A new method for quantitatively comparing calculated vibrational modes is described that relies on projecting the vectors describing the normal modes of one molecule onto those of a basis molecule. The procedure virtually automates the assignment of vibrational modes from one molecule to a second, s
โฆ LIBER โฆ
ViPA: A computer program for vector projection analysis of normal vibrational modes of molecules
โ Scribed by Anthony K. Grafton; Ralph A. Wheeler
- Publisher
- Elsevier Science
- Year
- 1998
- Tongue
- English
- Weight
- 369 KB
- Volume
- 113
- Category
- Article
- ISSN
- 0010-4655
No coin nor oath required. For personal study only.
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