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Adaptation of the GEOMO program for calculation of solvation and adsorption complexes

✍ Scribed by L. G. Gorb; N. N. Il'chenko; A. G. Grebenyuk; I. A. Abronin

Publisher
SP MAIK Nauka/Interperiodica
Year
1990
Tongue
English
Weight
177 KB
Volume
30
Category
Article
ISSN
0022-4766

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πŸ“œ SIMILAR VOLUMES

A new version of the program for the gen
A new version of the program for the generation of symmetry-adapted functions for molecular calculations
✍ LubomΓ­r SkΓ‘la πŸ“‚ Article πŸ“… 1990 πŸ› Elsevier Science 🌐 English βš– 69 KB

## Title of version: SYMMET version 2 Nature of physical problem The group theory is used for the classification of the electron Catalogue number: ABRA states of molecules and the transformation of the matrix eigenvalue problem to a quasidiagonal form. If the p-basis on Program obtainable from: CP