Parametrization of DFTB3/3OB for Magnesium and Zinc for Chemical and Biological Applications

Published 2014 View Full Article

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Title
Parametrization of DFTB3/3OB for Magnesium and Zinc for Chemical and Biological Applications
Authors
Keywords
-
Journal
JOURNAL OF PHYSICAL CHEMISTRY B
Volume 119, Issue 3, Pages 1062-1082
Publisher
American Chemical Society (ACS)
Online
2014-09-02
DOI
10.1021/jp506557r

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