149 citations · 339 across the 7 of their papers we have counts for
Showing 2016 · cond-mat.mtrl-sciShow all
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cond-mat.mtrl-sci2016★ 14 cited
Comparative study of semilocal density functionals on solids and surfaces
Yuxiang Mo, Guocai Tian, Jianmin Tao
Recently, Tao and Mo (TM) proposed an accurate all-purpose nonempirical meta-generalized gradient approximation (meta-GGA). The exchange part was derived from the density matrix ap…
cond-mat.mtrl-sci2016★ 41 cited
Assessment of a nonempirical semilocal density functional on solids and surfaces
Yuxiang Mo, Roberto Car, Viktor N. Staroverov +2
Recently, Tao and Mo developed a new nonempirical semilocal exchange-correlation density functional. The exchange part of this functional is derived from a density matrix expansion…
cond-mat.mtrl-sci2016★ 149 cited
Accurate semilocal density functional for condensed matter physics and quantum chemistry
Jianmin Tao, Yuxiang Mo
Most density functionals have been developed by imposing the known exact constraints on the exchange-correlation energy, or by a fit to a set of properties of selected systems, or…