Simultaneous Attenuation of Both Self-Interaction Error and Nondynamic Correlation Error in Density Functional Theory: A Spin-Pair Distinctive Adiabatic-Connection Approximation-Reference-Cited by-同舟云学术

Simultaneous Attenuation of Both Self-Interaction Error and Nondynamic Correlation Error in Density Functional Theory: A Spin-Pair Distinctive Adiabatic-Connection Approximation

Published:2019-05-02 Issue:10 Volume:10 Page:2617-2623
ISSN:1948-7185
Container-title:The Journal of Physical Chemistry Letters
language:en
Short-container-title:J. Phys. Chem. Lett.

Author:

Zhang Igor Ying¹^ORCID,Xu Xin¹^ORCID

Affiliation:

1. Shanghai Key Laboratory of Molecular Catalysis and Innovative Materials, Collaborative Innovation Center of Chemistry for Energy Materials, MOE Laboratory for Computational Physical Science, Department of Chemistry, Fudan University, Shanghai 200433, China

Publisher

American Chemical Society (ACS)

Subject

General Materials Science,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpclett.9b00946

Reference39 articles.

1. The exchange-correlation energy of a metallic surface

2. Exchange-correlation energy of a metallic surface: Wave-vector analysis

3. Climbing the Density Functional Ladder: Nonempirical Meta–Generalized Gradient Approximation Designed for Molecules and Solids

4. Developing the random phase approximation into a practical post-Kohn–Sham correlation model

5. Accurate Bulk Properties from Approximate Many-Body Techniques

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