Calculation of the auxiliary functions Fm(z)

Published: 1 January 1984| Version 1 | DOI: 10.17632/s4dn65k66x.1
Contributors:
L.F. Errea,
L. Méndez,
A. Riera

Description

Title of program: FRANKC Catalogue Id: ACFL_v1_0 Nature of problem Calculation of a set of auxiliary functions Fm(z) which appear in the analytical calculation of molecular integrals involving Gaussian type orbitals and generalised plane waves. Versions of this program held in the CPC repository in Mendeley Data ACFL_v1_0; FRANKC; 10.1016/0010-4655(84)90081-X This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)

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Categories

Physical Chemistry, Molecular Physics, Computational Physics, Computational Method

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