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Journal of Chemical Theory and Computation
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August 3, 2023
Characterization of the Hydrogen-Bond Network in High-Pressure Water by Deep Potential Molecular Dynamics
Renxi Liu, Mohan Chen
Journal of Chemical Theory and Computation
|
June 30, 2025
A Deep Learning Framework for the Electronic Structure of Water: Toward a Universal Model
Xinyuan Liang, Renxi Liu, Mohan Chen
Physical Chemistry Chemical Physics : PCCP
|
December 15, 2022
Solvation structures of calcium and magnesium ions in water with the presence of hydroxide: a study by deep potential molecular dynamics
Jianchuan Liu, Renxi Liu, Yu Cao, et al.
Mikrochimica Acta
|
August 4, 2020
Photoelectrochemical immunoassay platform based on MoS<sub>2</sub> nanosheets integrated with gold nanostars for neuron-specific enolase assay
Renxi Liu, Yanying Wang, Wingleung Wong, et al.
The Journal of Chemical Physics
|
July 15, 2022
Structural and dynamic properties of solvated hydroxide and hydronium ions in water from ab initio modeling
Renxi Liu, Chunyi Zhang, Xinyuan Liang, et al.
The Journal of Chemical Physics
|
August 21, 2023
Implementation of the meta-GGA exchange-correlation functional in numerical atomic orbital basis: With systematic testing on SCAN, rSCAN, and r2SCAN functionals
Renxi Liu, Daye Zheng, Xinyuan Liang, et al.
Science Advances
|
May 27, 2026
Understanding the density maximum of water with machine-learned potentials
Yizhi Song, Renxi Liu, Chunyi Zhang, et al.
The Journal of Physical Chemistry. A
|
December 1, 2022
DeePKS + ABACUS as a Bridge between Expensive Quantum Mechanical Models and Machine Learning Potentials
Wenfei Li, Qi Ou, Yixiao Chen, et al.
Journal of Chemical Information and Modeling
|
October 20, 2025
dpdata: A Scalable Python Toolkit for Atomistic Machine Learning Data Sets
Jinzhe Zeng, Xingliang Peng, Yong-Bin Zhuang, et al.
The Journal of Chemical Physics
|
November 20, 2025
ABACUS: An electronic structure analysis package for the AI era
Weiqing Zhou, Daye Zheng, Qianrui Liu, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 10) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
August 3, 2023
Characterization of the Hydrogen-Bond Network in High-Pressure Water by Deep Potential Molecular Dynamics
Renxi Liu, Mohan Chen
Journal of Chemical Theory and Computation
|
June 30, 2025
A Deep Learning Framework for the Electronic Structure of Water: Toward a Universal Model
Xinyuan Liang, Renxi Liu, Mohan Chen
Physical Chemistry Chemical Physics : PCCP
|
December 15, 2022
Solvation structures of calcium and magnesium ions in water with the presence of hydroxide: a study by deep potential molecular dynamics
Jianchuan Liu, Renxi Liu, Yu Cao, et al.
Mikrochimica Acta
|
August 4, 2020
Photoelectrochemical immunoassay platform based on MoS<sub>2</sub> nanosheets integrated with gold nanostars for neuron-specific enolase assay
Renxi Liu, Yanying Wang, Wingleung Wong, et al.
The Journal of Chemical Physics
|
July 15, 2022
Structural and dynamic properties of solvated hydroxide and hydronium ions in water from ab initio modeling
Renxi Liu, Chunyi Zhang, Xinyuan Liang, et al.
The Journal of Chemical Physics
|
August 21, 2023
Implementation of the meta-GGA exchange-correlation functional in numerical atomic orbital basis: With systematic testing on SCAN, rSCAN, and r2SCAN functionals
Renxi Liu, Daye Zheng, Xinyuan Liang, et al.
Science Advances
|
May 27, 2026
Understanding the density maximum of water with machine-learned potentials
Yizhi Song, Renxi Liu, Chunyi Zhang, et al.
The Journal of Physical Chemistry. A
|
December 1, 2022
DeePKS + ABACUS as a Bridge between Expensive Quantum Mechanical Models and Machine Learning Potentials
Wenfei Li, Qi Ou, Yixiao Chen, et al.
Journal of Chemical Information and Modeling
|
October 20, 2025
dpdata: A Scalable Python Toolkit for Atomistic Machine Learning Data Sets
Jinzhe Zeng, Xingliang Peng, Yong-Bin Zhuang, et al.
The Journal of Chemical Physics
|
November 20, 2025
ABACUS: An electronic structure analysis package for the AI era
Weiqing Zhou, Daye Zheng, Qianrui Liu, et al.
Page
of 1