Ehara Masahiro

エハラマサヒロ | Ehara Masahiro

Affiliation and department：
Other affiliations (2)：

Homepage URL (2)： http://tc.ims.ac.jp/ , http://tc.ims.ac.jp/ehara-e.html

Research field (2)： Functional solid-state chemistry , Basic physical chemistry

Research keywords (5)：機能物性化学 , 触媒化学 , 理論化学 , 量子化学 , Theoretical Chemistry

Research theme for competitive and other funds (20)：

2022 - 2027 Revolution of chiral materials science using helical light fields
2022 - 2027 Quantum inverse design theory for the chiroptical properties based on helical light fields
2020 - 2025 Molecular Systems Chemistry for the Efficient Utilization of Photon Energy
2020 - 2023 先進的量子状態理論に基づく不均一系触媒および光機能システム系の研究開発
2012 - 2022 実験と理論計算科学のインタープレイによる触媒・電池の元素戦略研究拠点

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Papers (313)：

Shinya Masuda, Haru Hirai, Pei Zhao, Shinjiro Takano, Masahiro Ehara, Tatsuya Tsukuda. Substrate-Dependent Role of a Pd Dopant in PdAu₁₂ Catalysts in the Oxidation of p-Substituted Benzyl Alcohols: Promotion of Hydride Abstraction and Reductive Activation of O₂. ACS Catalysis. 2024. 17123-17131
Sora Shirai, Satoshi Muratsugu, Hisaki Matsui, Kazuhiro Harada, Masahiro Ehara, Hidetaka Nakai, Mizuki Tada. Circularly polarized luminescence induction on a Tb(iii) complex with a tris(o-tert-butylaryloxide)-functionalized 1,4,7-triazacyclononane ligand coordinating chiral 1-phenylethylamine. Chemical Communications. 2024. 60. 14180-14183
Hiroki Miura, Kaoru Imoto, Hidenori Nishio, Anchalee Junkaew, Yunosuke Tsunesada, Yohei Fukuta, Masahiro Ehara, Tetsuya Shishido. Optimization of Metal-Support Cooperation for Boosting the Performance of Supported Gold Catalysts for the Borylation of C-O and C-N Bonds. Journal of the American Chemical Society. 2024. 146. 27528-27541
Xiao-Li Pei, Pei Zhao, Hitoshi Ube, Zhen Lei, Masahiro Ehara, Mitsuhiko Shionoya. Single-gold etching at the hypercarbon atom of C-centred hexagold(I) clusters protected by chiral N-heterocyclic carbenes. Nature Communications. 2024. 15. 1
Zhen Lei, Pei Zhao, Zong-Jie Guan, Zi-Ang Nan, Masahiro Ehara, Quan-Ming Wang. ‘Passivated Precursor’ Approach to All-Alkynyl-Protected Gold Nanoclusters and Total Structure Determination of Au130. Chemistry - A European Journal. 2024. 30. e202401094

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MISC (22)：

Masahiro Ehara, Koichi Yamashita. Special Issue: Next Generation Li and Na Rechargeable Batteries. CHEMICAL RECORD. 2019. 19. 4. 689-689
Nozomi Takagi, Ryoichi Fukuda, Masahiro Ehara, Shigeyoshi Sakakia. Electronic Structure and Stability of Binary Metal Cluster with Core-Shell Structure: Theoretical Approach. JOURNAL OF COMPUTER CHEMISTRY-JAPAN. 2019. 18. 1. 38-48
芳田嘉志, 小泉健一, 葛原優介, 松本晃典, 三角仁志, BOERO M., 江原正博, 大山順也, 町田正人. Rh薄膜触媒上のCO-NO反応における高いTOFの発現機構. 触媒討論会討論会A予稿集(CD-ROM). 2019. 124th
木下真之介, 宮崎康典, 井口佳哉, 江幡孝之, 住田聖太, 鬼塚侑樹, 高口博志, 赤井伸行, 白男川貴史, 江原正博, et al. para-,meta-,ortho-hydroxy methylcinnamateの無輻射緩和経路とtrans→cis異性化の研究. 分子科学討論会講演プログラム&要旨(Web). 2017. 11th
山崎馨, 木下真之介, 宮崎康典, 住田聖太, 鬼塚侑樹, 高口博志, 井口佳哉, 赤井伸行, 白男川貴史, 江原正博, et al. Hydroxy methylcinnamateにおける無輻射失活経路の置換位置依存性. 分子科学討論会講演プログラム&要旨(Web). 2017. 11th

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Books (27)：

Deep Reinforcement Learning in Chemistry: A Review
J. Comput. Chem. 45, 1881-1885 2024
解説:化学修飾でカーボンナノチューブの近赤外発光特性を制御 -バイオイメージングや光量子デバイスの光源としての活用を目指して
化学, 79(2), 37-40 2024
解説:スルフォネート保護銀ナノクラスターの合成と発光特性評価
ナノ学会誌, 22, 13-19 2023
Recent Progress in Controlling the Photoluminescence Properties of Single-Walled Carbon Nanotubes by Oxidation and Alkylation
Chem. Commun. 59, 14497-14508 (Back Cover) 2023
分光学的性質(17.4.2)
化学便覧基礎編改訂6版, 第17章, 理論化学, 計算科学, 情報科学, 2021

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Lectures and oral presentations (118)：

量子化学に基づく理論精密分光
(第三回冷却分子・精密分光シンポジウム, 東京(ハイブリッド) 2024)
複雑電子系の光物性科学と触媒化学
(第43回QCRIセミナー, 京都, 2024)
Inverse Design Approach of Molecular Aggregates and Molecule-Nanocluster Systems
(Indian Institute of Technology, Hyderabad, Hyderabad, India, 2024)
Nanocluster and Heterogeneous Catalysis: Interplay between Theory and Experiment
(IIIT Hyderabad, Hyderabad, India, 2024)
Nanocluster and Heterogeneous Catalysis: Interplay between Theory and Experiment
(Sustainable Catalysis: Synthesis, Theory, and Applications (SusCat-STA 2024), Udaipur, India 2024)

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Education (3)：

Professional career (1)：

Work history (18)：

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Committee career (24)：

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Awards (2)：

2009 - QSCP (Quantum Systems in Chemistry and Physics) Prize CMOA (Centre de Mecanique Ondulatoire Appliquee)
2009 - APATCC (Asia-Pacific Association of Theoretical & Computational Chemists) Pople Medal

Association Membership(s) (5)：

アメリカ化学会 , CATALYSIS SOCIETY OF JAPAN , APATCC (Asia-Pacific Association of Theoretical & Computational Chemist) , 分子科学会 , 日本化学会

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