Force analysis by molecular orbitals — partition of the Hellmann–Feynman force into one-electron orbital contributions
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference63 articles.
1. The Force Concept in Chemistry
2. The role of single-particle density in chemistry
3. B.M. Deb (Ed.), The Force Concept in Chemistry, Van Nostrand Reinhold, New York, 1981.
4. THE HELLMANN–FEYNMAN THEOREM AND CHEMICAL BINDING
5. THE ELECTRON DENSITY DISTRIBUTIONS IN HYDRIDE MOLECULES: I. THE WATER MOLECULE
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1. (QCO)+ as the model for bonding in non-classical carbonyls: a force approach study;Journal of Molecular Structure: THEOCHEM;2005-10
2. Valence electronic force and core electronic force. Significance of core electrons on chemical binding;Journal of Molecular Structure: THEOCHEM;2001-11
3. Where Do the Forces in Molecules Come from? A Density Functional Study of N2 and HCl;The Journal of Physical Chemistry A;2000-06-01
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