Calculation of Intermolecular Interaction Energies by Direct Numerical Integration over Electron Densities. I. Electrostatic and Polarization Energies in Molecular Crystals-Reference-Cited by-同舟云学术

Calculation of Intermolecular Interaction Energies by Direct Numerical Integration over Electron Densities. I. Electrostatic and Polarization Energies in Molecular Crystals

Published:2002-03-21 Issue:16 Volume:106 Page:4145-4154
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Gavezzotti A.¹

Affiliation:

1. Dipartimento di Chimica Strutturale e Stereochimica inorganica, Università di Milano, via Venezian 21, 20133 Milano, Italy

Publisher

American Chemical Society (ACS)

Subject

Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp0144202

Reference34 articles.

1. Coulombic interactions in crystalline hydrocarbons

2. Applications of realistic electrostatic modelling to molecules in complexes, solids and proteins

3. A Non-Empirical Intermolecular Potential for Oxalic Acid Crystal Structures

4. Role of Electrostatic Interactions in Determining the Crystal Structures of Polar Organic Molecules. A Distributed Multipole Study

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