A computational method for symmetry factorization without using symmetry operators
Authors:
B. Jordanov
Affiliation:
Institute of Organic Chemistry of the Bulgarian Academy of Sciences, 1113 Sofia Bulgaria
University of Salford, Department of Chemistry and Applied Chemistry, Salford, M5 4WT Gt. Britain
Abstract:
A computational method is suggested for symmetry factorization of symmetric matrices according to the symmetry properties of their basis. The method avoids the use of symmetry operators and is convenient for computer programming.