2010

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Original Papers
1. M. Nakano, T. Minami, H. Fukui, K. Yoneda, Y. Shigeta, R. Kishi, B. Champagne, E. Botek, “Approximate Spin-Projected Spin-Unrestricted Density Functional Theory Method: Application to the Diradical Character Dependences of the (Hyper) Polarizabilities in p-Quinodimethane Models”, Chemical Physics Letters, 501, 140-145 (2010).
2. Y. Nakanishi, T. Matsui, Y. Shigeta, Y. Kitagawa, T. Saito, Y. Kataoka, T. Kawakami, M. Okumura, K. Yamaguchi, “Sequence-Dependent Proton-Transfer Reaction in Stacked GC Pair III: The Influence of Proton Transfer to Conductivity”, International Journal of Quantum Chemistry, 110, 2221-2230 (2010).
3. K. Kamiya, M. Boero, K. Shiraishi, A. Oshiyama, Y. Shigeta, “Energy Compensation Mechanism for Charge-Separated Protonation States in Aspartate-Histidine Amino Acid Residue Pairs“, Journal of Physical Chemistry B, 114, 6567-6578 (2010).
4. M. Muraguchi, T. Endoh, Y. Takada, Y. Sakurai, S. Nomura, K. Shiraishi, M. Ikeda, K. Makihara, S. Miyazaki, Y. Shigeta, “Importance of Electronic State of Two-dimensional Electron Gas for Electron Injection Process in Nano-electronic Devices”, Physica E, 42, 2602-2605 (2010).
5. Y. Sakurai, S. Nomura, Y. Takada, J. Iwata, K. Shiraishi, M. Muraguchi, T. Endoh, Y. Shigeta, M. Ikeda, K. Makihara, S. Miyazaki, “Anomalous Temperature Dependence of Electron Tunneling Between a Two-Dimensional Electron Gas and Si Dots”, Physica E, 42, 918-921 (2010).
6. Y. Sakurai, J. Iwata, M. Muraguchi, Y. Shigeta, Y. Takada, S. Nomura, T. Endoh, S. Saito, K. Shiraishi, M. Ikeda, K. Makihara, S. Miyazaki, “Temperature Dependence of Electron Tunneling Between Two-Dimensional Electron Gas and Si Quantum Dots”, Japanese Journal of Applied Physics, 49, 014001 (4 pages), (2010).
7. H. Miyachi, T. Matsui, Y. Shigeta, K. Hirao, “Effects of Mercury (II) on Structural Properties, Electronic Structure and UV Absorption Spectra of Thymine-Mercury (II)-Thymine Nucleobase Pair Containing Duplex”, Physical Chemistry Chemical Physics, 12, 909-917, (2010).

Invited Talk
1. International conferences
1. “Theoretical Study on Artificial and Mismatch DNA Bases”, Symposium #5 Pacifichem 2010, Dec. 14th-20th 2010, Hawaii, USA.

2. Domestic conferences
1. “Analyses of Bio-Molecular Reactions Based on First-Principles Calculations“、Frontier in reaction path theory、Sep. 12th 2010、福井謙一記念研究センター・京都大学.

3. Lecture at other institutes

Book & Review

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