𝔖 Bobbio Scriptorium
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Topological analysis of the molecular electrostatic potential

✍ Scribed by Leboeuf, Martin; Köster, Andreas M.; Jug, Karl; Salahub, Dennis R.


Book ID
121286282
Publisher
American Institute of Physics
Year
1999
Tongue
English
Weight
789 KB
Volume
111
Category
Article
ISSN
0021-9606

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Electrostatic molecular potential analys
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## The Electrostatic Molecular Potential approach is used to estimate the influence of the oxygen and chlorine valence electrons on the Lewis acidity of the aluminium atoms in Hz AlOH and H,AlCl respectively. The potentials are computed using the electron density distribution arising from CNDO/2 w

Electrostatic molecular potential analys
✍ A. Okninski; S. Pasynkiewicz 📂 Article 📅 1979 🏛 Elsevier Science ⚖ 349 KB

The Electrostatic Molecular Potential approach is used to determine reaction channels for A12H6. The character of bonding in A12H6 is also analysed and discussed in terms of the highest occupied molecular orbitals.