活動報告・予告/Annual Reports/高柳研究室2013 の履歴(No.18)


研究室教員

発表論文

  1. "Preference Behavior on Donating Atoms of an Ambidentate Ligand 2-Methylisothiazol-3(2H)-one in its Metal Complexes," M. Kato, K. Unoura, T. Takayanagi, Y. Ikeda, T. Fujihara, and A. Nagasawa, Inorg. Chem., 52, 13375–13383 (2013).
  2. "Theoretical Study of Excess Electron Attachment Dynamics to the Guanine-Cytosine Base Pair: Electronic Structure Calculations and Ring-Polymer Molecular Dynamics Simulations," Y. Sugioka, T. Yoshikawa, and T. Takayanagi, J. Phys. Chem. A, 117, 11403–11410 (2013).
  3. "Theoretical study of N(4S, 2D) + CH3(2A2") reaction mechanisms revisited: the importance of spin-forbidden and roaming dynamics processes," S.Chiba, F.Yoshida, and T.Takayanagi, Chem. Phys. Lett., 595-596, 103-108 (2014).
  4. "Non-adiabatic relaxation dynamics of water anion cluster and its isotope effects by ring-polymer molecular dynamics simulation," T. Yoshikawa, T. Takayanagi, Int. J. Quantum Chem., (just accepted)

学会発表

外部資金獲得状況

  1. 2012~14年度 基盤研究(C) 研究代表者:高柳敏幸 低エネルギー電子による生体損傷機構の分子論的理解の深化 1,200千円 (2013年度)