I. A Fortran program for calculating degenerate Raman bands of symmetric tops with an adaptation for infrared bands

Published: 01-08-1971| Version 1 | DOI: 10.17632/ftsd7vspgc.1
Contributors:
F.N. Masri,
I.R. Williams

Description

Abstract Title of program: FORTRAN VIBROT I Catalogue number: AAGF Program obtainable from: CPC Program Library, Queen's University of Belfast, Northern Ireland (see application form in this issue) Computer for which the program is designed and others upon which it is operable Computer: IBM 360/91. Installation: Osk Ridge National Laboratory, Oak Ridge, Tennessee, USA Operating system or monitor under which the program is executed: OS 360 Programming language used: FORTRAN IV High... Title of program: FORTRAN VIBROT I Catalogue Id: AAGC_v2_0 [AAGF] Nature of problem This program solves the same physical problem as program VIBROT I (CPC 1 (1970) 349). the original program has been translated into Fortran IV from Algol. The logic, the test data and the output format are all virtually identical. the total cpu time is 11 seconds. ADAPTATION SUMMARY: Vol:Year:Page 2:1971:298 "0001VIBROT I FOR INFRARED" "I. A FORTRAN program for calculating degenerate Raman bands of symmetric tops with an adaptation for infrared bands." F.N. Masri; I.R. Williams Note: adaptation instructions are contained in source code Versions of this program held in the CPC repository in Mendeley Data AAGC_v1_0; VIBROT I; 10.1016/0010-4655(70)90036-6 AAGC_v2_0; FORTRAN VIBROT I; 10.1016/0010-4655(71)90005-1 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)

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