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Data · dataset · 1980

Subroutines for the evaluation of exchange integrals in the impact parameter formulation of atomic charge transfer collisions

Listed in Teesside University Research Data Repository

Title of program: REXMAT Catalogue Id: ACZV_v1_0 Nature of problem The impact parameter description of atomic charge transfer collisions using Slater-type orbitals as basis functions requires the computation of two-centre one-electron exchange integrals.

Description

The program REXMAT is designed to perform part of the algebra necessary to obtain these integrals in the form of one-dimensional integrals which may easily be evaluated numerically.

Versions of this program held in the CPC repository in Mendeley Data ACZV_v1_0; REXMAT; 10.1016/0010-4655(80)90087-9 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)

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Teesside University Research Data Repositoryoai:data.mendeley.com/n8zs2h968r.117 h agoJSON v1
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