𝔖 Bobbio Scriptorium
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Ab initio calculation of the molecular structure and conformational composition of dihalotetrasilanes

✍ Scribed by Harald Stüger; Rudolf Janoschek


Book ID
113258608
Publisher
Elsevier Science
Year
1994
Tongue
English
Weight
414 KB
Volume
313
Category
Article
ISSN
0166-1280

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Conformational analysis by combined ab i
✍ M. Askari; D.L. Merrifield; Lothar Schäfer 📂 Article 📅 1976 🏛 Elsevier Science 🌐 French ⚖ 125 KB

The most successful computational approach to the conformational analysis of medium-sized molecules with 30-40 atoms or more is presently based on molecular mechanics and empirical force fields. Because of their empirical nature, these procedures can at times lead to rather inconclusive results. In