Accession Number:

AD0257434

Title:

CALCULATION AND TABULATION OF EXPANSION OEFFICIENTS FOR N SHELL MOLECULAR TWO-CENTER INTEGRALS BY MEANS OF THE ELECTRONIC COMPUTER BESK

Descriptive Note:

Corporate Author:

STOCKHOLM UNIV (SWEDEN)

Personal Author(s):

Report Date:

1960-12-01

Pagination or Media Count:

1.0

Abstract:

The formulae for all the two-center integrals occurring in the MO-LCAO method with N shell Slater atomic orbitals is found from the tables of coefficients. The tables were computed by means of Besk according to a flow scheme. Using the corresponding program, which is working separately, it is possible to calculate the actual coefficients for integrals containing other shells as well. Author

Subject Categories:

Distribution Statement:

APPROVED FOR PUBLIC RELEASE