Self-Consistent Scheme Combining MD and Order-N DFT Methods: An Improved Set of Nonpolarizable Force Fields for Ionic Liquids

Published 2019 View Full Article

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Title
Self-Consistent Scheme Combining MD and Order-N DFT Methods: An Improved Set of Nonpolarizable Force Fields for Ionic Liquids
Authors
Keywords
-
Journal
Journal of Chemical Theory and Computation
Volume 16, Issue 1, Pages 651-665
Publisher
American Chemical Society (ACS)
Online
2019-12-24
DOI
10.1021/acs.jctc.9b00793

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