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20132026
most citedGPU acceleration of local and semilocal density functional calculations in the SPARC electronic structure code

15 citations · 40 across the 18 of their papers we have counts for

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physics.comp-ph2023★ 15 cited

GPU acceleration of local and semilocal density functional calculations in the SPARC electronic structure code

Abhiraj Sharma, Alfredo Metere, Phanish Suryanarayana +3

We present a GPU-accelerated version of the real-space SPARC electronic structure code for performing Kohn-Sham density functional theory calculations within the local density and…

physics.comp-ph2015

Visual, user-interactive generation of bond networks in 3D particle configurations

Alfredo Metere, Tomas Oppelstrup, Mikhail Dzugutov +1

We present a new program able to perform visual structural analysis on 3D particle systems called PASYVAT (PArticle SYstem Visual Analysis Tool). More specifically, it can select m…