Parametrization of the SCC-DFTB Method for Halogens

Published 2013 View Full Article

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Title
Parametrization of the SCC-DFTB Method for Halogens
Authors
Keywords
-
Journal
Journal of Chemical Theory and Computation
Volume 9, Issue 7, Pages 2939-2949
Publisher
American Chemical Society (ACS)
Online
2013-05-30
DOI
10.1021/ct4001922

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