A comparative study of energy bands in Kronig-Penney and Mathieu potentials
β Scribed by P.D. Loly; A.A. Bahurmuz
- Publisher
- Elsevier Science
- Year
- 1980
- Weight
- 442 KB
- Volume
- 100
- Category
- Article
- ISSN
- 0378-4363
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π SIMILAR VOLUMES
Basis set truncation error BSTE , size extensivity Error SEE , zero point Ε½ . Ε½ . y vibrational energy ZPVE , and basis set superposition error BSSE of HeH weak van der Waals interaction energy were determined and compared at the self-consistent field Ε½ . Ε½ . Ε½ . SCF , many-body perturbation theory
Recent dynamical computations on the LSTH and PK(I1) potential energy surfaces are analyzed in terms of different properties of the surfaces. Differences in the bend level structure of resonances are found to be due to the weaker vibrational force constant at the saddle point of the LSTH surface. Th