Accelerating MP2C dispersion corrections for dimers and molecular crystals

Journal of Chemical Physics

Volumn 138, Issue 22, 2013, Pages

  Huang, Yuanhang ^a   Shao, Yihan ^b   Beran, Gregory J O ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b Q Chem Inc   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL COSTS; COMPUTATIONAL EXPENSE; DISPERSION CORRECTION; MP2 CALCULATIONS; NON-COVALENT INTERACTION; ORDERS OF MAGNITUDE; PERTURBATION THEORY; SECOND ORDERS;

CRYSTAL SYMMETRY; DISPERSIONS; MOLECULAR CRYSTALS; MONOMERS;

DIMERS;

EID: 84879122980     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4809981     Document Type: Article

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