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New aspects in force field calculations

✍ Scribed by J. Mink


Publisher
Elsevier Science
Year
1988
Tongue
English
Weight
876 KB
Volume
173
Category
Article
ISSN
0022-2860

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πŸ“œ SIMILAR VOLUMES


Molvib - A flexible program for force fi
✍ T. Sundius πŸ“‚ Article πŸ“… 1990 πŸ› Elsevier Science 🌐 English βš– 345 KB

A description is given of MOLVIB, a Fortran program for classical harmonic force field calculations on free and crystalline molecules. All the calculations are done in mass-weighted Cartesian coordinates, which eliminates most problems with redundant coordinates. The force field is refined by a modi