Vytisknout
0492086 - ÚOCHB 2019 RIV US eng J - Článek v odborném periodiku
Stasyuk, Olga A. - Sedlák, Robert - Guerra, C. F. - Hobza, Pavel
Comparison of the DFT-SAPT and Canonical EDA Schemes for the Energy Decomposition of Various Types of Noncovalent Interactions.
Journal of Chemical Theory and Computation. Roč. 14, č. 7 (2018), s. 3440-3450. ISSN 1549-9618. E-ISSN 1549-9626
Grant CEP: GA ČR(CZ) GBP208/12/G016
Institucionální podpora: RVO:61388963
Klíčová slova: density functional theory * adapted perturbation theory * intermolecular interaction energies
Obor OECD: Physical chemistry
Impakt faktor: 5.313, rok: 2018
Trvalý link: http://hdl.handle.net/11104/0285948
Stasyuk, Olga A. - Sedlák, Robert - Guerra, C. F. - Hobza, Pavel
Comparison of the DFT-SAPT and Canonical EDA Schemes for the Energy Decomposition of Various Types of Noncovalent Interactions.
Journal of Chemical Theory and Computation. Roč. 14, č. 7 (2018), s. 3440-3450. ISSN 1549-9618. E-ISSN 1549-9626
Grant CEP: GA ČR(CZ) GBP208/12/G016
Institucionální podpora: RVO:61388963
Klíčová slova: density functional theory * adapted perturbation theory * intermolecular interaction energies
Obor OECD: Physical chemistry
Impakt faktor: 5.313, rok: 2018
Trvalý link: http://hdl.handle.net/11104/0285948