An efficient implementation of a QM–MM method in SIESTA

Published 2010 View Full Article

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Title
An efficient implementation of a QM–MM method in SIESTA
Authors
Keywords
-
Journal
THEORETICAL CHEMISTRY ACCOUNTS
Volume 128, Issue 4-6, Pages 825-833
Publisher
Springer Nature
Online
2010-09-20
DOI
10.1007/s00214-010-0816-5
References
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