Approximate electric potentials
β Scribed by George G. Hall
- Book ID
- 105095348
- Publisher
- Springer
- Year
- 1983
- Tongue
- English
- Weight
- 322 KB
- Volume
- 63
- Category
- Article
- ISSN
- 1432-2234
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π SIMILAR VOLUMES
## Abstract We derive new formulas for harmonic, diffraction, elastic, and hydrodynamic potentials acting on anisotropic Gaussians and approximate wavelets. These formulas can be used to construct accurate cubature formulas for these potentials. (Β© 2007 WILEYβVCH Verlag GmbH & Co. KGaA, Weinheim)
Approximate molecular electrostatic potentials MESPs are ## Ε½ . calculated with the asymptotic density model ADM on the basis of semiempirical wavefunctions generated by the SINDO1 method. The approximate MESP is adjusted to obtain good agreement with the exact MESP from 6-31G\* ab initio calcula