Extension of the Hartree−Fock Plus Dispersion Method by First-Order Correlation Effects-Reference-Cited by-同舟云学术

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Extension of the Hartree−Fock Plus Dispersion Method by First-Order Correlation Effects

Published:2009-12-29 Issue:2 Volume:1 Page:550-555
ISSN:1948-7185
Container-title:The Journal of Physical Chemistry Letters
language:en
Short-container-title:J. Phys. Chem. Lett.

Author:

Podeszwa Rafał¹²,Pernal Katarzyna²³,Patkowski Konrad²,Szalewicz Krzysztof²

Affiliation:

1. Institute of Chemistry, University of Silesia, Szkolna 9, 40-006 Katowice, Poland

2. Department of Physics and Astronomy, University of Delaware, Newark, Delaware 19716

3. Institute of Physics, Technical University of Lodz, ul. Wolczanska 219, 93-005 Lodz, Poland

Publisher

American Chemical Society (ACS)

Subject

General Materials Science,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jz9002444

Reference32 articles.

1. A simple but reliable method for the prediction of intermolecular potentials

2. Intermolecular forces in simple systems

3. Intermolecular forces via hybrid Hartree–Fock–SCF plus damped dispersion (HFD) energy calculations. An improved spherical model

4. Empirical correction to density functional theory for van der Waals interactions

5. Semiempirical GGA-type density functional constructed with a long-range dispersion correction

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