Towards Agentic Intelligence for Materials Science.

Xuye Liu

Huan Zhang 0001 Yizhan Li Wenhao Huang 0001 Ziyu Hou Yu Song Xuye Liu Farshid Effaty Jinya Jiang Sifan Wu 0003 Qianggang Ding Izumi Takahara Leonard R. MacGillivray Teruyasu Mizoguchi Tianshu Yu 0001 Lizi Liao Yuyu Luo Yu Rong Jia Li 0013 Ying Diao Heng Ji 0001 Bang Liu 0003 Towards Agentic Intelligence for Materials Science. 2026 February abs/2602.00169 CoRR https://doi.org/10.48550/arXiv.2602.00169 db/journals/corr/corr2602.html#abs-2602-00169 streams/journals/corr

Yimu Wang Xuye Liu Wei Pang Li Ma Shuai Yuan Paul E. Debevec Ning Yu 0006 Survey of Video Diffusion Models: Foundations, Implementations, and Applications. 2025 2025 Trans. Mach. Learn. Res. https://openreview.net/forum?id=2ODDBObKjH db/journals/tmlr/tmlr2025.html#WangLPMYDY25 streams/journals/tmlr

Xuye Liu Tengfei Ma 0001 Yimu Wang Fengjie Wang Jian Zhao 0010 NBDESCRIB: A Dataset for Text Description Generation from Tables and Code in Jupyter Notebooks with Guidelines. 26584-26606 2025 ACL (Findings) https://doi.org/10.18653/v1/2025.findings-acl.1364 https://aclanthology.org/2025.findings-acl.1364/ conf/acl/2025f db/conf/acl/acl2025f.html#Liu0WWZ25 Xuye Liu Annie Sun Pengcheng An Tengfei Ma 0001 Jian Zhao 0010 Influencer: Empowering Everyday Users in Creating Promotional Posts via AI-infused Exploration and Customization. 1004:1-1004:19 2025 CHI https://doi.org/10.1145/3706598.3713309 conf/chi/2025 db/conf/chi/chi2025.html#LiuSA0Z25 Xuye Liu Yimu Wang Jian Zhao 0010 ELIOT: Zero-Shot Video-Text Retrieval through Relevance-Boosted Captioning and Structural Information Extraction. 381-391 2025 NAACL (Student Research Workshop) https://doi.org/10.18653/v1/2025.naacl-srw.37 https://aclanthology.org/2025.naacl-srw.37/ conf/naacl/2025-4 db/conf/naacl/naacl2025-4.html#LiuWZ25 streams/conf/naacl Xuye Liu Yuzhe You Xinrong Qiu Tengfei Ma 0001 Jian Zhao 0010 MACEDON : Supporting Programmers with Real-Time Multi-Dimensional Code Evaluation and Optimization. 31:1-31:17 2025 UIST https://doi.org/10.1145/3746059.3747655 conf/uist/2025 db/conf/uist/uist2025.html#LiuYQ0025

Yimu Wang Xuye Liu Wei Pang Li Ma Shuai Yuan Paul E. Debevec Ning Yu 0006 Survey of Video Diffusion Models: Foundations, Implementations, and Applications. 2025 April abs/2504.16081 CoRR https://doi.org/10.48550/arXiv.2504.16081 db/journals/corr/corr2504.html#abs-2504-16081 streams/journals/corr

Zijian Chen Xueguang Ma Shengyao Zhuang Ping Nie Kai Zou Andrew Liu Joshua Green Kshama Patel Ruoxi Meng Mingyi Su Sahel Sharifymoghaddam Yanxi Li Haoran Hong Xinyu Shi Xuye Liu Nandan Thakur Crystina Zhang Luyu Gao Wenhu Chen Jimmy Lin BrowseComp-Plus: A More Fair and Transparent Evaluation Benchmark of Deep-Research Agent. 2025 August abs/2508.06600 CoRR https://doi.org/10.48550/arXiv.2508.06600 db/journals/corr/corr2508.html#abs-2508-06600 streams/journals/corr

Xuye Liu Annie Sun Pengcheng An Tengfei Ma 0001 Jian Zhao 0010 Influencer: Empowering Everyday Users in Creating Promotional Posts via AI-infused Exploration and Customization. 2024 abs/2407.14928 CoRR https://doi.org/10.48550/arXiv.2407.14928 db/journals/corr/corr2407.html#abs-2407-14928 streams/journals/corr

Fengjie Wang Xuye Liu Oujing Liu Ali Neshati Tengfei Ma 0001 Min Zhu 0005 Jian Zhao 0010 Slide4N: Creating Presentation Slides from Computational Notebooks with Human-AI Collaboration. 364:1-364:18 2023 CHI https://doi.org/10.1145/3544548.3580753 https://www.wikidata.org/entity/Q130852979 conf/chi/2023 db/conf/chi/chi2023.html#WangLLN0ZZ23

Qi Lin Yuli Zhou Siyuan Shi Yujuan Zhang Shaoli Yin Xuye Liu Qihui Peng Shaoting Huang Yitao Jiang Chen Cui Ruilian She Jinfeng Xu Fajin Dong How much can AI see in early pregnancy: A multi-center study of fetus head characterization in week 10-14 in ultrasound using deep learning. 107170 2022 226 Comput. Methods Programs Biomed. https://doi.org/10.1016/j.cmpb.2022.107170 db/journals/cmpb/cmpb226.html#LinZSZYLPHJCSXD22

