Personnel Information

写真a

Asada Toshio


Job Title

Professor

Organization

Chemistry

Homepage URL

http://fock.c.s.osakafu-u.ac.jp/~asada

Faculty in charge, etc. 【 display / non-display

  • College of Life, Environment, and Advanced Sciences

  • Graduate School of Science

Research field 【 display / non-display

  • Biochmistry

  • Functional Material Chemistry

  • Physical Chemistry

Degree 【 display / non-display

  • Doctor (Chemistry)

 

Papers 【 display / non-display

  • Spin-Orbit Coupling Constants in Atoms and Ions of Transition Elements:Comparison of Effective Core Potentials, Model Core Potentials, and All-Electron Methods, J.Phys.Chem.A, 2019, S.Koseki, N.Matsunaga, T.Asada, M.Schmidt, M.Gordon

  • An improved reaction path optimization method using a chain of conformations, Chem.Phys.Lett., 2018.12, T.Asada, N.Sawada, T.Nishikawa, and S.Koseki

  • Simulation study of hole mobility in the amorphous phase of organic molecules, Org.Elec., 2018.12, T. Asada and S.Koseki

  • Computational approach for molecular design using free energy contribution analysis, AIP Proc., 2018, T.Asada, B.Pradipta and S.Koseki

  • Understanding the structure and hydrogen bonding network of (H2O)32 and (H2O)33: an improved Monte Carlo Temperature Basin Paving (MCTBP) method and Quantum Theory of Atoms in Molecules (QTAIM) analysis, RCS Advances, 2017.12, Rakshit Avijit, Takamasa Yamaguchi, Toshio Asada, Pradipta Bandyopadhyay

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Charge of class subject 【 display / non-display

  • Introduction to Programming

  • Physical Chemistry II

  • Exercises in Physical Chemistry II

  • Quantum Chemistry