Literature DB >> 19256590

Long-range-corrected hybrids including random phase approximation correlation.

Benjamin G Janesko1, Thomas M Henderson, Gustavo E Scuseria.   

Abstract

We recently demonstrated a connection between the random phase approximation (RPA) and coupled cluster theory [G. E. Scuseria et al., J. Chem. Phys. 129, 231101 (2008)]. Based on this result, we here propose and test a simple scheme for introducing long-range RPA correlation into density functional theory. Our method provides good thermochemical results and models van der Waals interactions accurately.

Entities:  

Year:  2009        PMID: 19256590     DOI: 10.1063/1.3090814

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  3 in total

1.  Evolution of DFT studies in view of a scientometric perspective.

Authors:  Robin Haunschild; Andreas Barth; Werner Marx
Journal:  J Cheminform       Date:  2016-10-05       Impact factor: 5.514

2.  A comprehensive analysis of the history of DFT based on the bibliometric method RPYS.

Authors:  Robin Haunschild; Andreas Barth; Bernie French
Journal:  J Cheminform       Date:  2019-11-21       Impact factor: 5.514

3.  Assessment of the Second-Order Statically Screened Exchange Correction to the Random Phase Approximation for Correlation Energies.

Authors:  Arno Förster
Journal:  J Chem Theory Comput       Date:  2022-09-23       Impact factor: 6.578

  3 in total

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