GPU集群下第一原理非局部映射势能计算

付继芸贾伟乐曹宗雁王龙叶煌迟学斌

First-principle nonlocal projector potential calculation on GPU cluster

FU Jiyun JIA Weile CAO Zongyan WANG Long YE Huang CHI Xuebin

计算机应用 . 2013, (06): 1540 -1552 . DOI: 10.3724/SP.J.1087.2013.01540