2 papers
cs.DC2026
A Precision Emulation Approach to the GPU Acceleration of Ab Initio Electronic Structure Calculations
Hang Liu, Junjie Li, Yinzhi Wang +2
This study explores the use of INT8-based emulation for accelerating traditional FP64-based HPC workloads on modern GPU architectures. Through SCILIB-Accel automatic BLAS offload t…
physics.comp-ph2023
High Performance GPU Accelerated MuST Software
Xiao Liang, Edward Hanna, Derek Simmel +2
The MuST package is a computational software designed for ab initio electronic structure calculations for solids. The Locally Self-consistent Multiple Scattering (LSMS) method impl…