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Analytic gradient for the embedding potential with approximations in the fragment molecular orbital method

✍ Scribed by Nagata, Takeshi; Fedorov, Dmitri G.; Kitaura, Kazuo

Book ID: 123020812
Publisher: Elsevier Science
Year: 2012
Tongue: English
Weight: 680 KB
Volume: 544
Category: Article
ISSN: 0009-2614
DOI: 10.1016/j.cplett.2012.07.004

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