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FINITE VOLUME DISCRETIZATIONS FOR EIGENVALUE PROBLEMS WITH APPLICATIONS TO ELECTRONIC STRUCTURE CALCULATIONS 期刊论文
MULTISCALE MODELING & SIMULATION, 2011, 卷号: 9, 期号: 1, 页码: 208-240
作者:  Dai, Xiaoying;  Gong, Xingao;  Yang, Zhang;  Zhang, Dier;  Zhou, Aihui
收藏  |  浏览/下载:92/0  |  提交时间:2018/07/30
eigenvalue  electronic structure  finite element  finite volume  high order  symmetric  
A finite element recovery approach to Green's function approximations with applications to electrostatic potential computation 期刊论文
JOURNAL OF COMPUTATIONAL AND APPLIED MATHEMATICS, 2009, 卷号: 225, 期号: 1, 页码: 202-212
作者:  Yang, Ying;  Zhou, Aihui
收藏  |  浏览/下载:90/0  |  提交时间:2018/07/30
Finite element  Green's function  Recovery approach  Three dimensions  Electrostatic potential  Poisson-Boltzmann equation  
Convergence and optimal complexity of adaptive finite element eigenvalue computations 期刊论文
NUMERISCHE MATHEMATIK, 2008, 卷号: 110, 期号: 3, 页码: 313-355
作者:  Dai, Xiaoying;  Xu, Jinchao;  Zhou, Aihui
收藏  |  浏览/下载:87/0  |  提交时间:2018/07/30
THREE-SCALE FINITE ELEMENT EIGENVALUE DISCRETIZATIONS 期刊论文
BIT NUMERICAL MATHEMATICS, 2008, 卷号: 48, 期号: 3, 页码: 533-562
作者:  Gao, X.;  Liu, F.;  Zhou, A.
收藏  |  浏览/下载:82/0  |  提交时间:2018/07/30
discretization  eigenvalue  finite element  three-scale  
Orbital-Free Density Functional Theory for Molecular Structure Calculations 期刊论文
NUMERICAL MATHEMATICS-THEORY METHODS AND APPLICATIONS, 2008, 卷号: 1, 期号: 1, 页码: 1-28
作者:  Chen, Huajie;  Zhou, Aihui
收藏  |  浏览/下载:96/0  |  提交时间:2018/07/30
Density functional theory  molecular structure  numerical discretization  orbital-free