199 citations · 390 across the 3 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2013★ 199 cited
Density Functionals that Recognize Covalent, Metallic, and Weak Bonds
Jianwei Sun, Bing Xiao, Yuan Fang +6
Computationally-efficient semilocal approximations of density functional theory at the level of the local spin density approximation (LSDA) or generalized gradient approximation (G…
physics.chem-ph2013★ 191 cited
Semilocal and Hybrid Meta-Generalized Gradient Approximations Based on the Understanding of the Kinetic-Energy-Density Dependence
Jianwei Sun, Robin Haunschild, Bing Xiao +3
We present a global hybrid meta-generalized gradient approximation (meta-GGA) with three empirical parameters, as well as its underlying semilocal meta-GGA and a meta-GGA with only…
physics.chem-ph2012
Effect of orbital-overlap dependence in density functionals
Jianwei Sun, Bing Xiao, Adrienn Ruzsinszky
The semilocal meta generalized gradient approximation (MGGA) for the exchange-correlation functional of Kohn-Sham (KS) density functional theory can yield accurate ground-state ene…