most citedKSSOLV 2.0: An efficient MATLAB toolbox for solving the Kohn-Sham equations with plane-wave basis set

24 citations · 24 across the 1 of their papers we have counts for

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1 paper

physics.comp-ph2022★ 24 cited

KSSOLV 2.0: An efficient MATLAB toolbox for solving the Kohn-Sham equations with plane-wave basis set

Shizhe Jiao, Zhenlin Zhang, Kai Wu +12

KSSOLV (Kohn-Sham Solver) is a MATLAB toolbox for performing Kohn-Sham density functional theory (DFT) calculations with a plane-wave basis set. KSSOLV 2.0 preserves the design fea…