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Huajie Chen
Huajie Chen
Beijing Normal University
Подтвержден адрес электронной почты в домене bnu.edu.cn - Главная страница
Название
Процитировано
Процитировано
Год
Orbital-free density functional theory for molecular structure calculations
H Chen, A Zhou
Numerical Mathematics: Theory, Methods and Applications 1 (1), 1-28, 2008
822008
Adaptive Finite Element Approximations for Kohn-Sham Models
H Chen, X Dai, X Gong, L He, A Zhou
Multiscale Modeling & Simulation 12 (4), 1828-1869, 2014
732014
Numerical analysis of finite dimensional approximations of Kohn–Sham models
H Chen, X Gong, L He, Z Yang, A Zhou
Advances in Computational Mathematics 38 (2), 225-256, 2013
562013
Finite element approximations of nonlinear eigenvalue problems in quantum physics
H Chen, L He, A Zhou
Computer Methods in Applied Mechanics and Engineering 200 (21), 1846-1865, 2011
552011
QM/MM methods for crystalline defects. part 1: Locality of the tight binding model
H Chen, C Ortner
Multiscale Modeling & Simulation 14 (1), 232-264, 2016
462016
Numerical analysis of augmented plane wave methods for full-potential electronic structure calculations
H Chen, R Schneider
ESAIM: Mathematical Modelling and Numerical Analysis 49 (3), 755-785, 2015
452015
Numerical methods for a Kohn-Sham density functional model based on optimal transport
H Chen, G Friesecke, CB Mendl
Journal of chemical theory and computation 10 (10), 4360-4368, 2014
402014
Numerical approximations of a nonlinear eigenvalue problem and applications to a density functional model
H Chen, X Gong, A Zhou
Mathematical Methods in the Applied Sciences 33 (14), 1723-1742, 2010
392010
QM/MM methods for crystalline defects. Part 2: Consistent energy and force-mixing
H Chen, C Ortner
Multiscale Modeling & Simulation 15 (1), 184-214, 2017
342017
Adaptive finite element approximations for a class of nonlinear eigenvalue problems in quantum physics
H Chen, X Gong, L He, A Zhou
Advances in Applied Mathematics and Mechanics 3 (4), 493-518, 2011
27*2011
A two-scale higher-order finite element discretization for Schrödinger equation
H Chen, F Liu, A Zhou
Journal of Computational Mathematics, 315-337, 2009
252009
Thermodynamic limit of crystal defects with finite temperature tight binding
H Chen, J Lu, C Ortner
Archive for Rational Mechanics and Analysis 230 (2), 701-733, 2018
232018
Pair densities in density functional theory
H Chen, G Friesecke
Multiscale Modeling & Simulation 13 (4), 1259-1289, 2015
212015
Geometry equilibration of crystalline defects in quantum and atomistic descriptions
H Chen, FQ Nazar, C Ortner
Mathematical Models and Methods in Applied Sciences 29 (03), 419-492, 2019
192019
Error estimates for Hermite and even-tempered Gaussian approximations in quantum chemistry
M Bachmayr, H Chen, R Schneider
Numerische Mathematik 128 (1), 137-165, 2014
162014
Adaptive QM/MM coupling for crystalline defects
H Chen, M Liao, H Wang, Y Wang, L Zhang
Computer Methods in Applied Mechanics and Engineering 354, 351-368, 2019
142019
Plane wave methods for quantum eigenvalue problems of incommensurate systems
Y Zhou, H Chen, A Zhou
Journal of Computational Physics 384, 99-113, 2019
132019
A Posteriori Error Estimates for Adaptive QM/MM Coupling Methods
Y Wang, H Chen, M Liao, C Ortner, H Wang, L Zhang
SIAM Journal on Scientific Computing 43 (4), A2785-A2808, 2021
122021
Locality of interatomic forces in tight binding models for insulators
C Ortner, J Thomas, H Chen
ESAIM. Mathematical Modelling and Numerical Analysis 54, 2020
122020
Error Estimates of Some Numerical Atomic Orbitals in Molecular Simulations
H Chen, R Schneider
Communications in Computational Physics 18 (1), 125-146, 2015
92015
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