250 citations · 973 across the 45 of their papers we have counts for
Showing 2023 · physics.comp-phShow all
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physics.comp-ph2023★ 30 cited
High-performance evaluation of high angular momentum 4-center Gaussian integrals on modern accelerated processors
Andrey Asadchev, Edward F. Valeev
We present a high-performance evaluation method for 4-center 2-particle integrals over Gaussian atomic orbitals with high angular momenta () and arbitrary contraction degre…
physics.comp-ph2023★ 24 cited
Distributed Memory, GPU Accelerated Fock Construction for Hybrid, Gaussian Basis Density Functional Theory
David B. Williams-Young, Andrey Asadchev, Doru Thom Popovici +5
With the growing reliance of modern supercomputers on accelerator-based architectures such a GPUs, the development and optimization of electronic structure methods to exploit these…