Parametrization and Benchmark of DFTB3 for Organic Molecules

Published 2012 View Full Article

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Title
Parametrization and Benchmark of DFTB3 for Organic Molecules
Authors
Keywords
-
Journal
Journal of Chemical Theory and Computation
Volume 9, Issue 1, Pages 338-354
Publisher
American Chemical Society (ACS)
Online
2012-11-08
DOI
10.1021/ct300849w

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