活動報告・予告 / Annual Reports/高柳研究室2014

研究室教員

発表論文

  1. "Construction of global ab initio potential energy surface for the HNS system and quantum dynamics calculations for the S(3P) + NH(X3Σ) -> NS(X2Π) + H(2S) and N(4S) + SH(X2Π) -> NS(X2Π) + H(2S) reactions," K. Sato, T. Takayanagi, Chem. Phys., 439, 63-70 (2014).
  2. "Quantum localization/delocalization of muonium in the glycine-K+ complex," T.Yoshikawa, T.Honda, T. Takayanagi, Chem. Phys., 440, 135-141 (2014).
  3. "Application of long-range corrected density-functional theory to excess electron attachment to biomolecules," Y.Yokoi, K.Kano, Y.Minoshima, T. Takayanagi, Comp. Theo. Chem., 1046, 99-106 (2014).
  4. "Mode Selective Dynamics and Kinetics of the H2 + F2 -> H + HF + F Reaction," A.Matsugi, T. Takayanagi, Phys. Chem. Chem. Phys., 16, 22517-22526 (2014).
  5. "Fundamental Change in the Nature of Chemical Bonding by Isotopic Substitution," D.G. Fleming, J. Manz, K. Sato, T. Takayanagi, Angew. Chem. Int. Ed., 53, 13706-13709 (2014).
  6. "Quantum reactive scattering study of the S(3P) + NH(X3Σ) -> NS(X2Π) + H(2S) / SH(X2Π) + N(4S) reaction on the lowest three (1A', 1A", and 3A") potential energy surfaces: contribution of HNS/HSN isomerization and spin-forbidden process," K. Sato, T. Takayanagi, Chem. Phys., 450-451, 74-82 (2015).
  7. "Semiclassical dynamics of electron attachment to guanine-cytosine base pair," T. Honda, Y. Minoshima, Y. Yokoi, M. Shiga, T. Takayanagi, Chem. Phys. Lett., 625, 174-178 (2015).

総説,雑誌(日本語)

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 1,000千円 (2014年度)