Theoretical studies on the electronic and the geometrical structures for various molecules by the molecular orbital or the density functional theory have recently been developed and applied widely under the progress of computer technologies. At present, it is possible to carry out a theoretical inve
Optimization of the geometry of mono- and biradicals in the “half-electron” method
✍ Scribed by A. M. Nesterenko
- Publisher
- SP MAIK Nauka/Interperiodica
- Year
- 1984
- Tongue
- English
- Weight
- 298 KB
- Volume
- 24
- Category
- Article
- ISSN
- 0022-4766
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