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Ke XU
Ke XU
Verified email at stu.xmu.edu.cn
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GPUMD: A package for constructing accurate machine-learned potentials and performing highly efficient atomistic simulations
Z Fan, Y Wang, P Ying, K Song, J Wang, Y Wang, Z Zeng, K Xu, ...
The Journal of Chemical Physics 157, 114801, 2022
1502022
A submicron Si@ C core-shell intertwined with carbon nanowires and graphene nanosheet as a high-performance anode material for lithium ion battery
Z Fan, Y Wang, S Zheng, K Xu, J Wu, S Chen, J Liang, A Shi, Z Wang
Energy Storage Materials 39, 1-10, 2021
1052021
Self-deicing electrolyte hydrogel surfaces with Pa-level ice adhesion and durable antifreezing/antifrost performance
T Li, PF Ibáñez-Ibáñez, V Håkonsen, J Wu, K Xu, Y Zhuo, S Luo, J He, ...
ACS applied materials & interfaces 12 (31), 35572-35578, 2020
862020
Thermal transport in from molecular dynamics using different empirical potentials
K Xu, AJ Gabourie, A Hashemi, Z Fan, N Wei, AB Farimani, HP Komsa, ...
Physical Review B 99 (5), 054303, 2019
762019
Wetting properties of defective graphene oxide: a molecular simulation study
K Xu, J Zhang, X Hao, C Zhang, N Wei, C Zhang
Molecules 23 (6), 1439, 2018
432018
Thermal transport properties of single-layer black phosphorous from extensive molecular dynamics simulations
K Xu, Z Fan, J Zhang, N Wei, T Ala-Nissila
Modelling and Simulation in Materials Science and Engineering 26, 085001, 2018
392018
Accurate prediction of heat conductivity of water by a neuroevolution potential
K Xu, Y Hao, T Liang, P Ying, J Xu, J Wu, Z Fan
The Journal of Chemical Physics 158 (20), 2023
282023
HTR: An ultra-high speed algorithm for cage recognition of clathrate hydrates
Y Liu, K Xu, Y Xu, J Liu, J Wu, Z Zhang
Nanotechnology Reviews 11 (1), 699-711, 2022
262022
Strengthening and weakening of methane hydrate by water vacancies.
Y Lin, Y Liu, K Xu, T Li, Z Zhang, J Wu
Advances in Geo-Energy Research 6 (1), 2022
252022
Mechanical Properties of CH4–CO2 Heteroclathrate Hydrates
K Xu, L Yang, J Liu, Z Zhang, J Wu
Energy & Fuels 34 (11), 14368-14378, 2020
252020
Sub-micrometer phonon mean free paths in metal–organic frameworks revealed by machine learning molecular dynamics simulations
P Ying, T Liang, K Xu, J Zhang, J Xu, Z Zhong, Z Fan
ACS Applied Materials & Interfaces 15 (30), 36412-36422, 2023
222023
Molecular dynamics simulations of heat transport using machine-learned potentials: A mini-review and tutorial on GPUMD with neuroevolution potentials
H Dong, Y Shi, P Ying, K Xu, T Liang, Y Wang, Z Zeng, X Wu, W Zhou, ...
Journal of Applied Physics 135 (16), 2024
212024
Strengthening and Weakening by Dislocations in Monolayer MoS2
L Yang, J Liu, Y Lin, K Xu, X Cao, Z Zhang, J Wu
Chemistry of Materials 33 (22), 8758-8767, 2021
212021
Dual-ionic hydrogels with ultralong anti-dehydration lifespan and superior anti-icing performance
T Li, K Xu, L Shi, J Wu, J He, Z Zhang
Applied Materials Today 26, 101367, 2022
202022
Interfacial mechanical properties of tetrahydrofuran hydrate-solid surfaces: Implications for hydrate management
Y Lin, T Li, S Liu, Q Shi, K Xu, Z Zhang, J Wu
Journal of Colloid and Interface Science 629, 326-335, 2023
192023
Role of nanotube chirality on the mechanical characteristics of pillared graphene
Y Lin, K Xu, X Cao, Z Zhang, J Wu
Mechanics of Materials 162, 104035, 2021
192021
Mechanisms of temperature-dependent thermal transport in amorphous silica from machine-learning molecular dynamics
T Liang, P Ying, K Xu, Z Ye, C Ling, Z Fan, J Xu
Physical Review B 108 (18), 184203, 2023
182023
Abnormally high thermal conductivity in fivefold twinned diamond nanowires
T Liang, K Xu, M Han, Y Yao, Z Zhang, X Zeng, J Xu, J Wu
Materials Today Physics 25, 100705, 2022
182022
Structural and mechanical stability of clathrate hydrates encapsulating monoatomic guest species
K Xu, Y Lin, T Li, Y Fu, Z Zhang, J Wu
Journal of Molecular Liquids 347, 118391, 2022
182022
Efficient mechanical modulation of the phonon thermal conductivity of Mo 6 S 6 nanowires
K Xu, S Deng, T Liang, X Cao, M Han, X Zeng, Z Zhang, N Yang, J Wu
Nanoscale 14 (8), 3078-3086, 2022
182022
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