Modeling Electronic Response Properties with an Explicit-Electron Machine Learning Potential
Author:
Affiliation:
1. Center for Molecular Modeling (CMM), Ghent University, Technologiepark-Zwijnaarde 46, B-9052 Gent, Belgium
2. IDLab, Electronics and Information Systems Department, Ghent University-imec, Technologiepark-Zwijnaarde 126, B-9052 Gent, Belgium
Funder
Universiteit Gent
Fonds Wetenschappelijk Onderzoek
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.1c00978
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1. Polarizable Force Fields: History, Test Cases, and Prospects
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