Fast exploration of potential energy surfaces with a joint venture of quantum chemistry, evolutionary algorithms and unsupervised learning
Author:
Affiliation:
1. Scuola Normale Superiore, Piazza dei Cavalieri, 56125, Pisa, Italy
2. Università di Brescia, DMMT-sede Europa, Viale Europa 11, 25121 Brescia, Italy
Abstract
Funder
Agenzia Spaziale Italiana
Ministero dell'Università e della Ricerca
Publisher
Royal Society of Chemistry (RSC)
Link
http://pubs.rsc.org/en/content/articlepdf/2022/DD/D2DD00070A
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