DAMQT: A package for the analysis of electron density in molecules
Author:
Publisher
Elsevier BV
Subject
General Physics and Astronomy,Hardware and Architecture
Reference38 articles.
1. Properties of atoms in molecules. I. Proposed definition of the charge on an atom in a molecule
2. Properties of atoms in molecules. The position of the center of electronic charge of an atom in a molecule
3. Properties of atoms in molecules
4. Properties of atoms in molecules. a proposed method for calculating the extent of distortion of an atom
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1. Electrostatic Potential for Exploring Electron Delocalization in Infinitenes, Circulenes, and Nanobelts;The Journal of Organic Chemistry;2023-03-23
2. Topology of electrostatic potential and electron density reveals a covalent to non-covalent carbon–carbon bond continuum;Physical Chemistry Chemical Physics;2023
3. Electronegativity equalization principle: new approaches and models for the study of chemical reactivity;Chemical Reactivity;2023
4. DAMQT 3: Advanced suite for the analysis of molecular density and related properties in large systems;Computer Physics Communications;2022-10
5. Probing the Directionality of S···O/N Chalcogen Bond and Its Interplay with Weak C–H···O/N/S Hydrogen Bond Using Molecular Electrostatic Potential;The Journal of Physical Chemistry B;2022-09-30
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