A new microscopic model for the quantitative interpretation of solvent effects on molecular eiectrooic spectxa is proposed. The interaction ener& is caicuIated between the solute molecule and a camplet. shell of surrounding solvent nolecutes. The equilibrium configuration is obtained by a procedur
Correlation effects in calculation of electronic states for model molecular systems
โ Scribed by H. Chojnacki; Z. Laskowski
- Publisher
- Elsevier Science
- Year
- 1986
- Tongue
- English
- Weight
- 229 KB
- Volume
- 141
- Category
- Article
- ISSN
- 0022-2860
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