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エネルギー・環境材料研究センター 先進蓄電池研究開発拠点 データベースチーム

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論文

2026
  1. Wenqin Peng, Shigenobu Hayashi, Abraham Castro Garcia, Lei Fang, Masaki Takeguchi, Yibin Xu, Ken Sakaushi. Interpretable data-driven discovery of high-performance multielement metal oxide electrocatalysts for oxygen evolution reaction from a small hybrid dataset. Science and Technology of Advanced Materials. 27 [1] 2713992-1-2713992-12. 2026. Open Access
  2. Michiko Sasaki, Yibin Xu, Takao Mori, Masahiro Goto. Independent control of the thermoelectric parameters in titanium nitride thin films via crystal preferred orientation control using the combinatorial sputter coating. Japanese Journal of Applied Physics. 65 [7] 07SP32-07SP32-6. 2026. Open Access
2025
  1. Masahiro Goto, Michiko Sasaki, Taku Moronaga, Toru Hara, Yibin Xu. Room-temperature FeSi2-doped Cu2Se thermoelectric films with enhanced figure of merit. Scientific Reports. 15 [1] 27278-1-27278-10. 2025. Open Access
  2. Kei NISHIKAWA, Takuya MASUDA, Yibin XU, Yoshitaka TATEYAMA, Shoichi MATSUDA, Shuji NAKANISHI, Shotaro HANADA, Yoshiharu MUKOUYAMA, Toshihiko MANDAI, Naoaki KUWATA, Tsuyoshi OHNISHI, Kiyoshi KANAMURA. Global Trends in Battery Research and Development: The Contribution of the Center for Advanced Battery Collaboration. Electrochemistry. 93 [6] 062003-062003. 2025. Open Access
  3. Yen-Ju Wu, Yibin Xu, Lei Fang, Wenqin Peng, Ken Sakaushi, Meiqi Zhang, Masao Arai, Yukinori Koyama. Periodic table-based compositional descriptors for accelerating electrochemical material discovery: Li-ion conductors and oxygen evolution electrocatalysts. Science and Technology of Advanced Materials: Methods. 5 [1] 2513218-1-2513218-14. 2025. Open Access
  4. Tianzhuo Zhan, Chong Zheng, Mao Xu, Zhi Cao, Yen-Ju Wu, Yibin Xu, Ryo Yokogawa, Atsushi Ogura, Yanming Xue, Haidong Wang, Mengjie Song, Wei Wang, Bo Chen, Takanobu Watanabe, Yonggang Jiang, Huawei Chen, Deyuan Zhang. Thermal Conductivity and Thermal Boundary Resistance of Low–Dielectric Constant Interlayer Dielectrics in Advanced Very Large Scale Integration Interconnects. ACS Applied Electronic Materials. 7 [18] 8428-8439. 2025. Open Access
2024
  1. Yibin Xu, Yen-Ju Wu, Huiping Li, Lei Fang, Shigenobu Hayashi, Ayako Oishi, Natsuko Shimizu, Riccarda Caputo. A comprehensive data network for data-driven study of battery materials. Science and Technology of Advanced Materials. 25 [1] 2403328-1-2403328-11. 2024. Open Access
  2. Yen-Ju Wu, Kazuto Akagi, Masahiro Goto, Yibin Xu. Topological data analysis of TEM-based structural features affecting the thermal conductivity of amorphous Ge. International Journal of Heat and Mass Transfer. 221 125012. 2024. Open Access
2023
  1. Yen-Ju Wu, Yibin Xu. Data-Driven Design of Transparent Thermal Insulating Nanoscale Layered Oxides. Micromachines. 14 [1] 186. 2023. Open Access
  2. 徐 一斌. 電池材料のデータ駆動研究 物質探索から実用材料設計へ. 化学と工業. 76 [6] 377-379. 2023.
  3. Tianzhuo Zhan, Yen-Ju Wu, Yibin Xu. Effects of Thermal Boundary Resistance on Thermal Management of Gallium-Nitride-Based Semiconductor Devices: A Review. Micromachines. 14 [11] 2076. 2023. Open Access
  4. 徐 一斌. 無機材料データの収集と利活用. Journal of the Society of Inorganic Materials, Japan. 30 [427] 310-316. 2023. Open Access

書籍

2025
  1. 徐 一斌. マテリアルズ・インフォマティクスの 現状と将来展望. マテリアルズ・インフォマティクスが拓く材料開発の新潮流. 2025. Open Access

