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20182022
most citedNonlocal van der Waals functionals for solids: Choosing an appropriate one

94 citations · 183 across the 8 of their papers we have counts for

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cond-mat.mtrl-sci2018★ 23 cited

Orbital-free approximations to the kinetic-energy density in exchange-correlation MGGA functionals: tests on solids

Fabien Tran, Péter Kovács, Leila Kalantari +2

A recent study of Mejia-Rodriguez and Trickey [Phys. Rev. A 96, 052512 (2017)] showed that the deorbitalization procedure (replacing the exact Kohn-Sham kinetic-energy density by a…