 2016 Fourth International Conference on Ubiquitous Positioning, Indoor Navigation and Location Based Services (UPINLBS), (2016), 207-217, https://doi.org/10.1109/UPINLBS.2016.7809973

2015

  • Schweizer, H., Besta, M., Hoefler, T., Evaluating the Cost of Atomic Operations on Modern Architectures, 2015 International Conference on Parallel Architecture and Compilation (PACT), (2015), 445-456, https://doi.org/10.1109/PACT.2015.24

Leonhard Open

2021

  • Obukhov, A. Rakhuba, M., Liniger, A., Huang, Z., Georgoulis, St., Dai, D., Van Gool, L., Spectral Tensor Train Parameterization of Deep Learning Layers, Proceedings of The 24th International Conference on Artificial Intelligence and Statistics, PMLR, 130, 3547-3555, (2021), http://proceedings.mlr.press/v130/obukhov21a/obukhov21a.pdf

Brutus (2007-2016)

2015

  • Hugi, A., Geiser, M., Villares, G., Cappelli, F., Blaser, St., Faist, J., All Solid State Mid-Infrared Dual-Comb Spectroscopy Platform Based on QCL Technology, Proc. SPIE 9370, Quantum Sensing and Nanophotonic Devices XII, 93701l, (2015), https://doi.org/10.1117/12.2084967

2014

  • Arbenz, P., Hupp, D., Obrist, D. (2014). A Parallel Solver for the Time-Periodic Navier–Stokes Equations, Parallel Processing and Applied Mathematics, PPAM 2013, LNCS, vol 8385, (2014), 291-300, https://doi.org/10.1007/978-3-642-55195-6_27

2013

  • Hejazialhosseini, B., Conti, C., Rossinelli, D., Koumoutsakos, P. (2013). High Performance CPU Kernels for Multiphase Compressible Flows, High Performance Computing for Computational Science, VECPAR 2012, LNCS, vol 7851, (2013), 216-225, https://doi.org/10.1007/978-3-642-38718-0_22
  • Rossinelli, D., Hejazialhosseini, B., Hadjidoukas, P., Bekas, C., Curioni, A., Bertsch, A., Futral, S., Schmidt, S.T., Adams, N.A., 11 PFLOP/s simulations of cloud cavitation collapse, SC '13: Proceedings of the International Conference on High Performance Computing, Networking, Storage and Analysis, (2013), 1-13, https://doi.org/10.1145/2503210.2504565

2012

  • Arbenz, P., Hiltebrand, A., Obrist, D., A Parallel Space-Time Finite Difference Solver for Periodic Solutions of the Shallow-Water Equation, Parallel Processing and Applied Mathematics, PPAM 2011, LNCS, vol 7204, (2012), 302-312, https://doi.org/10.1007/978-3-642-31500-8_31
  • Hejazialhosseini, B., Rossinelli, D., Conti, C., Koumoutsakos, P., High throughput software for direct numerical simulations of compressible two-phase flows, SC '12: Proceedings of the International Conference on High Performance Computing, Networking, Storage and Analysis, (2012), 1-12, https://doi.org/10.1109/SC.2012.66
  • Šukys, J., Mishra, S., Schwab, C., Static Load Balancing for Multi-level Monte Carlo Finite Volume Solvers, Parallel Processing and Applied Mathematics, PPAM 2011, LNCS, vol 7203 , (2012), 245-254, https://doi.org/10.1007/978-3-642-31464-3_25

