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Plane wave methods for quantum eigenvalue problems of incommensurate systems 期刊论文
JOURNAL OF COMPUTATIONAL PHYSICS, 2019, 卷号: 384, 页码: 99-113
作者:  Zhou, Yuzhi;  Chen, Huajie;  Zhou, Aihui
收藏  |  浏览/下载:108/0  |  提交时间:2019/12/13
Incommensurate system  Quantum eigenvalue problem  Plane wave  Density functional theory  
A defect correction scheme for finite element eigenvalues with applications to quantum chemistry 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2006, 卷号: 28, 期号: 1, 页码: 321-338
作者:  Shen, LH;  Zhou, AH
收藏  |  浏览/下载:92/0  |  提交时间:2018/07/30
defect correction  eigenvalue  finite element  Hartree-Fock equation  highly accurate  quantum chemistry