Open AccessBasis set convergence of the coupled-cluster correction, $\delta _{\text{MP2}}^{\text{CCSD(T)}}$δMP2CCSD(T): Best practices for benchmarking non-covalent interactions and the attendant revision of the S22, NBC10, HBC6, and HSG databases
Author(s) -
Michael S. Marshall,
Lori A. Burns,
C. David Sherrill
Publication year - 2011
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.3659142
Subject(s) - coupled cluster , extrapolation , basis set , perturbation theory (quantum mechanics) , physics , basis (linear algebra) , chemistry , combinatorics , mathematics , molecule , quantum mechanics , mathematical analysis , geometry
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