April Yi Wang Dakuo Wang Jaimie Drozdal Michael J. Muller Soya Park Justin D. Weisz Xuye Liu Lingfei Wu 0001 Casey Dugan Documentation Matters: Human-Centered AI System to Assist Data Science Code Documentation in Computational Notebooks. 17:1-17:33 2022 29 ACM Trans. Comput. Hum. Interact. 2 https://doi.org/10.1145/3489465 https://www.wikidata.org/entity/Q114613922 db/journals/tochi/tochi29.html#WangWDMPWLWD22

April Yi Wang Dakuo Wang Jaimie Drozdal Xuye Liu Soya Park Steve Oney Christopher Brooks 0001 What Makes a Well-Documented Notebook? A Case Study of Data Scientists' Documentation Practices in Kaggle. 445:1-445:7 2021 CHI Extended Abstracts https://doi.org/10.1145/3411763.3451617 conf/chi/2021a db/conf/chi/chi2021a.html#WangWDLPO021 Xuye Liu Dakuo Wang April Yi Wang Yufang Hou 0001 Lingfei Wu 0001 HAConvGNN: Hierarchical Attention Based Convolutional Graph Neural Network for Code Documentation Generation in Jupyter Notebooks. 4473-4485 2021 EMNLP (Findings) https://doi.org/10.18653/v1/2021.findings-emnlp.381 https://aclanthology.org/2021.findings-emnlp.381 conf/emnlp/2021f db/conf/emnlp/emnlp2021f.html#LiuWWHW21 April Yi Wang Dakuo Wang Xuye Liu Lingfei Wu 0001 Graph-Augmented Code Summarization in Computational Notebooks. 5020-5023 2021 IJCAI https://doi.org/10.24963/ijcai.2021/717 conf/ijcai/2021 db/conf/ijcai/ijcai2021.html#WangWLW21 Michael J. Muller April Yi Wang Steven I. Ross Justin D. Weisz Mayank Agarwal Kartik Talamadupula Stephanie Houde Fernando Martinez 0001 John T. Richards Jaimie Drozdal Xuye Liu David Piorkowski Dakuo Wang How Data Scientists Improve Generated Code Documentation in Jupyter Notebooks. 2021 IUI Workshops https://ceur-ws.org/Vol-2903/IUI21WS-HAIGEN-10.pdf conf/iui/2021w db/conf/iui/iui2021w.html#MullerWRWATHMRD21

April Yi Wang Dakuo Wang Jaimie Drozdal Michael J. Muller Soya Park Justin D. Weisz Xuye Liu Lingfei Wu 0001 Casey Dugan Themisto: Towards Automated Documentation Generation in Computational Notebooks. 2021 abs/2102.12592 CoRR https://arxiv.org/abs/2102.12592 db/journals/corr/corr2102.html#abs-2102-12592

Xuye Liu Dakuo Wang April Yi Wang Lingfei Wu 0001 HAConvGNN: Hierarchical Attention Based Convolutional Graph Neural Network for Code Documentation Generation in Jupyter Notebooks. 2021 abs/2104.01002 CoRR https://arxiv.org/abs/2104.01002 db/journals/corr/corr2104.html#abs-2104-01002

Mayank Agarwal Pengcheng An Christopher Brooks 0001 Wenhu Chen Zijian Chen Chen Cui Paul E. Debevec Ying Diao Qianggang Ding Fajin Dong Jaimie Drozdal Casey Dugan Farshid Effaty Luyu Gao Joshua Green Haoran Hong Yufang Hou 0001 Ziyu Hou Stephanie Houde Shaoting Huang Wenhao Huang 0001 Heng Ji 0001 Jinya Jiang Yitao Jiang Jia Li 0013 Yanxi Li Yizhan Li Lizi Liao Jimmy Lin Qi Lin Andrew Liu Bang Liu 0003 Oujing Liu Yuyu Luo Li Ma Tengfei Ma 0001 Xueguang Ma Leonard R. MacGillivray Fernando Martinez 0001 Ruoxi Meng Teruyasu Mizoguchi Michael J. Muller Ali Neshati Ping Nie Steve Oney Wei Pang Soya Park Kshama Patel Qihui Peng David Piorkowski Xinrong Qiu John T. Richards Yu Rong Steven I. Ross Sahel Sharifymoghaddam Ruilian She Siyuan Shi Xinyu Shi Yu Song Mingyi Su Annie Sun Izumi Takahara Kartik Talamadupula Nandan Thakur April Yi Wang Dakuo Wang Fengjie Wang Yimu Wang Justin D. Weisz Lingfei Wu 0001 Sifan Wu 0003 Jinfeng Xu Shaoli Yin Yuzhe You Ning Yu 0006 Tianshu Yu 0001 Shuai Yuan Huan Zhang 0001 Xinyu Zhang 0018Crystina Zhang Yujuan Zhang Jian Zhao 0010 Yuli Zhou Min Zhu 0005 Shengyao Zhuang Kai Zou