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MP2.5 and MP2.X: Approaching CCSD(T) Quality Description of Noncovalent Interaction at the Cost of a Single CCSD Iteration
- 1.0392564 - ÚOCHB 2014 RIV DE eng J - Journal Article
Sedlák, Robert - Riley, K. E. - Řezáč, Jan - Pitoňák, M. - Hobza, Pavel
MP2.5 and MP2.X: Approaching CCSD(T) Quality Description of Noncovalent Interaction at the Cost of a Single CCSD Iteration.
ChemPhysChem. Roč. 14, č. 4 (2013), s. 698-707. ISSN 1439-4235. E-ISSN 1439-7641
R&D Projects: GA ČR GBP208/12/G016
Grant - others:European Social Fund(XE) CZ1.05/2.1.00/03/0058
Institutional support: RVO:61388963
Keywords : benchmark dataset * complete basis set limit * correlation energy * MOllerPlesset perturbation theory * noncovalent interactions
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.360, year: 2013
Permanent Link: http://hdl.handle.net/11104/0221403
Number of the records: 1