Efficient yet accurate dispersion-corrected semilocal exchange–correlation functionals for non-covalent interactions

Author:

Patra Abhilash1ORCID,Jana Subrata1ORCID,Constantin Lucian A.2ORCID,Samal Prasanjit1ORCID

Affiliation:

1. School of Physical Sciences, National Institute of Science Education and Research, HBNI, Bhubaneswar 752050, India

2. Istituto di Nanoscienze, Consiglio Nazionale delle Ricerche CNR-NANO, 41125 Modena, Italy

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference205 articles.

1. Inhomogeneous Electron Gas

2. Self-Consistent Equations Including Exchange and Correlation Effects

3. Self-interaction correction to density-functional approximations for many-electron systems

4. Jacob’s ladder of density functional approximations for the exchange-correlation energy

5. G. E. Scuseria and V. N. Staroverov, in Theory and Application of Computational Chemistry: The First 40 Years, edited by C. E. Dykstra, G. Frenking, K. S. Kim, and G. E. Scuseria (Elsevier, Amsterdam, 2005), pp. 669–724.

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