池田裕治

イケダユウジ | Ikeda Yuji

所属機関・部署：

研究分野 (1件)：金属材料物性

研究キーワード (1件)：第一原理計算

競争的資金等の研究課題 (4件)：

2023 - 2026 Computer-Aided Design of Laves-Phase Alloys for Hydrogen Storage
2023 - 2023 Bridge between Materials Science and Theoretical Chemistry-Machine-Learning Interatomic Potentials with the Coupled-Cluster Accuracy
2016 - 2018 形状記憶合金における格子振動の非調和性:第一原理計算に基づく定量解析
2012 - 2013 局所的な誘電特性及び電気伝導特性の解析のための第一原理電子状態計算プログラムの開発

論文 (71件)：

Pranav Kumar, Fritz Körmann, Blazej Grabowski, Yuji Ikeda. Machine learning potentials for hydrogen absorption in TiCr2 Laves phases. Acta Materialia. 2025
Sung, M.Y., Jang, T.J., Song, S.Y., Lee, G., nd Ryou, K. and Oh, S.-H., Lee, B.-J., Choi, P.-P., Neugebauer, J., et al. Ultrastrong and ductile CoNiMoAl medium-entropy alloys enabled by L12 nanoprecipitate-induced multiple deformation mechanisms. Journal of Materials Science and Technology. 2025. 225
Dangwal, S., Ikeda, Y., Grabowski, B., Edalati, K. Machine learning to explore high-entropy alloys with desired enthalpy for room-temperature hydrogen storage: Prediction of density functional theory and experimental data. Chemical Engineering Journal. 2024. 493
Hidalgo-Jim{\'e}nez, J., Akbay, T., Ikeda, Y., Ishihara, T., Edalati, K. Mechanism of anatase-to-columbite TiO2 phase transformation via sheared phases: first-principles calculations and high-pressure torsion experiments. Journal of Materials Science. 2024. 59. 14
Ou, Y., Ikeda, Y., Scholz, L., Divinski, S., Fritzen, F., Grabowski, B. Atomistic modeling of bulk and grain boundary diffusion in solid electrolyte Li6PS5Cl using machine-learning interatomic potentials. Physical Review Materials. 2024. 8. 11

講演・口頭発表等 (26件)：

Fe-M (M=Ni, Pd, Pt)不規則合金についての第一原理フォノン計算
(日本金属学会2015年春期(第156回)講演大会 2015)
Phonon dispersion relations of Fe and its alloys in paramagnetic state
(Ab initio Description of Iron and Steel: Multiple Impacts of Magnetism (ADIS2014) 2014)
常磁性Feにおけるフォノンと圧力相転移:第一原理計算とその統計処理
(日本金属学会2014年秋期(第155回)講演大会 2014)
Anharmonic behavior of phonons in paramagnetic iron
(3rd edition of the International Conference on Advanced Materials Modelling (ICAMM2014) 2014)
Volume dependence of phonon frequencies in paramagnetic bcc iron: a first-principles study
(The 4th International Symposium on Advanced Microscopy and Theoretical Calculations (AMTC4) 2014)

学歴 (2件)：

経歴 (4件)：

2019/11 - 現在 University of Stuttgart Institute for Materials Science
2018/04 - 2019/11 Max-Planck Institut für Eisenforschung GmbH Computational Materials Design Department
2017/04 - 2018/03 京都大学大学院工学研究科材料工学専攻
2013/04 - 2017/03 京都大学構造材料元素戦略研究拠点

受賞 (3件)：

2018/09 - 2018 Autumn Annual (163rd) Meeting of The Japan Institute of Metals and Materials Young Researcher Award
2015/11 - 2nd International Symposium on Frontiers in Materials Science (FMS2015) Poster Award (2nd Prize)
2013/10 - 16th Asian Workshop on First-Principles Electronic Structure Calculations (ASIAN16) Best Poster Award

所属学会 (1件)：

日本金属学会

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池田 裕治