Basic concepts and illustrative applications of the sensitivity analysis of molecular charge distribution
Author:
Publisher
Elsevier BV
Subject
General Engineering
Reference42 articles.
1. Quantum Theory of Atoms in Molecules–Dalton Revisited
2. Bonded and nonbonded charge concentrations and their relation to molecular geometry and reactivity
3. Toward a theory of chemical reactivity based on the charge density
4. Structure and bonding in sulfur-nitrogen compounds
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