2011

2010

  • Belina, F.A., Irving, J., Ernst, J.R., Holliger, K., Source Wavelet Estimation during Full-waveform Inversion of Ground Penetrating Radar Data, Near Surface 2010 - 16th EAGE European Meeting of Environmental and Engineering Geophysics, cp-164-00009, (2010), https://doi.org/10.3997/2214-4609.20144774
  • Meles, G.A., Greenhalgh, S.A., Green, A.G., van der Kruk, J., Tackling the non-linearity problem in GPR waveform inversion, Proceedings of the XIII Internarional Conference on Ground Penetrating Radar, (2010), 1-6, https://doi.org/10.1109/ICGPR.2010.5550233
  • Meles, G.A., Van der Kruk, J., Greenhalgh, St.A., Ernst, J.R., Maurer, H., Green, A.G., A New Vector Waveform Inversion Algorithm for Simultaneous Updating of Conductivity and Permittivity Parameters From Combination Crosshole/Borehole-to-Surface GPR Data, IEEE Transactions on Geoscience and Remote Sensing, 48(9), (2010), 3391-3407, https://doi.org/10.1109/TGRS.2010.2046670
  • Sherony, M.J., Su, L.T., Chung, J.E., Antoniadis, D.A., "Inversion electron effective mobility in SOI NMOSFETs, Proceedings of 1993 IEEE International SOI Conference, (2010), 120-121, https://doi.org/10.1109/SOI.1993.344567.

2009

  • Arbenz, P., Bryner, J., Tobler, C. (2010). Parallelized Transient Elastic Wave Propagation in Orthotropic Structures, Parallel Processing and Applied Mathematics, PPAM 2009, LNCS, vol 6068, (2009), 310-319, https://doi.org/10.1007/978-3-642-14403-5_33
  • Rossinelli, D., Bergdorf, M., Hejazialhosseini, B., Koumoutsakos, P., Wavelet-Based Adaptive Solvers on Multi-core Architectures for the Simulation of Complex Systems, . In: Sips, H., Epema, D., Lin, HX. (eds) Euro-Par 2009 Parallel Processing, Euro-Par 2009, LNCS, vol 5704, (2009), 721-734, https://doi.org/10.1007/978-3-642-03869-3_68

HPC team

2022

  • Guillod, T., Czyz, P., Kolar, J.W., Geometrical Optimization of Medium-Frequency Air-Core Transformers for DCX Applications, IEEE Journal of Emerging and Selected Topics in Power Electronics, (2022), https://doi.org/10.1109/JESTPE.2021.3140197

Theses referencing HPC clusters of ETH or the HPC team

Euler (2014-now)

