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Jiaxin Xu
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A novel composite perovskite-based material for chemical-looping steam methane reforming to hydrogen and syngas
H Ding, Y Xu, C Luo, Q Wang, C Shen, J Xu, L Zhang
Energy conversion and management 171, 12-19, 2018
872018
Graph rationalization with environment-based augmentations
G Liu, T Zhao, J Xu, T Luo, M Jiang
Proceedings of the 28th ACM SIGKDD Conference on Knowledge Discovery and …, 2022
472022
Machine learning-assisted exploration of thermally conductive polymers based on high-throughput molecular dynamics simulations
R Ma, H Zhang, J Xu, L Sun, Y Hayashi, R Yoshida, J Shiomi, J Wang, ...
Materials Today Physics 28, 100850, 2022
242022
Effect of Sodium Bromide on CaO-Based Sorbents Derived from Three Kinds of Sources for CO2 Capture
C Shen, C Luo, T Luo, J Xu, B Lu, S Liu, L Zhang
ACS omega 5 (29), 17908-17917, 2020
152020
Data-centric learning from unlabeled graphs with diffusion model
G Liu, E Inae, T Zhao, J Xu, T Luo, M Jiang
Advances in neural information processing systems 36, 2024
102024
Extremely High Thermal Conductivity of Aligned Polyacetylene Predicted using First-Principles-Informed United-Atom Force Field
T Zhang, J Xu, T Luo
arXiv preprint arXiv:2009.13708, 2020
102020
Superior Polymeric Gas Separation Membrane Designed by Explainable Graph Machine Learning
J Xu, A Suleiman, G Liu, M Perez, R Zhang, M Jiang, R Guo, T Luo
arXiv preprint arXiv:2404.10903, 2024
2024
Unlocking enhanced thermal conductivity in polymer blends through active learning
J Xu, T Luo
npj Computational Materials 10 (1), 74, 2024
2024
Inverse Molecular Design with Multi-Conditional Diffusion Guidance
G Liu, J Xu, T Luo, M Jiang
arXiv preprint arXiv:2401.13858, 2024
2024
Machine learning-assisted discovery of high-performance polymer membranes for gas separation
J Xu, A Suleiman, G Liu, M Jiang, R Guo, T Luo
APS March Meeting Abstracts 2023, S03. 011, 2023
2023
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