Rchr
J-GLOBAL ID:200901005800017432   Update date: Jan. 13, 2023

Kobayashi Masato

コバヤシ マサト | Kobayashi Masato
Affiliation and department:
Job title: Associate Professor
Other affiliations (2):
  • Hokkaido University  WPI-ICReDD 
  • Hokkaido University  Research Center of Mathematics for Social Creativity (MSC), Research Institute for Electronic Science (RIES)   Concurrent Associate Professor
Homepage URL  (1): http://sites.google.com/site/chemistmasatokobayashi/
Research field  (1): Basic physical chemistry
Research keywords  (6): electronic structure theory ,  materials informatics ,  catalyst informatics ,  chemoinformatics ,  Theoretical Chemistry ,  Quantum Chemistry
Research theme for competitive and other funds  (11):
  • 2021 - 2024 Acceleration of the Development of Organic Reactions Based on the Fusion of Automatic Synthesis Robots and Information Science
  • 2021 - 2023 大規模量子化学計算と結晶構造DBを用いた超秩序構造のシナジー効果・動的特性の解明
  • 2020 - 2023 High-order many body correlation analysis of network forming glass based on comprehensive integration of experimental, theoretical and data sciences
  • 2020 - 2022 パーシステント・ホモロジーを用いたグローバル反応経路地図に対する記述子の開拓
  • 2017 - 2021 大規模複雑電子構造系の遷移状態・電子励起状態計算法の確立と生体反応への応用
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Papers (90):
  • Hiromi Nakai, Masato Kobayashi, Takeshi Yoshikawa, Junji Seino, Yasuhiro Ikabata, Yoshifumi Nishimura. Divide-and-Conquer Linear-Scaling Quantum Chemical Computations. The Journal of Physical Chemistry A. 2023
  • Burai Murayama, Masato Kobayashi, Masamitsu Aoki, Suguru Ishibashi, Takuya Saito, Takenobu Nakamura, Hiroshi Teramoto, Tetsuya Taketsugu. Characterizing Reaction Route Map of Realistic Molecular Reactions based on Weight Rank Clique Filtration of Persistent Homology. 2022
  • Hideo Takakura, Shino Matsuhiro, Osamu Inanami, Masato Kobayashi, Kenichiro Saita, Masaki Yamashita, Kohei Nakajima, Motofumi Suzuki, Naoki Miyamoto, Tetsuya Taketsugu, et al. Ligand release from silicon phthalocyanine dyes triggered by X-ray irradiation. Organic & biomolecular chemistry. 2022
  • Yuichi Kitagawa, Ryoma Moriake, Tomoko Akama, Koki Saito, Kota Aikawa, Sunao Shoji, Koji Fushimi, Masato Kobayashi, Tetsuya Taketsugu, Yasuchika Hasegawa. Effective Photosensitization in Excited-State Equilibrium: Brilliant Luminescence of Tb III Coordination Polymers Through Ancillary Ligand Modifications. ChemPlusChem. 2022
  • Hideo Takakura, Shino Matsuhiro, Masato Kobayashi, Yuto Goto, Mei Harada, Tetsuya Taketsugu, Mikako Ogawa. Axial-ligand-cleavable silicon phthalocyanines triggered by near-infrared light toward design of photosensitizers for photoimmunotherapy. Journal of Photochemistry and Photobiology A: Chemistry. 2022. 426. 113749-113749
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MISC (49):
Books (4):
  • The Art of High Performance Computing for Computational Science, Vol. 2
    Springer 2019
  • Keisan Kagaku no tameno HPC Gijutsu 2
    Osaka University Press 2017 ISBN:9784872595871
  • すぐできる量子化学計算ビギナーズマニュアル
    講談社 2015 ISBN:9784061543881
  • Linear-scaling techniques in computational chemistry and physics : methods and applications
    Springer 2011 ISBN:9789048128525
Lectures and oral presentations  (82):
  • Analyses for Catalytic and Surface Adsorption Systems by Quantum Chemical Calculations × Informatics
    (Lecture in AI Advanced Research Center at Gifu Univ. 2021)
  • Analyses and Prediction for Catalytic and Surface Adsorption Systems by Combining Quantum Chemical Calculations and Data Science
    (RCCS & Nanotechnology Platform Workshop 2021 2021)
  • Data Scientific Analysis of Quantum Chemical Calculation Results for Surface Adsorption Systems and Its Application to Catalysis
    (36th Computational Materials Design Workshop 2020)
  • Construction of quantum chemical calculation database of surface adsorption systems and its application to catalytic activity analysis
    (ESICB Electron Theory Meeting 2019)
  • Data-Scientific Analysis of Quantum Chemical Calculation Results for Surface Adsorption Systems and Its Application to Catalysts
    (Rare Events Workshop 2019 2019)
more...
Education (2):
  • 2004 - 2007 Waseda University Graduate School of Science and Engineering Department of Chemistry
  • 1999 - 2003 Waseda University School of Science and Engineering Department of Chemistry
Professional career (1):
  • PhD (Science) (Waseda University)
Work history (13):
  • 2021/10 - 現在 Hokkaido University Research Center of Mathematics for Social Creativity, Research Institute for Electronic Science Concurrent Faculty
  • 2020/11 - 現在 Hokkaido University Faculty of Science Department of Chemistry Associate Professor
  • 2019/04 - 現在 Hokkaido University WPI-ICReDD Concurrent Associate Professor
  • 2014/04 - 2022/03 Kyoto University Elements Strategy Initiative for Catalysts and Batteries Project Associate Professor
  • 2017/07 - 2020/10 Hokkaido University Faculty of Science Lecturer
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Committee career (9):
  • 2016/04 - 現在 National Institute of Science and Technology Policy (NISTEP) Investigator, Science and Technology Experts Network
  • 2021/10 - 2025/09 Japan Society of Theoretical Chemistry Secretary
  • - 2021/09 The 15th Annual Meeting of Japan Society for Molecular Science Organizing Committee
  • - 2020/09 Secretariat Office
  • - 2019/05 22nd Symposium on Theoretical Chemistry Organizing Committee
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Awards (3):
  • 2012 - 2nd CMSI Workshop Excellent Poster Award
  • 2009 - Society of Computer Chemistry, Japan Yoshida Award (Excellent Paper Award)
  • 2008 - WATOC2008 Poster Prize
Association Membership(s) (5):
Japan Society of Theoretical Chemistry ,  CATALYSIS SOCIETY OF JAPAN ,  THE CHEMICAL SOCIETY OF JAPAN ,  JAPAN SOCIETY FOR MOLECULAR SCIENCE ,  SOCIETY OF COMPUTER CHEMISTRY, JAPAN
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