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AN ORTHOGONALIZATION-FREE PARALLELIZABLE FRAMEWORK FOR ALL-ELECTRON CALCULATIONS IN DENSITY FUNCTIONAL THEORY 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2022, 卷号: 44, 期号: 3, 页码: B723-B745
作者:  Gao, Bin;  Hu, Guanghu;  Kuang, Yang;  Liu, Xin
收藏  |  浏览/下载:98/0  |  提交时间:2023/02/07
Key words  density functional theory  all-electron calculations  total energy minimization  orthogonalization-free  scalability  
PARALLEL ENERGY-STABLE SOLVER FOR A COUPLED ALLEN-CAHN AND CAHN-HILLIARD SYSTEM 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2020, 卷号: 42, 期号: 5, 页码: C294-C312
作者:  Huang, Jizu;  Yang, Chao;  Wei, Ying
收藏  |  浏览/下载:139/0  |  提交时间:2021/04/26
coupled Allen-Cahn/Cahn-Hilliard system  discrete variational derivative method  unconditionally energy stable scheme  Newton-Krylov-Schwarz  domain decomposition method  
DYNAMIC EVALUATION OF EXPONENTIAL POLYNOMIAL CURVES AND SURFACES VIA BASIS TRANSFORMATION 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2019, 卷号: 41, 期号: 5, 页码: A3401-A3420
作者:  Yang, Xunnian;  Hong, Jialin
收藏  |  浏览/下载:127/0  |  提交时间:2020/05/24
curves and surfaces  linear differential operator  exponential polynomial  dynamic evaluation  basis transformation  
ACCELERATION OF THE TWO-LEVEL MGRIT ALGORITHM VIA THE DIAGONALIZATION TECHNIQUE 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2019, 卷号: 41, 期号: 5, 页码: A3421-A3448
作者:  Wu, Shu-Lin;  Zhou, Tao
收藏  |  浏览/下载:136/0  |  提交时间:2020/05/24
multigrid-reduction-in-time (MGRIT) algorithm  acceleration  convergence analysis  diagonalization technique  parallel coarse-grid-correction  
PARAREAL EXPONENTIAL theta-SCHEME FOR LONGTIME SIMULATION OF STOCHASTIC SCHRODINGER EQUATIONS WITH WEAK DAMPING 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2019, 卷号: 41, 期号: 6, 页码: B1155-B1177
作者:  Hong, Jialin;  Wang, Xu;  Zhang, Liying
收藏  |  浏览/下载:128/0  |  提交时间:2020/09/23
stochastic Schrodinger equation  parareal algorithm  exponential theta-scheme  invariant measure  
MULTISCALE ALGORITHMS AND COMPUTATIONS FOR THE TIME-DEPENDENT MAXWELL-SCHRODINGER SYSTEM IN HETEROGENEOUS NANOSTRUCTURES 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2019, 卷号: 41, 期号: 2, 页码: A1091-A1120
作者:  Ma, Chupeng;  Cao, Liqun;  Lin, Yanping
收藏  |  浏览/下载:161/0  |  提交时间:2020/01/10
Maxwell-Schrodinger system  homogenization method  multiscale asymptotic expansion  finite element method  
A NOVEL INTEGRAL EQUATION FOR SCATTERING BY LOCALLY ROUGH SURFACES AND APPLICATION TO THE INVERSE PROBLEM: THE NEUMANN CASE 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2019, 卷号: 41, 期号: 6, 页码: A3673-A3702
作者:  Qu, Fenglong;  Zhang, Bo;  Zhang, Haiwen
收藏  |  浏览/下载:160/0  |  提交时间:2020/09/23
integral equation  locally rough surface  Neumann boundary condition  far-field pattern  RCIP method  Newton iteration method  
EFFICIENT AND QUALIFIED MESH GENERATION FOR GAUSSIAN MOLECULAR SURFACE USING ADAPTIVE PARTITION AND PIECEWISE POLYNOMIAL APPROXIMATION 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2018, 卷号: 40, 期号: 2, 页码: B507-B527
作者:  Liu, Tiantian;  Chen, Minxin;  Lu, Benzhuo
收藏  |  浏览/下载:160/0  |  提交时间:2018/07/30
surface mesh generation  Gaussian surface  triangulation  adaptive partition  trilinear polynomial  
A GENERALIZED SAMPLING AND PRECONDITIONING SCHEME FOR SPARSE APPROXIMATION OF POLYNOMIAL CHAOS EXPANSIONS 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2017, 卷号: 39, 期号: 3, 页码: A1114-A1144
作者:  Jakeman, John D.;  Narayan, Akil;  Zhou, Tao
收藏  |  浏览/下载:108/0  |  提交时间:2018/07/30
uncertainty quantification  polynomial chaos  compressed sensing  
A NONLINEARLY PRECONDITIONED INEXACT NEWTON ALGORITHM FOR STEADY STATE LATTICE BOLTZMANN EQUATIONS 期刊论文
SIAM JOURNAL ON SCIENTIFIC COMPUTING, 2016, 卷号: 38, 期号: 3, 页码: A1701-A1724
作者:  Huang, Jizu;  Yang, Chao;  Cai, Xiao-Chuan
收藏  |  浏览/下载:138/0  |  提交时间:2018/07/30
steady state lattice Boltzmann equations  inexact Newton algorithm  nonlinear preconditioning  pollution removing coarse space  parallel scalability