Research field (5)：
Magnetism, superconductivity, and strongly correlated systems
, Energy chemistry
, Thin-film surfaces and interfaces
, Mathematical physics and basic theory
, Semiconductors, optical and atomic physics
Research keywords (2)：
Electrochemistry
, Compuatational Materials Physics
Research theme for competitive and other funds (13)：
2023 - 2026 物理-化学連携による持続的成長に向けた高機能・長寿命材料の探索・制御
2020 - 2025 Innovative energy storage materials based on the peculiar functions realized by isolated molecules/orbitals.
2022 - 2025 水電解電極として世界最高活性を示す非金属触媒の技術革新
2018 - 2022 Dense charge storage using anomalous dielectric electric double layer
2015 - 2019 Development of advanced energy storage system based on overall strategies on new materials and new interface
2010 - 2015 Studies on Structure Sampling and Non-Equilibrium Dynamics Using Ab-Initio Molecular Dynamics Methods
2007 - 2011 Design and study of nanotube hybrid structure
2007 - 2009 First principles simulation of electrochemical reaction at metal/water interface
2004 - 2006 カーボンナノチューブを基にしたナノ構造体の物性解明
2002 - 2003 Quantum Theoretical Approach in Exploration of New Functions in Surface Nano-Structures
1999 - 2000 単純二原子分子性固体の圧力誘起相転移の機構解明及び磁性の研究
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Papers (107)：
Minoru Otani. (Invited) Study of Electrochemical Interfaces Using DFT and the Classical Liquid Theory Hybrid Simulations. ECS Meeting Abstracts. 2023
Kuroda, Fumiaki, Hagiwara, Satoshi, Otani, Minoru. Structural changes in the lithium cobalt dioxide electrode: A combined approach with cluster expansion and Bayesian optimization. PHYSICAL REVIEW MATERIALS. 2023. 7. 11. 115402-1-115402-8
Hagiwara, Satoshi, Kuroda, Fumiaki, Kondo, Takahiro, Otani, Minoru. Electrocatalytic Mechanisms for an Oxygen Evolution Reaction at a Rhombohedral Boron Monosulfide Electrode/Alkaline Medium Interface. ACS Appl. Mater. Interfaces. 2023. 15. 43. 50174-50184
Ono, Takumi, Yoda, Satoshi, Kageyama, Daichi, Saito, Yoko, Takebayashi, Yoshihiro, Tai, Tetsuro, Otani, Minoru. Computational design of nucleating agents of poly (methyl methacrylate) microcellular foams: "savanna-like" surface structures and their effects on foaming. POLYMER ENGINEERING AND SCIENCE. 2023. 63. 12. 4019-4031
Taisuke, Hasegawa, Satoshi, Hagiwara, Minoru, Otani, Satoshi, Maeda. A Combined Reaction Path Search and Hybrid Solvation Method for the Systematic Exploration of Elementary Reactions at the Solid-Liquid Interface. JOURNAL OF PHYSICAL CHEMISTRY LETTERS. 2023. 14. 39. 8796-8804
Ando Yasunobu, Sugahara Akira, Kajiyama Satoshi, Otani Minoru, Okubo Masashi, Yamada Atsuo. Dependence of cation species and negative-dielectric effect on the electric-double layer capacitance of a MXene electrode. Abstract book of Annual Meeting of the Japan Society of Vacuum and Surface Science. 2019. 2019. 0. 3Hp04Y
Ando Yasunobu, Kawamura Yoshiumi, Ikeshoji Tamio, Otani Minoru. 7pAS-1 First-principles study of the relation between decomposition of ionic molecules and Fermi-level pinning on charged electrodes. Meeting abstracts of the Physical Society of Japan. 2014. 69. 2. 637-637
Hamada Ikutaro, Sugino Osamu, Bonnet Nicephore, Otani Minoru. Improved modeling of electrified interfaces using the effective screening medium method. Meeting abstracts of the Physical Society of Japan. 2013. 68. 2. 255-255
First-principles study on oxygen and selenium under high pressures
2000
Lectures and oral presentations (8)：
優れた安定性を持つ酸素発生反応触媒r-BS+G
(日本化学会第104春季年会(2024))
Enhancing the Stability of rBS+G Electrocatalyst for Efficient Oxygen Evolution Reaction
(第16回日本ホウ素・ホウ化物研究会)
r-BS as a promising high performance with strong durability metalfree electrocatalyst for OER
(Materials Research Meeting 2023 (MRM2023/IUMRS-ICA2023))
Boron monosulfides: a promising material used as the electrocatalyst for the oxygen evolution reaction
(Annual Meeting of the Japan Society of Vacuum and Surface Science 2023)
1995 - 2000 Osaka University Graduate School of Engineering Science
1991 - 1995 Osaka University School of Engineering Science
Work history (13)：
2021/04 - 現在 University of Tsukuba Center for Computational Sciences Professor
2015/11 - 2021/03 National Institute of Advanced Industrial Science and Technology Research Center for Computational Design of Advanced Functional Materials Team Leader
2015/04 - 2015/10 National Institute of Advanced Industrial Science and Technology
2013/11 - 2015/03 National Institute of Advanced Industrial Science and Technology
2013/10 - 2013/10 National Institute of Advanced Industrial Science and Technology
2012/10 - 2013/09 National Institute of Advanced Industrial Science and Technology
2010/04 - 2012/09 National Institute of Advanced Industrial Science and Technology
2008/04 - 2010/03 National Institute of Advanced Industrial Science and Technology
2007/04 - 2008/03 The University of Tokyo Institute of Solid State Physics Research assistant
2003/10 - 2007/03 The University of Tokyo Institute of Solid State Physics Research assistant
2001/04 - 2003/09 University of Tsukuba Institute of Physics Research assistant
2000/04 - 2001/03 The University of Tokyo The Institute for Solid State Physics JSPS Research Fellowship for Young Scientists
1999/01 - 2000/03 Osaka University Graduate School of Engineering Science JSPS Research Fellowship for Young Scientists
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Committee career (2)：
2020/04 - 現在 一般社団法人 電気化学界面シミュレーションコンソーシアム 代表理事
2018/01 - 2020/03 一般社団法人 電気化学界面シミュレーションコンソーシアム 理事
Awards (2)：
2009/02 - 日本物理学会 第14回日本物理学会論文賞
2007/02 - 東京大学物性研究所 第5回 東京大学 物性研究所 ISSP学術奨励賞
Association Membership(s) (2)：
The Electrochemical Society of Japan (ECSJ)
, THE PHYSICAL SOCIETY OF JAPAN
