Rchr
J-GLOBAL ID:200901028879321697
Update date: Apr. 19, 2024
Watanabe Yoshihiro
ワタナベ ヨシヒロ | Watanabe Yoshihiro
Affiliation and department:
Job title:
Assistant Professor
Homepage URL (1):
https://ccl.scc.kyushu-u.ac.jp/~yoshi/
Research field (2):
Basic physical chemistry
, Semiconductors, optical and atomic physics
Research keywords (2):
理論化学 計算化学 量子化学
, Theoretical chemistry Computational chemistry Quantum chemistry
Research theme for competitive and other funds (5):
- 2013 - 2016 Theoretical study on the charge transfer through DNA induced by structural and solvent fluctuation
- 2012 - 2014 A study of quasidegenerate electronic states by relativistic multi-reference theory
- 2011 - 2013 Development of multiconfigurational electronic structure theory and simulation method for quasidegenerate systems in solution
- 2003 - 2005 The development of accurate electronic structure theory for large systems and its application to interface systems
- Relativistic CI calculation using reduced frozen-core approximation
Papers (16):
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Nobuki Inoue, Yoshihiro Watanabe, Haruyuki Nakano. Generalized Foldy-Wouthuysen transformation for relativistic two-component methods: Systematic analysis of two-component Hamiltonians. Journal of Computational Chemistry. 2024
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Ippei Tsuzuki, Nobuki Inoue, Yoshihiro Watanabe, Haruyuki Nakano. Two-component transformation inclusive contraction scheme in the relativistic molecular orbital theory. Chemical Physics Letters. 2024. 840. 141146-141146
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Nobuki Inoue, Yoshihiro Watanabe, Haruyuki Nakano. Theoretical examination of QED Hamiltonian in relativistic molecular orbital theory. The Journal of chemical physics. 2023. 159. 5
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K Kanemaru, Y Watanabe, N Yoshida, H Nakano. Application of the reference interaction site model self-consistent field method based on the Dirac-Hartree-Fock wave function to a chemical reaction. IOP Conference Series: Materials Science and Engineering. 2023. 1280. 1. 012002-012002
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Kodai Kanemaru, Yoshihiro Watanabe, Norio Yoshida, Haruyuki Nakano. Solvent effects in four-component relativistic electronic structure theory based on the reference interaction-site model. Journal of Computational Chemistry. 2023. 44. 1. 5-14
more...
MISC (33):
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Daisuke Okamoto, Yoshihiro Watanabe, Norio Yoshida, Haruyuki Nakano. Implementation of state-averaged MCSCF method to RISM- and 3D-RISM-SCF schemes. Chemical Physics Letters. 2019. 730. 179-185
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Hiroko Moriyama, Yoshihiro Watanabe, Haruyuki Nakano, Shigeyoshi Yamamoto, Hiroshi Tatewaki. Electronic structure of LaO based on frozen-core four-component relativistic multiconfigurational quasidegenerate perturbation theory. JOURNAL OF CHEMICAL PHYSICS. 2010. 132. 12. 124310
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Yoshihiro Watanabe, Haruyuki Nakano, Hiroshi Tatewaki. Effect of removing the no-virtual pair approximation on the correlation energy of the He isoelectronic sequence. II. Point nuclear charge model. JOURNAL OF CHEMICAL PHYSICS. 2010. 132. 12. 124105
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Hiroko Moriyama, Hiroshi Tatewaki, Yoshihiro Watanabe, Haruyuki Nakano. Molecular Spinors Suitable for Four-Component Relativistic Correlation Calculations: Studies of LaF+ and LaF Using Multiconfigurational Quasi-Degenerate Perturbation Theory. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 2009. 109. 9. 1898-1904
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Yuko Wasada-Tsutsui, Yoshihiro Watanabe, Hiroshi Tatewaki. Electronic Structures of Lanthanide Monofluorides in the Ground State: Frozen-Core Dirac-Fock-Roothaan Calculations. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 2009. 109. 9. 1874-1885
more...
Books (1):
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Recent Advances in Computational Chemistry Vol. 5, "RECENT ADVANCES IN RELATIVISTIC MOLECULAR THEORY" pp. 247-255, PROPHET4R: Four-Component Relativistic Atomic and Molecular Program Suite
World Scientific 2004
Education (6):
- - 1998 Kyushu University
- - 1998 Kyushu University Graduate School, Division of Natural Science
- - 1996 The University of Electro-Communications
- - 1994 The University of Electro-Communications Faculty of Electro-Communications
- - 1994 The University of Electro-Communications Faculty of Electro Communications
- - 1992 National Institute of Technology, Kurume College
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Professional career (1):
- Doctor(Science) (Kyushu University)
Association Membership(s) (3):
分子科学会
, 日本化学会
, The Chemical Society of Japan
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