"Molecular energies and properties from density functional theory: ..."

Andrew C. Scheiner, Jon Baker, Jan W. Andzelm (1997)

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DOI: 10.1002/(SICI)1096-987X(19970430)18:6<775::AID-JCC4>3.0.CO;2-P

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type: Journal Article

metadata version: 2020-04-01

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Andrew C. Scheiner, Jon Baker, Jan W. Andzelm:
Molecular energies and properties from density functional theory: Exploring basis set dependence of Kohn - Sham equation using several density functionals. J. Comput. Chem. 18(6): 775-795 (1997)

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