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Extensions of the S66 Data Set: More Accurate Interaction Energies and Angular-Displaced Nonequilibrium Geometries
- 1.0370220 - ÚOCHB 2012 RIV US eng J - Journal Article
Řezáč, Jan - Riley, Kevin Eugene - Hobza, Pavel
Extensions of the S66 Data Set: More Accurate Interaction Energies and Angular-Displaced Nonequilibrium Geometries.
Journal of Chemical Theory and Computation. Roč. 7, č. 11 (2011), s. 3466-3470. ISSN 1549-9618. E-ISSN 1549-9626
R&D Projects: GA MŠMT LC512
Grant - others:European Social Fund(XE) CZ.1.05/2.1.00/03.0058
Institutional research plan: CEZ:AV0Z40550506
Keywords : correlated molecular calculations * plesset perturbation-theory * gaussian-basis sets
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 5.215, year: 2011
Permanent Link: http://hdl.handle.net/11104/0204084
Number of the records: 1