活動報告・予告 / Annual Reports/高柳研究室2012

研究室教員

発表論文

  1. "Real Wave Packet and Flux Analysis Studies of the H + F2 -> HF + F Reaction," F. Gogtas, E. Karabulut, T. Tanaka, T. Takayanagi, R. Tutuk, Int. J. Quantum. Chem., 112, 2348-2354 (2012).
  2. "Rare gas bond property of Rg-Be2O2 and Rg-Be2O2-Rg (Rg = He, Ne, Ar, Kr and Xe) as a comparison with Rg-BeO," T. Kobayashi, Y. Kohno, T. Takayanagi, K. Seki, K. Ueda, Comp. Theo. Chem., 991, 48-55 (2012).
  3. "Ab initio prediction of vibrational states of the HeCuF helium-containing complex," T. Tanaka, T. Takayanagi, T. Taketsugu, Y. Ono, Chem. Phys. Lett., 539-540, 15-18 (2012).
  4. "A practical approach to temperature effects in dissociative electron attachment cross sections using local complex potential theory," Y.Sugioka, T.Takayanagi, Chem. Phys., 405, 189-196 (2012).
  5. "Quantum−Thermal Crossover of Hydrogen and Tritium Diffusion in α-Iron," T. Yoshikawa, T. Takayanagi, H. Kimizuka, M. Shiga, J. Phys. Chem. C, 116, 23113-23119 (2012).
  6. "Application of ring-polymer molecular dynamics to electronically nonadiabatic excess electron dynamics in water clusters: importance of nuclear quantum effects," T. Yoshikawa, T. Takayanagi, Chem. Phys. Lett., 564, 1-5(2013) (selected as an editor's choice article).

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 2,100千円 (2012年度)