Publication Date | Article Title | Author(s) |
21-Sep-2020 | 86 PFLOPS Deep Potential Molecular Dynamics simulation of 100 million atoms with ab initio accuracy | Lu, Denghui; Wang, Han; Chen, Mohan; Lin, Lin; Car, Roberto; et al |
20-Feb-2012 | Adaptive local basis set for Kohn-Sham density functional theory in a discontinuous Galerkin framework I: Total energy calculation | Lin, Lin; Lu, Jianfeng; Ying, Lexing; E, Weinan |
28-Mar-2012 | Atomistic simulations of rare events using gentlest ascent dynamics | Samanta, Amit; E, Weinan |
12-Jun-2020 | Deep neural network for the dielectric response of insulators | Zhang, Linfeng; Chen, Mohan; Wu, Xifan; Wang, Han; E, Weinan; et al |
24-Mar-2022 | A deep potential model with long-range electrostatic interactions | Zhang, Linfeng; Wang, Han; Muniz, Maria Carolina; Panagiotopoulos, Athanassios Z; Car, Roberto; et al |
4-Apr-2018 | Deep Potential Molecular Dynamics: A Scalable Model with the Accuracy of Quantum Mechanics | Zhang, Linfeng; Han, Jiequn; Wang, Han; Car, Roberto; E, Weinan |
1-Jan-2018 | Deep Potential: A General Representation of a Many-Body Potential Energy Surface | Han, Jiequn; Zhang, Linfeng; Car, Roberto; E, Weinan |
16-Jul-2018 | DeePCG: Constructing coarse-grained models via deep neural networks | Zhang, Linfeng; Han, Jiequn; Wang, Han; Car, Roberto; E, Weinan |
15-Jul-2013 | Efficient iterative method for solving the Dirac–Kohn–Sham density functional theory | Lin, Lin; Shao, Sihong; E, Weinan |
Nov-2013 | Exact Renormalization Group Analysis of Turbulent Transport by the Shear Flow | E, Weinan; Shen, Hao |
Jul-2016 | Interfacial diffusion aided deformation during nanoindentation | Samanta, Amit; E, Weinan |
15-Oct-2019 | Isotope effects in liquid water via deep potential molecular dynamics | Ko, Hsin-Yu; Zhang, Linfeng; Santra, Biswajit; Wang, Han; E, Weinan; et al |
Jan-2016 | Multiscale Adaptive Representation of Signals: I. The Basic Framework | Tai, Cheng; E, Weinan |
Mar-2017 | Noisy Hegselmann-Krause Systems: Phase Transition and the 2R-Conjecture | Wang, Chu; Li, Qianxiao; E, Weinan; Chazelle, Bernard |
1-May-2012 | Optimized local basis set for Kohn-Sham density functional theory | Lin, Lin; Lu, Jianfeng; Ying, Lexing; E, Weinan |
9-Jun-2021 | Phase Diagram of a Deep Potential Water Model | Zhang, Linfeng; Wang, Han; Car, Roberto; E, Weinan |
Sep-2016 | Renormalized powers of Ornstein–Uhlenbeck processes and well-posedness of stochastic Ginzburg–Landau equations | E, Weinan; Jentzen, Arnulf; Shen, Hao |