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Journal of Chemical Theory and Computation
|
November 28, 2015
A Density Functional Theory Study of Ground and Low-Lying Excited Electronic States in Defective Graphenes
Hiroto Tachikawa, Yoshinori Nagoya, Hiroshi Kawabata
Physical Chemistry Chemical Physics : PCCP
|
July 25, 2007
The structures and electronic states of zinc-water clusters Zn(n)(H2O)(m) (n = 1-32 and m = 1-3)
Hiroto Tachikawa, Kei Iokibe, Kazuhisa Azumi, et al.
ACS Omega
|
March 29, 2021
Molecular Design of a Reversible Hydrogen Storage Device Composed of the Graphene Nanoflake-Magnesium-H<sub>2</sub> System
Hiroto Tachikawa, Yoshiki Izumi, Tetsuji Iyama, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 27, 2010
Electronic state dependence of the ion-molecule reaction CH(3)CN(+) + CH(3)CN → CH(4)CN(+) + CH(2)CN: threshold electron-secondary ion coincidence (TESICO) and direct ab initio molecular dynamics study
Hiroto Tachikawa, Takahiro Fukuzumi, Kazushige Inaoka, et al.
Journal of Photochemistry and Photobiology. B, Biology
|
March 29, 2005
Ab initio model study on acetylcholinesterase catalysis: potential energy surfaces of the proton transfer reactions
Hiroto Tachikawa, Manabu Igarashi, Jun Nishihira, et al.
Science and Technology of Advanced Materials
|
November 24, 2016
Electronic structures of one-dimensional poly-fused selenophene radical cations: density functional theory study
Hiroshi Kawabata, Shigekazu Ohmori, Kazumi Matsushige, et al.
Nanomaterials (Basel, Switzerland)
|
September 13, 2024
Mechanism of Carrier Formation in P3HT-C<sub>60</sub>-PCBM Solar Cells
Hiroto Tachikawa, Hiroshi Kawabata, Shigeaki Abe, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 2, 2021
Theoretical study of the dissociative photodetachment dynamics of the hydrated superoxide anion cluster
Yu Hashimoto, Kohei Saito, Toshiyuki Takayanagi, et al.
The Journal of Chemical Physics
|
July 23, 2004
Hydrogen atom formation from the photodissociation of water ice at 193 nm
Akihiro Yabushita, Yuichi Hashikawa, Atsushi Ikeda, et al.
The Journal of Physical Chemistry Letters
|
August 18, 2015
Quantum Tunneling Hydrogenation of Solid Benzene and Its Control via Surface Structure
Tetsuya Hama, Hirokazu Ueta, Akira Kouchi, et al.
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Search research articles
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Showing results (51-60 of 66) with videos related to
Sort By:
Page
of 7
Journal of Chemical Theory and Computation
|
November 28, 2015
A Density Functional Theory Study of Ground and Low-Lying Excited Electronic States in Defective Graphenes
Hiroto Tachikawa, Yoshinori Nagoya, Hiroshi Kawabata
Physical Chemistry Chemical Physics : PCCP
|
July 25, 2007
The structures and electronic states of zinc-water clusters Zn(n)(H2O)(m) (n = 1-32 and m = 1-3)
Hiroto Tachikawa, Kei Iokibe, Kazuhisa Azumi, et al.
ACS Omega
|
March 29, 2021
Molecular Design of a Reversible Hydrogen Storage Device Composed of the Graphene Nanoflake-Magnesium-H<sub>2</sub> System
Hiroto Tachikawa, Yoshiki Izumi, Tetsuji Iyama, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 27, 2010
Electronic state dependence of the ion-molecule reaction CH(3)CN(+) + CH(3)CN → CH(4)CN(+) + CH(2)CN: threshold electron-secondary ion coincidence (TESICO) and direct ab initio molecular dynamics study
Hiroto Tachikawa, Takahiro Fukuzumi, Kazushige Inaoka, et al.
Journal of Photochemistry and Photobiology. B, Biology
|
March 29, 2005
Ab initio model study on acetylcholinesterase catalysis: potential energy surfaces of the proton transfer reactions
Hiroto Tachikawa, Manabu Igarashi, Jun Nishihira, et al.
Science and Technology of Advanced Materials
|
November 24, 2016
Electronic structures of one-dimensional poly-fused selenophene radical cations: density functional theory study
Hiroshi Kawabata, Shigekazu Ohmori, Kazumi Matsushige, et al.
Nanomaterials (Basel, Switzerland)
|
September 13, 2024
Mechanism of Carrier Formation in P3HT-C<sub>60</sub>-PCBM Solar Cells
Hiroto Tachikawa, Hiroshi Kawabata, Shigeaki Abe, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 2, 2021
Theoretical study of the dissociative photodetachment dynamics of the hydrated superoxide anion cluster
Yu Hashimoto, Kohei Saito, Toshiyuki Takayanagi, et al.
The Journal of Chemical Physics
|
July 23, 2004
Hydrogen atom formation from the photodissociation of water ice at 193 nm
Akihiro Yabushita, Yuichi Hashikawa, Atsushi Ikeda, et al.
The Journal of Physical Chemistry Letters
|
August 18, 2015
Quantum Tunneling Hydrogenation of Solid Benzene and Its Control via Surface Structure
Tetsuya Hama, Hirokazu Ueta, Akira Kouchi, et al.
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