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Science (New York, N.Y.)
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November 8, 2014
Microscopic mechanisms of equilibrium melting of a solid
Amit Samanta, Mark E Tuckerman, Tang-Qing Yu, et al.
Physical Review Letters
|
May 21, 2010
Nucleation of ordered phases in block copolymers
Xiuyuan Cheng, Ling Lin, Weinan E, et al.
The Journal of Chemical Physics
|
May 3, 2014
Sampling saddle points on a free energy surface
Amit Samanta, Ming Chen, Tang-Qing Yu, et al.
Journal of Chemical Information and Modeling
|
September 28, 2024
Accurate Conformation Sampling via Protein Structural Diffusion
Jiahao Fan, Ziyao Li, Eric Alcaide, et al.
Nature Computational Science
|
January 4, 2024
Efficient sampling of high-dimensional free energy landscapes using adaptive reinforced dynamics
Dongdong Wang, Yanze Wang, Junhan Chang, et al.
Physical Review Letters
|
February 22, 2026
Ab Initio Bulk Free Energy Surface of Proper Ferroelectrics
Pinchen Xie, Yixiao Chen, Xinyu Xu, et al.
The Journal of Chemical Physics
|
March 9, 2021
Deep potential generation scheme and simulation protocol for the Li<sub>10</sub>GeP<sub>2</sub>S<sub>12</sub>-type superionic conductors
Jianxing Huang, Linfeng Zhang, Han Wang, et al.
Nature Communications
|
August 8, 2024
Deep learning tight-binding approach for large-scale electronic simulations at finite temperatures with ab initio accuracy
Qiangqiang Gu, Zhanghao Zhouyin, Shishir Kumar Pandey, et al.
The Journal of Chemical Physics
|
April 2, 2022
A deep potential model with long-range electrostatic interactions
Linfeng Zhang, Han Wang, Maria Carolina Muniz, et al.
Angewandte Chemie (International Ed. in English)
|
April 19, 2024
Machine Learning Molecular Dynamics Shows Anomalous Entropic Effect on Catalysis through Surface Pre-melting of Nanoclusters
Fu-Qiang Gong, Yun-Pei Liu, Ye Wang, et al.
Page
of 6
Search research articles
Search
Showing results (31-40 of 54) with videos related to
Sort By:
Page
of 6
Science (New York, N.Y.)
|
November 8, 2014
Microscopic mechanisms of equilibrium melting of a solid
Amit Samanta, Mark E Tuckerman, Tang-Qing Yu, et al.
Physical Review Letters
|
May 21, 2010
Nucleation of ordered phases in block copolymers
Xiuyuan Cheng, Ling Lin, Weinan E, et al.
The Journal of Chemical Physics
|
May 3, 2014
Sampling saddle points on a free energy surface
Amit Samanta, Ming Chen, Tang-Qing Yu, et al.
Journal of Chemical Information and Modeling
|
September 28, 2024
Accurate Conformation Sampling via Protein Structural Diffusion
Jiahao Fan, Ziyao Li, Eric Alcaide, et al.
Nature Computational Science
|
January 4, 2024
Efficient sampling of high-dimensional free energy landscapes using adaptive reinforced dynamics
Dongdong Wang, Yanze Wang, Junhan Chang, et al.
Physical Review Letters
|
February 22, 2026
Ab Initio Bulk Free Energy Surface of Proper Ferroelectrics
Pinchen Xie, Yixiao Chen, Xinyu Xu, et al.
The Journal of Chemical Physics
|
March 9, 2021
Deep potential generation scheme and simulation protocol for the Li<sub>10</sub>GeP<sub>2</sub>S<sub>12</sub>-type superionic conductors
Jianxing Huang, Linfeng Zhang, Han Wang, et al.
Nature Communications
|
August 8, 2024
Deep learning tight-binding approach for large-scale electronic simulations at finite temperatures with ab initio accuracy
Qiangqiang Gu, Zhanghao Zhouyin, Shishir Kumar Pandey, et al.
The Journal of Chemical Physics
|
April 2, 2022
A deep potential model with long-range electrostatic interactions
Linfeng Zhang, Han Wang, Maria Carolina Muniz, et al.
Angewandte Chemie (International Ed. in English)
|
April 19, 2024
Machine Learning Molecular Dynamics Shows Anomalous Entropic Effect on Catalysis through Surface Pre-melting of Nanoclusters
Fu-Qiang Gong, Yun-Pei Liu, Ye Wang, et al.
Page
of 6