Rovibrational cross sections from reactance matrices calculated in adiabatic nuclei approximation

Published: 1 January 1975| Version 1 | DOI: 10.17632/kzjrj7zndt.1
Contributor:
Ronald J.W. Henry

Description

Title of program: VIBAD Catalogue Id: ACWI_v1_0 Nature of problem Body frame reactance matrices obtained from elastic scattering calculations at fixed internuclear separations are transformed into laboratory frame matrices to compute differential and integral cross sections for simultaneous rotational and vibrational excitation of a molecule. Versions of this program held in the CPC repository in Mendeley Data ACWI_v1_0; VIBAD; 10.1016/0010-4655(75)90041-7 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)

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Categories

Physical Chemistry, Molecular Physics, Computational Physics

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