𝔖 Bobbio Scriptorium
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Ab initio calculations of potential barbiers for ionic conductivity of the β-PbF2 compound

✍ Scribed by M. Nizam; Y. Bouteiller

Book ID
113257030
Publisher
Elsevier Science
Year
1990
Tongue
English
Weight
658 KB
Volume
206
Category
Article
ISSN
0166-1280

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Ab initio calculations of the rotational
Ab initio calculations of the rotational potential functions for propylamine and ethylmethylamine
✍ Norman L. Allinger; Ulrich Burkert; Salvatore Profeta Jr. 📂 Article 📅 1980 🏛 John Wiley and Sons 🌐 English ⚖ 373 KB

## Abstract Calculations at the STO‐3G and 4–31G levels have been carried out on propylamine and ethylmethylamine, using geometries determined by molecular mechanics by allowing complete molecular relaxation in all degrees of freedom except for torsion about the central bond, and at 30° increments