A program for calculating the static interaction potential between an electron and a diatomic molecule

Published: 01-01-1971| Version 1 | DOI: 10.17632/bkkh7wnwbw.1
Contributors:
F.H.M. Faisal,
A.L.V. Tench

Description

Abstract Title of program: STATIC INTERACTION POTENTIAL Catalogue number: ACQW Program obtainable from: CPC Program Library, Queen's University of Belfast, N. Ireland (see application form in this issue) Computer: IBM 360/75. Installation: A.E.R.E. Harwell Operating system or monitor under which the program is executed: HASP MFT2 Programming languages used: FORTRAN IV High speed store required: 52K words. No. of bits in a word: 32 Is the program overlaid? Yes No. of magnetic tapes required: None What ... Title of program: STATIC INTERACTION POTENTIAL Catalogue Id: ACQW_v1_0 Nature of problem This program calculates the single centre multipole expansion of the static potential for a diatomic molecule. ... CORRECTION SUMMARY: Vol:Year:Page 5:1973:396 "000A CORRECTION 19/12/72" "A program for calculating the static interaction potential between an electron and a diatomic molecule. (C.P.C. 2(1971)261)." F.H.M. Faisal; A.L.V. Tench CORRECTION SUMMARY: Vol:Year:Page 0:unpublished:unpublished "000BCORRECTION 22/06/76" "Unpublished correction to a program for calculating the static interaction potential between an electron and a diatomic molecule." F.H.M. Faisal; A.L.V. Tench Note: correction instructions are contained in source code Versions of this program held in the CPC repository in Mendeley Data ACQW_v1_0; STATIC INTERACTION POTENTIAL; 10.1016/0010-4655(71)90002-6 ACQW_v2_0; OCEP W.F. AND STATIC POTENTIAL; 10.1016/0010-4655(76)90055-2 ACQW_v3_0; ONE CENTRE STATIC POTENTIAL; 10.1016/0010-4655(80)90006-5 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)

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