Implementation and benchmark tests of the DFTB method and its application in the ONIOM method

Published 2009 View Full Article

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Title
Implementation and benchmark tests of the DFTB method and its application in the ONIOM method
Authors
Keywords
-
Journal
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
Volume 109, Issue 9, Pages 1841-1854
Publisher
Wiley
Online
2009-03-24
DOI
10.1002/qua.22002

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