Electronic continuum correction without scaled charges

Published 2020 View Full Article

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Title
Electronic continuum correction without scaled charges
Authors
Keywords
Molecular dynamics in electronic continuum, Scaled charges, External field, Water model, Permittivity, Simulation
Journal
JOURNAL OF MOLECULAR LIQUIDS
Volume 314, Issue -, Pages 113571
Publisher
Elsevier BV
Online
2020-06-23
DOI
10.1016/j.molliq.2020.113571

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