I. Program for calculating degenerate Raman bands of symmetric tops with an adaptation for infrared bands

Published: 1 January 1970| Version 1 | DOI: 10.17632/8gwrpgwm25.1
Contributors:
F.N. Masri,
I.R. Williams

Description

Title of program: VIBROT I Catalogue Id: AAGC_v1_0 Nature of problem The program VIBROT I calculates the degenerate vibration-rotation bands of symmetric top molecules in the gas-phase infrared or Raman spectrum. ... ADAPTATION SUMMARY: Vol:Year:Page 1:1970:350 "0001 ADAPT VIBROT I FOR INFRARED" "I. 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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Physical Chemistry, Molecular Physics, Computational Physics

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