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cs.DC2026
MakoXC: Rearchitecting DFT Exchange-Correlation with Matrix-Aligned and Knowledge-Organized Sparsity
Haozhi Han, Fusong Ju, Jing Bai +8
Density Functional Theory (DFT) is indispensable for materials science and drug discovery, yet the exchange--correlation (XC) evaluation remains a major bottleneck due to its cubic…
cs.DC2021
An Efficient Vectorization Scheme for Stencil Computation
Kun Li, Liang Yuan, Yunquan Zhang +3
Stencil computation is one of the most important kernels in various scientific and engineering applications. A variety of work has focused on vectorization and tiling techniques, a…
cs.DC2021
Reducing Redundancy in Data Organization and Arithmetic Calculation for Stencil Computations
Kun Li, Liang Yuan, Yunquan Zhang +3
Stencil computation is one of the most important kernels in various scientific and engineering applications. A variety of work has focused on vectorization techniques, aiming at ex…