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A parallel orbital-updating based plane-wave basis method for electronic structure calculations 期刊论文
JOURNAL OF COMPUTATIONAL PHYSICS, 2017, 卷号: 348, 页码: 482-492
Authors:  Pan, Yan;  Dai, Xiaoying;  de Gironcoli, Stefano;  Gong, Xin-Gao;  Rignanese, Gian-Marco;  Zhou, Aihui
Favorite  |  View/Download:24/0  |  Submit date:2018/07/30
Density functional theory  Electronic structure  Plane-wave  Parallel orbital-updating  
特征值问题的davidson型方法及其实现技术 期刊论文
数值计算与计算机应用, 2006, 卷号: 27, 期号: 3, 页码: 218
Authors:  戴小英;  周爱辉;  高兴誉
Favorite  |  View/Download:10/0  |  Submit date:2020/01/10