An integral transformation procedure is reported as a part of an ab initio program (named SYCETY) developed recently for spatially extended molecules. It is shown that all advantages of the program SYCETY can be kept. The procedure is especially suitable to transform the integrals to a localized bas
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Ab initio program for treatment of related molecules. I. Integral part
β Scribed by Cornelia Kozmutza
- Publisher
- Springer
- Year
- 1981
- Tongue
- English
- Weight
- 507 KB
- Volume
- 60
- Category
- Article
- ISSN
- 1432-2234
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