Classical Elementary Particle Models Based on the Dualistic Approach
β Scribed by M. N. Mahanta; Dr. Y. K. Gupta
- Publisher
- John Wiley and Sons
- Year
- 1988
- Tongue
- English
- Weight
- 472 KB
- Volume
- 500
- Category
- Article
- ISSN
- 0003-3804
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π SIMILAR VOLUMES
A semi-classical tunneling methodology combined with the use of classical trajectories is adopted in order to evaluate the tunneling splittings for bi-dirnensional surfaces of malonaldehyde and hydrogenoxalate anion proton transfer reactions. It is shown that the optimization of the tunneling path m
## Abstract Condensedβphase computational studies of molecules using molecular mechanics approaches require the use of force fields to describe the energetics of the systems as a function of structure. The advantage of polarizable force fields over nonpolarizable (or additive) models lies in their