基于图形处理单元与密度拟合近似的单精度耦合簇CCSD和CCSD(T)程序
王治钒, 何冰, 路艳朝, 王繁
Single-precision CCSD and CCSD(T) Calculations with Density Fitting Approximations on Graphics Processing Units
Zhifan Wang, Bing He, Yanzhao Lu, Fan Wang
化学学报
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2022, (10): 1401
-1409
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DOI: 10.6023/A22070313