On-the-fly machine learning force field generation: Application to melting points

Author(s)
Ryosuke Jinnouchi, Ferenc Karsai, Georg Kresse
Organisation(s)
Computational Materials Physics
External organisation(s)
Toyota Central R&D Labs., Inc., VASP Software GmbH, Universität Wien
Journal
Physical Review B
Volume
100
No. of pages
15
ISSN
2469-9950
DOI
https://doi.org/10.1103/PhysRevB.100.014105
Publication date
07-2019
Peer reviewed
Yes
Austrian Fields of Science 2012
103015 Condensed matter, 103018 Materials physics
Keywords
ASJC Scopus subject areas
Electronic, Optical and Magnetic Materials, Condensed Matter Physics
Portal url
https://ucris.univie.ac.at/portal/en/publications/onthefly-machine-learning-force-field-generation-application-to-melting-points(77dc4098-da4f-4f43-bfde-d5cd292bab80).html