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Molcol: A program for solving atomic and molecular collision problems

delete2000-09-01
delete56
PRE
AI
F
Flower, DR *
G
G. Bourhis
J
Jean‐Marie Launay
DOI：10.1016/S0010-4655(00)00118-1delete
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Abstract

Abstract

En 中文
We describe a Fortran program that enables cross sections to be calculated for collisions between two systems of arbitrary angular momenta, The quantal coupled channels (partial wave expansion) method is used. Illustrative results are presented for the case of a collision between an atom (He 1s(2) S-1) and a vibrating diatomic molecule (H-2), and between a molecule (H-2) and an atom possessing fine structure (O 1s(2)2s(2)2p(4) (3)p). (C) 2000 Elsevier Science B.V. All rights reserved.
Keywords:
molecular collisions
rovibrationally inelastic scattering
quantal coupled channels method
fine structure excitation

Journal

Computer Physics Communications cover
Computer Physics Communications
IF:
3.4
Papers:
1.2W
Citations:
3.7W

Organization

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Cited Papers

Cited Papers

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