Ab Initio Machine Learning in Chemical Compound Space

Author(s)
Bing Huang, O. Anatole von Lilienfeld
Organisation(s)
Computational Materials Physics
External organisation(s)
Universität Basel
Journal
Chemical Reviews
Volume
121
Pages
10001-10036
No. of pages
36
ISSN
0009-2665
DOI
https://doi.org/10.1021/acs.chemrev.0c01303
Publication date
08-2021
Peer reviewed
Yes
Austrian Fields of Science 2012
103025 Quantum mechanics, 104017 Physical chemistry, 102019 Machine learning
Keywords
ASJC Scopus subject areas
Chemistry(all)
Portal url
https://ucrisportal.univie.ac.at/en/publications/ab-initio-machine-learning-in-chemical-compound-space(d537baf9-effe-4f31-a23c-3c6fc2cc1a41).html