Self-consistent nuclear calculations with a deformed basis
β Scribed by D.R. Tuerpe; W.H. Bassichis; A.K. Kerman
- Publisher
- Elsevier Science
- Year
- 1970
- Tongue
- English
- Weight
- 625 KB
- Volume
- 142
- Category
- Article
- ISSN
- 0375-9474
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π SIMILAR VOLUMES
Practical methods of generating reliable and economic basis sets for relativistic self-consistent fields (RSCF) calculations are developed. Large component basis sets are generated from constrained optimizations of exponents in the nonrelativistic atomic calculations for light atoms, For heavy atoms
## rn The orthogonal group function approach, as based on the Huzinaga equation, is extensively applied in reduced basis frozen-core calculations. Although the theory is developed for orthogonal electronic groups, the use of reduced basis sets prevents strict orthogonality and the formalism is com