口頭発表

2026
  1. XU, Yibin. Building Materials Databases in the Age of AI: From Information Extraction to Scientific Representation. The 9th Asian Materials Data Symposium (AMDS 2026). 2026. 招待講演
  2. XU, Yibin. Evolving Data Infrastructure for Battery Materials Research. KRICT R&D Forum: Materials Data, AI, and Self-Driving Labs. 2026. 招待講演
  3. XU, Yibin. Leverage Data to Accelerate Innovation in Electrochemical Materials. CRC 1625 Ninth Colloquium 2026. 2026. 招待講演
  4. 後藤 真宏, 佐々木 道子, 徐 一斌. コンビナトリアルスパッタ法を用いた低熱伝導ハイエントロピー材料の探索. 日本金属学会2026年春期(第178回)講演大会. 2026.
  5. 徐 一斌. 電池材料研究を支えるデータ基盤と設計支援ツールの開発. 表面技術協会第153回講演大会. 2026. 招待講演
  6. XU, Yibin. Data Infrastructure and Machine-Learning-Guided Exploration of Battery Materials. 2026 I2CNER Annual Symposium. 2026. 招待講演
2025
  1. 徐 一斌. データが導く新しい材料研究 ― データ基盤からAI設計までの実践 ―. 2025年度第3回 DxMT人材育成セミナー. 2025. 招待講演
  2. WU, Yen-Ju, XU, Yibin. Inverse Design Framework for Exploring Material Spaces Integrated with Structure Prediction. Material Research Meeting 2025 (MRM 2025). 2025. Open Access
  3. WU, Yen-Ju, XU, Yibin. Structure Prediction from Chemical Formula Using Periodic Descriptors: Toward Inverse Design of Inorganic Materials. 2025 TwiChE (72nd Annual Meeting of the Taiwan Society of Chemical Engineer). 2025. 招待講演 Open Access
  4. 徐 一斌, 新井 正男, 森本新太郎. AIと高品質データの融合がもたらす新たな電池材料データベース. 第66回電池討論会. 2025.
  5. WU, Yen-Ju, YAMAURA, Kazunari, XU, Yibin. AI-Assisted Structure–Property Mapping of Perovskite Ferroelectrics for High-Permittivity Applications. 第35回 日本MRS年次大会. 2025. 招待講演 Open Access
  6. WU, Yen-Ju, SASAKI, Michiko, GOTO, Masahiro, XU, Yibin. Data-Driven Design of Multi-Element Thermal Insulating Thin Films for Advanced Thermal Management. TACT 2025 International Thin Films Conference. 2025. 招待講演 Open Access
  7. XU, Yibin. Leverage Data to Accelerate Innovation of Thermal Functional Materials. The 14th Asian Thermophysical Properties Conference (ATPC 2025). 2025. 招待講演 Open Access
  8. 福島孝治, 崎下 雄稀, 徐 一斌. AtomWork Explorerについて. 日本物理学会第80回年次大会. 2025.
  9. 後藤 真宏, 佐々木 道子, 諸永 拓, 原 徹, 徐 一斌. 室温におけるFeSi2添加Cu2Se薄膜の熱電特性. 2025年第86回応用物理学会秋季学術講演会. 2025. Open Access
  10. WU, Yen-Ju, XU, Yibin. Structure Prediction from Chemical Formula Using Periodic Descriptors. 第86回応用物理学会 秋季学術講演会. 2025. Open Access
  11. XU, Yibin. Application of Data-Driven Approaches to Thermal Property Engineering. NPL 2nd Industrial Advisory Group -- Advanced Materials Thermal Characterisation. 2025. 招待講演
  12. 福島孝治, 崎下 雄稀, 方 蕾, 西川 宜孝, 新井 正男, 徐 一斌. AtomWork Creatorについて. NIFS一般共同利用研究課題(研究会). 2025.
  13. SASAKI, Michiko, Shenghong Ju, XU, Yibin, 塩見 淳一郎, GOTO, Masahiro. Optimization of strain in bismuth telluride thermoelectric films by combinatorial gradient thermal annealing (COGTAN). The 41st International and 7th Asian Conference on Thermoelectrics 2025. 2025.
  14. GOTO, Masahiro, SASAKI, Michiko, MORONAGA, Taku, HARA, Toru, XU, Yibin. Large figure-of-merit in Cu2Se films doped with SiFeO as a room-temperature thermoelectrics. The 41st International and 7th Asian Conference on Thermoelectrics (ICT/ACT 2025). 2025.
  15. 徐 一斌. 伝熱制御材料データ駆動研究の挑戦. 日本化学会 第105春季年会 (2025). 2025. 招待講演
  16. WU, Yen-Ju, XU, Yibin. Designing Thermal Insulating thin films with Data-Driven Innovation. 2025 Nature Conference: Materials for AI, AI for Materials. 2025. 招待講演 Open Access
