most citedGPU acceleration of hybrid functional calculations in the SPARC electronic structure code

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physics.comp-ph2025★ 1 cited

GPU acceleration of hybrid functional calculations in the SPARC electronic structure code

Xin Jing, Abhiraj Sharma, John E. Pask +1

We present a GPU-accelerated version of the real-space SPARC electronic structure code for performing hybrid functional calculations in generalized Kohn-Sham density functional the…