## Abstract Wave functions expressed as antisymmetrized products of strongly orthogonal geminals have been evaluated for H~2~O, NH~3~ and CH~4~. The geminals have been expressed as linear combinations of 2 ร 2 detors constructed with localized SCFโMO's. Several ground state observables have been co
โฆ LIBER โฆ
GF calculation with minimal and extended basis sets for H2O, NH3, CH4and H2O2
โ Scribed by Pier Filippo Franchini; Claudio Vergani
- Publisher
- Springer
- Year
- 1969
- Tongue
- English
- Weight
- 467 KB
- Volume
- 13
- Category
- Article
- ISSN
- 1432-2234
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