  17. 徐 一斌, ウー イェン ルー, 新井 正男, 小山 幸典, 李 惠萍, 方 蕾, 林 繁信, 大石 郁子, 清水 奈津子, 崎下 雄稀. データ駆動型電池材料探索の基盤技術. nano tech 2025 第24回 国際ナノテクノロジー総合展・技術会議. 2025.
2024
  1. WU, Yen-Ju, XU, Yibin. Data-driven approaches for designing thermal insulating materials. 7th Academic Collaboration Seminar (ACS) NTUST - NIMS workshop . 2024. 招待講演 Open Access
  2. XU, Yibin. Construction of High-Quality Databases for Data-Driven Study on Inorganic Materials. Data-driven materials R&D activities: A bilateral dialogue: France-Japan. 2024. 招待講演
  3. ZHANG, Meiqi, ARAI, Masao, WU, Yen-Ju, KOYAMA, Yukinori, XU, Yibin. First-Principles Calculations and Machine Learning Accelerated Superionic Conductivity Predictions for Novel Anti-Fluorite Solid Electrolytes. 2024 MRS Fall Meeting & Exhibit. 2024.
  4. 徐 一斌, 方 蕾, ウー イェン ルー, 張 美斉, 新井 正男. Liイオン伝導体のデータ駆動探索. 第65回電池討論会. 2024.
  5. KUWAJIMA, Isao, ITOH, Takuro, MATSUDA, Asahiko, ISHII, Masashi, XU, Yibin, ONO, Yoshinori, SAWADA, Kota, DEMURA, Masahiko. Introduction to World-Class Materials Database provided by NIMS. The 8th Asian Materials Data Symposium (AMDS 2024). 2024. 招待講演
  6. XU, Yibin, FANG, Lei, WU, Yen-Ju, ZHANG, Meiqi, KOYAMA, Yukinori, ARAI, Masao. Data-driven Exploration for Li Ionic Conductor. The 8th Asian Materials Data Symposium. 2024. 招待講演
  7. ZHANG, Meiqi, WU, Yen-Ju, KOYAMA, Yukinori, ARAI, Masao, XU, Yibin. Accelerating the valid of Solid Electrolyte Candidates through Machine Learning Force Fields: A Case Study on Li8SeN2 and Li10GeP2S12. NIMS Award Symposium 2024. 2024.
  8. XU, Yibin, WU, Yen-Ju, ARAI, Masao, 李 惠萍, FANG, Lei, 林 繁信, 大石 郁子, SAKISHITA, Yuki, 清水 奈津子. Development of Fundamental Technologies for Data-Driven Battery Material Exploration. NIMS Award Symposium 2024. 2024.
  9. XU, Yibin, WU, Yen-Ju, 李 惠萍, FANG, Lei. Development of a Data Network for Battery Materials. IWAMSN 2024. 2024.
  10. WU, Yen-Ju, Kazuto Akagi, GOTO, Masahiro, XU, Yibin. Structural Insights into Thermal Conductivity of Amorphous Germanium Using Topological Data Analysis. 第85回応用物理学会 秋季学術講演会. 2024. Open Access
  11. SAKAUSHI, Ken, FANG, Lei, PENG, Wenqin, 林 繁信, XU, Yibin. Curated Literature Data versus High-Quality Experimental Data: A Consideration on Handling Electrochemical Data with Divergent Characteristics for Artificial Intelligence based Efficient Discovery of Promising Water-Splitting Electrocatalysts. Data-driven discovery in the chemical sciences Faraday Discussion. 2024. 招待講演
2023
  1. KUWAJIMA, Isao, ITOH, Takuro, MATSUDA, Asahiko, ISHII, Masashi, XU, Yibin, ONO, Yoshinori, SAWADA, Kota, DEMURA, Masahiko. World-Class Materials Database provided by NIMS. マテリアル戦略総合シンポジウム2023 (MatISS2023) & DxMT,ARIM合同イベント. 2023.
  2. 徐 一斌, ウー イェン ルー, 福島孝治. 電池材料データベース AtomWork-Battery とその応用. 第2回先進蓄電池研究開発拠点(ABC)シンポジウム. 2023. 招待講演
  3. WU, Yen-Ju, XU, Yibin. Unveiling Key Factors and Design Implications for Enhancing Li Diffusion in Garnet Ionic Conductors. The 7th Asian Materials Data Symposium (2023 AMDS). 2023. 招待講演 Open Access
  4. XU, Yibin, FANG, Lei, WU, Yen-Ju. Application of Materials Data Extracted from Literature. The 7th Asian Materials Data Symposium. 2023. 招待講演 Open Access
  5. 崎下 雄稀, 徐 一斌, 福島 孝治. 高イオン伝導性材料探索のためのベイズ最適化フレームワーク. 第84回応用物理学会秋季学術講演会. 2023.
  6. 佐々木 道子, 鞠生宏, 徐 一斌, 後藤 真宏. コンビナトリアル傾斜アニール処理を施したBi2Te3薄膜の構造変化と熱電特性の相関. 表面技術協会 148回講演大会. 2023.
  7. XU, Yibin. Construction of a Materials Database for Exploration of New Battery Materials. KRICT R&D Forum. 2023. 招待講演