𝔖 Bobbio Scriptorium
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Additivity model study of CNDO electron densities in some aza-substituted naphthalenes

✍ Scribed by R.C. Rastogi; N.K. Ray

Book ID
103012028
Publisher
Elsevier Science
Year
1975
Tongue
English
Weight
150 KB
Volume
35
Category
Article
ISSN
0009-2614

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📜 SIMILAR VOLUMES

Additivity model for calculations of UHF
Additivity model for calculations of UHF spin densities in some aza-aromatic radical anions
✍ K. K. Sharma 📂 Article 📅 1978 🏛 John Wiley and Sons 🌐 English ⚖ 204 KB

## Abstract The additivity model suggested by Moss et al. has been applied for predicting spin densities in aza‐aromatic radical anions. The core‐resonance integrals (β~__rs__~) have been evaluated using Linderberg's relation. The spin‐density values calculated using the additivity model, have been

Additivity model for calculations of UHF
Additivity model for calculations of UHF spin densities and charge densities in some methyl-substituted radical anions
✍ K. K. Sharma 📂 Article 📅 1977 🏛 John Wiley and Sons 🌐 English ⚖ 233 KB

## Abstract The additivity model as suggested by Moss et al. has been used for predicting spin densities in methyl‐substituted radical anions. Linderberg's relation has been employed for evaluating the core‐resonance integrals (β~__rs__~) and a heteroatom model for the methyl group has been used.