研究领域

Physical Chemistry Theoretical Chemistry

Quantum Theory of Chemical Processes

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K. Ando, The Axial Methionine Ligand may Control the Redox Reorganizations in the Active Site of Blue Copper Proteins, J. Chem. Phys., 133, 175101-1-9 (2010). K. Hyeon-Deuk, K. Ando, Quantum Effects of Hydrogen Atoms on the Dynamical Rearrangement of Hydrogen-bond Networks in Liquid Water, J. Chem. Phys., 132, 164507-1-5 (2010). K. Ando, Semiquantal Valence-Bond Wave Packet Description of Chemical Bonding, Bull. Chem. Soc. Jpn. 82, 975-986 (2009). N. Sakumichi, K. Ando, Semiquantal Analysis of Adiabatic Hydrogen Transfer Rate, J. Chem. Phys. 128, 164516-1-9 (2008). K. Ando, Ligand-to-Metal Charge-Transfer Dynamics in a Blue Copper Protein Plastocyanin: A Molecular Dynamics Study, J. Phys. Chem. B, 112, 250-256 (2008). K. Ando and M. Santer, Mixed quantum-classical Liouville molecular dynamics without momentum jump, J. Chem. Phys., 118, 10399-10406 (2003). K. Ando and H. Sumi, Path integral Monte Carlo calculation of reaction-diffusion equation, J. Chem. Phys., 118, 8315-8320 (2003).