Abstract
Distributed basis sets of s-type Gaussian function for diatomic molecules are developed in which the disposition of the off-nucleus expansion centers are determined by a stochastic variational technique. The utility of this approach is investigated by means of prototype matrix Hartree–Fock calculations for the ground state of the nitrogen molecule. ©1999 John Wiley & Sons, Inc. Int J Quant Chem 74: 547–552, 1999
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