TITLE

The basis set convergence of the Hartree-Fock energy for H[sub 2]

AUTHOR(S)
Jensen, Frank
PUB. DATE
April 1999
SOURCE
Journal of Chemical Physics;4/8/1999, Vol. 110 Issue 14, p6601
SOURCE TYPE
Academic Journal
DOC. TYPE
Article
ABSTRACT
Illustrates that the Hartree-Fock energy approximation for the hydrogen2 molecule converges exponentially. Influence of the number of basis functions on a given type; Factors that determine the subnanohartree accuracy.
ACCESSION #
4262497

 

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