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"Analytic derivatives for the XYG3 type of doubly hybrid density ..."

Neil Qiang Su, Igor Ying Zhang, Xin Xu (2013)

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DOI: 10.1002/JCC.23312

access: closed

type: Journal Article

metadata version: 2020-04-01

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Neil Qiang Su, Igor Ying Zhang, Xin Xu:
Analytic derivatives for the XYG3 type of doubly hybrid density functionals: Theory, implementation, and assessment. J. Comput. Chem. 34(20): 1759-1774 (2013)

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