Comparison of the performance of exact-exchange-based density functional methods

Modified Becke’05 method of nondynamic correlation in density functional theory with self-consistent implementation

(2012) Emil Proynov et al.   CHEMICAL PHYSICS LETTERS

Improved self-consistent and resolution-of-identity approximated Becke'05 density functional model of nondynamic electron correlation

(2012) Emil Proynov et al.   JOURNAL OF CHEMICAL PHYSICS

Efficient self-consistent DFT calculation of nondynamic correlation based on the B05 method

(2010) Emil Proynov et al.   CHEMICAL PHYSICS LETTERS

The dissociation energy of N2

(2010) Jan AlmlÖf et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Some Fundamental Issues in Ground-State Density Functional Theory: A Guide for the Perplexed

(2009) John P. Perdew et al.   Journal of Chemical Theory and Computation

Assessment of a density functional with full exact exchange and balanced non-locality of correlation

(2009) Carlos A. Jiménez-Hoyos et al.   MOLECULAR PHYSICS

Optimal operators for Hartree–Fock exchange from long-range corrected hybrid density functionals

(2008) Jeng-Da Chai et al.   CHEMICAL PHYSICS LETTERS

Fractional spins and static correlation error in density functional theory

(2008) Aron J. Cohen et al.   JOURNAL OF CHEMICAL PHYSICS

Self-Consistent Field Calculations of Excited States Using the Maximum Overlap Method (MOM)†

(2008) Andrew T. B. Gilbert et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Density functional with full exact exchange, balanced nonlocality of correlation, and constraint satisfaction

(2008) John P. Perdew et al.   PHYSICAL REVIEW A

Exact-exchange energy density in the gauge of a semilocal density-functional approximation

(2008) Jianmin Tao et al.   PHYSICAL REVIEW A

Insights into Current Limitations of Density Functional Theory

(2008) A. J. Cohen et al.   SCIENCE

Multi-reference calculations of nitric oxide dimer

(2007) Naoki Taguchi et al.   CHEMICAL PHYSICS LETTERS