2025年度活動報告・高柳研究室

発表論文

  1. “Applications of the density functional method combined with the electron-positron correlation-polarization potential to positron binding to hydrocarbons and water clusters”, D. Yoshida, T. Takayanagi, Y. Kita, T. Shimazaki, and M. Tachikawa, Phys. Chem. Chem. Phys.27, 12171-12181 (2025) [Selected as 2025 PCCP HOT Articles].
  2. “Effect of constitutional isomers on positron binding to fluorinated benzenes: applications of the positron-electron correlation-polarization potential approach”, D. Yoshida, T. Takayanagi, M. Tachikawa, J. Phys.: Conf. Ser., 3029, 012003 (2025).

  3. “Applications of Electron-Positron Correlation-Polarization Potential Method to Positron Binding in Glycine Conformers”, D. Yoshida, M. Takagi, T. Takayanagi, M. Tachikawa, Solid State Phenomena, 374, 55-62 (2025).
  4. “Effects of Halogenations and Conformational Isomers on Positron Binding in Halogenated Hydrocarbons”, M. Ashiba, D. Yoshida, Y. Kita, T. Shimazaki, T. Takayanagi, M. Tachikawa, J. Comp. Chem., 46(23), e70217 (2025)

総説,雑誌(日本語)

学会発表

  • 40th Symposium on Chemical Kinetics and Dynamics (Japan, 2024/06/04-06).
    • “Collison branching dynamics in the interstellar H3+ + HNCO system on the maxhine-leaening full-dimensional potential energy surface”,  (Saitama University1; Tokyo Metropolitan University2), Shoto Nakagawa1, Haruki Ota1, Tatsuhito Murakami1, 2, Toshiyuki Takayanagi1 [Poster presentation]
    • “Structural Changes in Alchol Molecules and Water Clusters Induced by Positron Attachment: A Theoretical Study Using the CPP Method”, (Saitama Univsity1; Tohoku Univsity2), Yamaki Keita1, Yamada Hayato1, Takayanagi Toshiyuki1, Yoshida Daisuke2 [Poster presentation]
    • “Reaction dynamics of the interstellar CH3OH + H3+ → CH3OH2+ + H2 / CH2OH+ + 2H2 reaction using the Δ-Machine Learning potential Energy Surface”,  (Saitama University1; Tokyo Metropolitan University2), SASAKI Yuki1, NAKAGAWA Shoto1, ARAI Shinnosuke1, MURAKAMI Tatsuhiro2, TAKAYANAGI Toshiyuki1 [Poster presentation]
    • “Theoretical study of solvent effects on post-transition state bifurcation reaction with explicit water”, (Saitama University1; Tokyo Metropolitan University2), MATSUBUCHI Hayato1, NAKAGAWA Shoto1, HAYASHI Daiki1, NOGUCHI Aoi1, OKAMOTO Daichi1, KIKUMA Yuya1, MURAKAMI Tatsuhiro2, TAKAYANAGI Toshiyuki1 [Poster presentation]

科学研究費補助金

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