Accession Number : AD0640389

Title :   EVALUATION OF MOLECULAR INTEGRALS BY THE METHOD OF BARNETT AND COULSON.

Corporate Author : LONDON UNIV (ENGLAND) COMPUTER UNIT

Personal Author(s) : BERNAL,M. J. M. ; Mills,B. M.

Report Date : 01 AUG 1960

Pagination or Media Count : 21

Abstract : A brief account of the Barnett-Coulson method for the evaluation of molecular integrals is given. Programs for calculating some of the basic integrals occuring in the method, and their application to the evaluation of two-electron two-centre integrals, are described. (Author)

Descriptors :   *MOLECULAR ORBITALS, *INTEGRALS, COMPUTER PROGRAMMING, ELECTRONS, MOLECULAR ENERGY LEVELS, UNITED KINGDOM.

Subject Categories : Atomic and Molecular Physics and Spectroscopy
      Quantum Theory and Relativity

Distribution Statement : APPROVED FOR PUBLIC RELEASE