Miguel A. Caro

Miguel A. Caro

Senior Scientist & Academy of Finland Research Fellow, Aalto University
Verified email at aalto.fi
Cited by 4257
Interatomic potentials Materials modeling Atomistic machine learning
Xiangguo Li

Xiangguo Li

Sun Yat-sen University
Verified email at mail.sysu.edu.cn
Cited by 3362
Density functional theory machine learning interatomic potentials 2D materials
Yury Lysogorskiy

Yury Lysogorskiy

ICAMS, Ruhr University Bochum
Verified email at rub.de
Cited by 1379
interatomic potentials machine learning
Jiří Hostaš

Jiří Hostaš

Assistant Research Officer
Verified email at nrc-cnrc.gc.ca
Cited by 998
computational chemistry non-covalent interactions host-guest AI/ML interatomic potentials
Daria Smirnova

Daria Smirnova

Max-Planck-Institut für Eisenforschung GmbH
Verified email at mpie.de
Cited by 956
molecular dynamics interatomic potentials atomistic simulations
Leonardo Medrano Sandonas

Leonardo Medrano Sandonas

Technische Universität Dresden
Verified email at tu-dresden.de
Cited by 938
Machine learning inverse design interatomic potentials atomistic modelling transport phenomena
Akira TAKAHASHI

Akira TAKAHASHI

Tokyo Institute of Technology
Verified email at m.titech.ac.jp
Cited by 887
Materials science Interatomic potentials Machine learning First principles calculation
Louis THIRY

Louis THIRY

PhD at ENS Paris, ERC STUOD Postdoc INRIA Rennes
Verified email at ens.fr
Cited by 782
machine learning computer vision geophysical fluid dynamics density functional theory interatomic potentials
Andrey Kartamyshev

Andrey Kartamyshev

Full-time researcher, Van Lang University
Verified email at vlu.edu.vn
Cited by 584
materials science DFT molecular dynamics interatomic potentials
David Mora-Fonz

David Mora-Fonz

Research Associate, University College London
Verified email at ucl.ac.uk
Cited by 534
Computational Chemistry Metal Oxides Surfaces DFT Interatomic Potentials
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