Toward Automated Sampling of Polymorph Nucleation and Free Energies with the SGOOP and Metadynamics
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Title
Toward Automated Sampling of Polymorph Nucleation and Free Energies with the SGOOP and Metadynamics
Authors
Keywords
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Journal
JOURNAL OF PHYSICAL CHEMISTRY B
Volume 125, Issue 47, Pages 13049-13056
Publisher
American Chemical Society (ACS)
Online
2021-11-18
DOI
10.1021/acs.jpcb.1c07595
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