544 citations · 1.7k across the 20 of their papers we have counts for
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cond-mat.mtrl-sci2015★ 19 cited
Fragment Approach to Constrained Density Functional Theory Calculations using Daubechies Wavelets
Laura E. Ratcliff, Luigi Genovese, Stephan Mohr +1
In a recent paper we presented a linear scaling Kohn-Sham density functional theory (DFT) code based on Daubechies wavelets, where a minimal set of localized support functions is o…
cond-mat.mtrl-sci2015★ 201 cited
Accurate and efficient linear scaling DFT calculations with universal applicability
Stephan Mohr, Laura E. Ratcliff, Luigi Genovese +4
Density Functional Theory calculations traditionally suffer from an inherent cubic scaling with respect to the size of the system, making big calculations extremely expensive. This…