Determining the role of the underlying orbital-dependence...

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Journal of Computational Chemistry 2017 / 04

Determining the role of the underlying orbital-dependence of PBE0-DH and PBE-QIDH double-hybrid density functionals

Sancho-García, Juan Carlos, Pérez-Jiménez, Ángel José, Savarese, Marika, Brémond, Éric, Adamo, Juan Carlo
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Language:
english
Journal:
Journal of Computational Chemistry
DOI:
10.1002/jcc.24788
Date:
April, 2017
File:
PDF, 436 KB
english, 2017
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