PhD theses

  • Bieri, Philipp, 2017, Unique Architectural and Evolutionary Features of the Mammalian Mitochondrial and the Plant Chloroplast Ribosome Revealed by Cryo-Electron Microscopy, https://doi.org/10.3929/ethz-b-000202600
  • Cotter, Etienne, 2024, I. Synthesis and Biological Assessment of Analogs of the Marine Macrolide (−)-Zampanolide. II. Studies Towards the Synthesis of Core-Modified Analogs of β-Lactam Antibiotics: Exploring Reactions of Isocyanates with Aliphatic Imines and Synthesis of New β-Sultam Derivatives, https://doi.org/10.3929/ethz-b-000681414
  • Gasser, Valentina Carla Mercedes, 2023, Methods Development, Structure Elucidation and Quantum-Mechanical Calculations: Harnessing Nickel and Iron for Strong Bond Functionalization, https://doi.org/10.3929/ethz-b-000626035
  • Griesbach, Julia Kerstin, 2024, Mechanobiology and Mineralization Dynamics in Bone Health and Disease: Insights from Computational Modeling, Organotypic Models, and In Vivo Studies, https://doi.org/10.3929/ethz-b-000706570
  • Herrmann, Markus, 2019, Contributions to the Risk Assessment of Natural and Induced Seismicity Producing High-Resolution Catalogs and Improving Risk-Based Decision-Making, https://doi.org/10.3929/ethz-b-000370375
  • Hofer, Gregor, 2019, The two-dimensional polymerization mechanism of an anthracene-based monomer: A single-crystal-to-single-crystal transformation investigated via total X-ray scattering, https://doi.org/10.3929/ethz-b-000371011
  • Gasser, Valentina Carla Mercedes, 2023, Methods Development, Structure Elucidation and Quantum-Mechanical Calculations: Harnessing Nickel and Iron for Strong Bond Functionalization, https://doi.org/10.3929/ethz-b-000626035
  • Müller, Marcel, 2022, Investigating the influence of oxidant concentration in fatty acid aerosol ozonolysis by means of electrodynamic balance–mass spectrometry, https://doi.org/10.3929/ethz-b-000587090
  • Nguyen, Cristina K. X., 2023, Hybrid method for studying dynamic conformational ensemble of multidomain proteins: SRSF1 tandem RRMs in the free and bound states, https://doi.org/10.3929/ethz-b-000615380
  • Perozzi, David, 2022, Quantification of the earth pressure acting on corrosion-damaged cantilever retaining walls: An analysis of the soil-structure interaction, https://doi.org/10.3929/ethz-b-000591353
  • Reisenbauer,Julia, 2023, Developments in Nickel-catalyzed Transfer Hydrocyanation Reactions and Novel Skeletal Editing Strategies through Nitrogen Atom Insertion, https://doi.org/10.3929/ethz-b-000612836
  • Yilmaz, Dilara, 2024, Unraveling the Mechano-Molecular Mechanism of Aging: Insights from CRISPR/Cas9 Cell Reporter & Prematurely Aging PolgA Mice on Bone Mechanoregulation, https://doi.org/10.3929/ethz-b-000690431
  • Zhong, Xin, 2017, Numerical modelling of grainscale pressure variations in metamorphic rocks: interplay between mineral reactions, diffusion and mechanical deformation, https://doi.org/10.3929/ethz-b-000224597

Master theses

  • Haagmans, Vincent, 2021, Modelling the significance of snow-vegetation interactions for active layer dynamics in an Arctic permafrost region subjected to tundra shrubification, https://doi.org/10.3929/ethz-b-000518127
  • Van Liedekerke, Ambra Maria, 2022, Coordinated Maintenance Planning and Congestion Management for the Swiss Power Grid: Scheduling Algorithms and Topological Action Optimization, https://doi.org/10.3929/ethz-b-000639804

Bachelor theses

Semester theses

Leonhard Med 1.0 (2017-2022)

Master theses

Bachelor theses

  • Rüegsegger, Nicola Elias, 2021, Weaning of Mechanically Ventilated Patients in the Intensive Care Unit: A Clinician-in-the-Loop Reinforcement Learning Approach, https://doi.org/10.3929/ethz-b-000473932

Leonhard Open (2017-2021)

PhD theses

Master theses

Bachelor theses

Brutus (2007-2016)

PhD theses

  • Grommek, Andreas, 2012, Polymorphism in the ccβ model amyloid investigated by solid-state NMR and prediction of carbon chemical shifts of proteins by DFT calculations, https://doi.org/10.3929/ethz-a-007558057
  • Kunz, Anna-Pitschna E., 2011, Refinement of Molecular Simulation methodology: Development of Polarisable Solvents and Techniques to Enhance configurational Sampling, https://doi.org/10.3929/ethz-a-6618381
  • Lövenich, Sandra Nicola, 2009, Improvements to the annotation of protein-coding genes in Drosophila melanogaster based on peptide sequences derived from high-throughput tandem mass spectrometry, https://doi.org/10.3929/ethz-a-005905851
  • Semenov, Alexey, 2011, Global 3-D imaging of mantle electrical conductivity based on inversion of observatory Cresponses an approach, data analysis and results, https://doi.org/10.3929/ethz-a-006676164
  • Zhong, Xin, 2017, Numerical modelling of grainscale pressure variations in metamorphic rocks: interplay between mineral reactions, diffusion and mechanical deformation, https://doi.org/10.3929/ethz-b-000224597

Master theses

Semester theses

HPC team

PhD theses

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