A new exchange–correlation functional free of delocalization and static correlation errors

A bridge-functional-based classical mapping method for predicting the correlation functions of uniform electron gases at finite temperature

(2014) Yu Liu et al.   JOURNAL OF CHEMICAL PHYSICS

Perspective: Fifty years of density-functional theory in chemical physics

(2014) Axel D. Becke   JOURNAL OF CHEMICAL PHYSICS

Towards nonlocal density functionals by explicit modeling of the exchange-correlation hole in inhomogeneous systems

(2013) K. J. H. Giesbertz et al.   PHYSICAL REVIEW A

A liquid-state theory for electron correlation functions and thermodynamics

(2012) Shuangliang Zhao et al.   CHEMICAL PHYSICS LETTERS

Symmetric Nonlocal Weighted Density Approximations from the Exchange-Correlation Hole of the Uniform Electron Gas

(2012) Rogelio Cuevas-Saavedra et al.   Journal of Chemical Theory and Computation

Challenges for Density Functional Theory

(2011) Aron J. Cohen et al.   CHEMICAL REVIEWS

The classical-map hyper-netted-chain (CHNC) method and associated novel density-functional techniques for warm dense matter

(2011) M. W. C. Dharma-Wardana   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Effect of the damping function in dispersion corrected density functional theory

(2011) Stefan Grimme et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Discontinuous Nature of the Exchange-Correlation Functional in Strongly Correlated Systems

(2009) Paula Mori-Sánchez et al.   PHYSICAL REVIEW LETTERS

Benchmarks for electronically excited states: Time-dependent density functional theory and density functional theory based multireference configuration interaction

(2008) Mario R. Silva-Junior et al.   JOURNAL OF CHEMICAL PHYSICS

Localization and Delocalization Errors in Density Functional Theory and Implications for Band-Gap Prediction

(2008) Paula Mori-Sánchez et al.   PHYSICAL REVIEW LETTERS

Insights into Current Limitations of Density Functional Theory

(2008) A. J. Cohen et al.   SCIENCE