An SCF-CI study of the water dimer potential surface and the effects of including the correlation energy, the basis set superposition error and the Davidson correction

By Baum J.O.   Finney J.L.  

Molecular Physics, Vol. 55, Iss. 5, 1985-08 ,pp. : 1097-1108

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Basis set error in quadrupole moment calculations

By McCullough E.A.  

Molecular Physics, Vol. 42, Iss. 4, 1981-03 ,pp. : 943-950

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Enthalpy difference between conformations of normal alkanes: effects of basis set and chain length on intramolecular basis set superposition error

By Balabin Roman  

Molecular Physics, Vol. 109, Iss. 6, 2011-03 ,pp. : 943-953

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Approximate SCF calculations on the [Mn(H 2 O) 6 ] 2+ complex with a minimal basis set

By Andriessen J.  

Molecular Physics, Vol. 23, Iss. 6, 1972-06 ,pp. : 1103-1113

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Calculated dissociation energies of the alkali metal monoxides NaO and KO Basis set superposition error and symmetry lowering

By Lee Edmond   Wright Timothy   Dyke John  

Molecular Physics, Vol. 82, Iss. 6, 1994-08 ,pp. : 1281-1281

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