Small split-valence Gaussian 3-21SP and 4-22SP basis sets, w Ε½ .x previously reported for the first-row atoms Chem. Phys. Lett., 229, 151 1996 , have been extended for the second-row elements of the Periodic Table . The total energies of the ground states of the second-row atoms calculated with the
β¦ LIBER β¦
Gaussian basis functions for use in molecular calculations. Contraction of (12s9p) atomic basis sets for the second row atoms
β Scribed by T.H. Dunning Jr.
- Publisher
- Elsevier Science
- Year
- 1970
- Tongue
- English
- Weight
- 500 KB
- Volume
- 7
- Category
- Article
- ISSN
- 0009-2614
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