Analysis of double-hybrid density functionals along the adiabatic connection-Reference-Cited by-同舟云学术

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Analysis of double-hybrid density functionals along the adiabatic connection

Published:2013-04-09 Issue:9-11 Volume:111 Page:1275-1294
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Cornaton Yann¹,Franck Odile¹,Teale Andrew M.²³,Fromager Emmanuel¹

Affiliation:

1. a Laboratoire de Chimie Quantique, Institut de Chimie , CNRS/Université de Strasbourg , Strasbourg , France

2. b School of Chemistry , University of Nottingham , University Park, Nottingham , United Kingdom

3. c Department of Chemistry, Centre for Theoretical and Computational Chemistry , University of Oslo , Blindern, Oslo , Norway

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

https://www.tandfonline.com/doi/pdf/10.1080/00268976.2013.783640

Reference85 articles.

1. Density‐functional thermochemistry. III. The role of exact exchange

2. A new mixing of Hartree–Fock and local density‐functional theories

3. The exchange-correlation energy of a metallic surface

4. Exchange and correlation in atoms, molecules, and solids by the spin-density-functional formalism

5. Erratum: Exchange and correlation in atoms, molecules, and solids by the spin-density-functional formalism

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2. Non-empirical double-hybrid density functionals as reliable tools for electronic structure calculations;Electronic Structure;2022-10-28

3. Reduced density matrix functional theory from an ab initio seniority-zero wave function: Exact and approximate formulations along adiabatic connection paths;Physical Review A;2022-09-02

4. Do any types of double-hybrid models render the correct order of excited state energies in inverted singlet–triplet emitters?;The Journal of Chemical Physics;2022-02-14

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