Reference : Improving molecular force fields across configurational space by combining supervised...
Scientific journals : Article
Physical, chemical, mathematical & earth Sciences : Physics
http://hdl.handle.net/10993/49417
Improving molecular force fields across configurational space by combining supervised and unsupervised machine learning
English
Cordeiro Fonseca, Gregory mailto [University of Luxembourg > Faculty of Science, Technology and Medicine (FSTM) > Department of Physics and Materials Science (DPHYMS) >]
Poltavskyi, Igor mailto [University of Luxembourg > Faculty of Science, Technology and Medicine (FSTM) > Department of Physics and Materials Science (DPHYMS) >]
Vassilev Galindo, Valentin mailto [University of Luxembourg > Faculty of Science, Technology and Medicine (FSTM) > Department of Physics and Materials Science (DPHYMS) >]
Tkatchenko, Alexandre mailto [University of Luxembourg > Faculty of Science, Technology and Medicine (FSTM) > Department of Physics and Materials Science (DPHYMS) >]
22-Mar-2021
Journal of Chemical Physics
Yes
http://hdl.handle.net/10993/49417
10.1063/5.0035530

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