
Accession Number : AD0617703
Title : THE CALCULATION OF ATOMIC WAVE FUNCTIONS BY SOLUTION OF THE HARTREEFOCK EQUATIONS.
Descriptive Note : Final technical rept.,
Corporate Author : CEIR LTD LONDON (ENGLAND)
Personal Author(s) : Mayers,D. F. ; Hirsh,A. J.
Report Date : APR 1965
Pagination or Media Count : 298
Abstract : A program prepared for the IBM 7090 to solve the general form of the HartreeFock equations is described. The program is written in FORTRAN II except for three subroutines which are written in the FAP language. It is divided into four parts which contain: I. Basic theory and method of numerical solution; II. User's guide to the program; III. Subroutine Specifications; IV. Flow diagrams and listing. (Author)
Descriptors : (*ATOMIC STRUCTURE, FUNCTIONS(MATHEMATICS)), (*COMPUTER PROGRAMMING, DIFFERENTIAL EQUATIONS), (*DIFFERENTIAL EQUATIONS, ATOMIC STRUCTURE), ATOMIC ENERGY LEVELS, QUANTUM THEORY, INTEGRAL EQUATIONS, ITERATIONS, PROGRAMMING LANGUAGES
Distribution Statement : APPROVED FOR PUBLIC RELEASE