Third version of a program for calculating the static interaction potential between an electron and a diatomic molecule

Title of program: ONE CENTRE STATIC POTENTIAL
Catalogue Id: ACQW_v3_0 [ACZR]

Nature of problem
The program calculates one-centre expansions for the two-centre wave function of a diatomic molecule ...
CORRECTION SUMMARY:
Vol:Year:Page 41:1986:179
"000A CORRECTION 28/01/86"
"Errors in the three CPC versions of the program to calculate the
single centre expansion of the electron diatomic-molecule static
potential. (C.P.C. 20(1980)267)."
L. Malegat; M. Le Dourneuf; V.K. Lan

ADAPTATION SUMMARY:
Vol:Year:Page 41:1986:179
"0001 PARAMETRIZED DIMENSIONS"
"Errors in the three CPC versions of the program to calculate the
single centre expansion of the electron diatomic-molecule static
potential."
L. Malegat; M. Le Dourneuf; V.K. Lan

Note: adaptation instructions are contained in source code

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)