Comparison of the DFT-SAPT and Canonical EDA Schemes for the Energy Decomposition of Various Types of Noncovalent Interactions

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SYSNO	0492086
Title	Comparison of the DFT-SAPT and Canonical EDA Schemes for the Energy Decomposition of Various Types of Noncovalent Interactions
Author(s)	Stasyuk, Olga A. (UOCHB-X) [610/61] Sedlák, Robert (UOCHB-X) [610/61]_RID Guerra, C. F. (NL) Hobza, Pavel (UOCHB-X) [610/61]_{RID, ORCID}
Corespondence/senior	Hobza, Pavel - Korespondující autor
Source Title	Journal of Chemical Theory and Computation . Roč. 14, č. 7 (2018), s. 3440-3450. - : American Chemical Society
Document Type	Článek v odborném periodiku
Grant	GBP208/12/G016 GA ČR - Czech Science Foundation (CSF), CZ - Czech Republic
Institutional support	UOCHB-X - RVO:61388963
Language	eng
Country	US
Keywords	density functional theory * adapted perturbation theory * intermolecular interaction energies
Cooperating institutions	Univerzita Palackého v Olomouci (Czech Republic)
Permanent Link	http://hdl.handle.net/11104/0285948

Number of the records: 1