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Papers citing Materials Data toward Machine Learning: Advances and Challenges

  1. Extracting and reconstructing knowledge in materials science literature using large language models

    Communications Materials · 2026-01-08

    Shuyuan Li, Shihao Wei, Chenyu Huang, Yunjiang Zhang, Guizhen Zhang, Shaorui Sun

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  2. Machine Learning-Assisted Polymer and Polymer Composite Design for Additive Manufacturing

    AI Materials · 2026-01-17

    Kingsley Yeboah Gyabaah, Bernard Mahoney, Anthony Kwasi Martey, Cheng Yan, Patrick F. Mensah, Guoqiang Li

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  3. Contrastive learning for data-efficient substrate deoxidation monitoring in edge-side adaptive molecular beam epitaxy systems

    Journal of Semiconductors · 2026-03-01

    Yuehao Li, Cai Shen, Wenkang Zhan, Bowen Xu, Yazhou Yang, Xu Zhang, Hongchang Wang, Chao Zhao, Haifang Jian

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  4. Data Distribution Matters: Enhancing model generalization in Data-Driven Materials Discovery by intentionally exploiting both positive and negative data

    Acta Physico-Chimica Sinica · 2026-03-01

    Yiheng Wu, Lijun Liu, Wei Deng, Haodong Jiang, Ruotong Li, Ming Hu, Bo Peng, Dapeng Wang

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  5. Machine Learning Prediction of Crystal Structure Stability toward the Design of High-Entropy Oxides

    Chinese Physics Letters · 2026-03-30

    Qiancheng Zhou, C. Wang, Liyuan Wang, Zhouzhou Wang, Ming Qiu, Mingdong Dong, Ying Yu

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  6. Unveiling Tribological Mechanisms of MoS2 Coatings on FeNiCr Alloys via Molecular Dynamics and Machine Learning

    Chinese Journal of Mechanical Engineering · 2026-05-01

    Kun Guo, Hang Li, Xibo Shao, Junqin Shi, Liangzhu Zhang, Xian-Zong Wang, Jianxi Liu, Cheng‐Feng Du, Jie Wang, Shaowei Feng, Long Wang

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  7. Data-driven design of electrocatalysts: Machine learning workflows, paradigm shifts, and applications

    Advanced Powder Materials · 2026-05-21

    Ziwei Liu, Hanqing Gu, Liwei Yang, Wengcheng Wu, Zhong Huang, Haozhi Wang, Yang Wang, Yida Deng

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  8. Quantifying and Interpreting Solvation Power of Cyclic Carbonate by Chemical Calculation and Machine Learning

    The Journal of Physical Chemistry Letters · 2026-05-26

    Tong Wu, Zhong-Yang LIU, J W Zhang, Qi-Kai Ma, Hao-Xiong Nan, Weijie Chi, Ebrahim Nemati‐Kande, Akbar Dauletbay, Xin-Bing Cheng, Long Kong

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  9. Data-richness-driven machine learning for predictive design of high-performance g-C₃N₄ photocatalysts in NO removal

    Results in Engineering · 2026-07-14

    Tianfang Li, Caijuan Xia, Huanyu Pei, Hongjuan Hao, Wingkei Ho, Dingze Lu

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  10. Machine learning modeling reveals unconventional nucleation mechanism in phase‐change material GeTe

    InfoScience. · 2026-08-14

    Siqi Tang, Qundao Xu, Shaojie Yuan, Rui Chen, Hengyi Hu, Meng Kai Xu, Kan‐Hao Xue, Nian‐Ke Chen, Riccardo Mazzarello, Xianbin Li, Xiangshui Miao, Ming Xu

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  11. A Dual Machine‐Learning Framework for Predicting Phase Stability and Mixing Enthalpy Difference in MSi 2 ‐Type High‐Entropy Refractory Metal Silicides

    Advanced Engineering Materials · 2026-08-31

    Nidhi Rawat, Deepak S. Bisht, A. Perumal

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