Inaccurate Conformational Energies Still Hinder Crystal Structure Prediction in Flexible Organic Molecules
Author:
Affiliation:
1. Department of Chemistry, University of California Riverside, Riverside, California 92521, United States
Funder
Division of Chemistry
Publisher
American Chemical Society (ACS)
Subject
Condensed Matter Physics,General Materials Science,General Chemistry
Link
http://pubs.acs.org/doi/pdf/10.1021/acs.cgd.0c00676
Reference57 articles.
1. Modeling Polymorphic Molecular Crystals with Electronic Structure Theory
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