It is shown that with the use of published one-center INDO parameters for transition metals M , it is not possible to reproduce experimental relative energies of the electronic states of M , M', and M 2 + accurately enough. Two new sets of INDO parameters for the elements of the I and I1 transition
One-center parameters of the CNDO and INDO methods for atoms of transition elements of series I and II
โ Scribed by O. V. Sizova; N. V. Ivanova; V. I. Baranovskii
- Publisher
- SP MAIK Nauka/Interperiodica
- Year
- 1984
- Tongue
- English
- Weight
- 240 KB
- Volume
- 24
- Category
- Article
- ISSN
- 0022-4766
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