most citedMinimal parameter implicit solvent model for ab initio electronic structure calculations

82 citations · 82 across the 1 of their papers we have counts for

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1 paper

physics.comp-ph2011★ 82 cited

Minimal parameter implicit solvent model for ab initio electronic structure calculations

Jacek Dziedzic, Hatem H. Helal, Chris-Kriton Skylaris +2

We present an implicit solvent model for ab initio electronic structure calculations which is fully self-consistent and is based on direct solution of the nonhomogeneous Poisson eq…