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Physical Chemistry Chemical Physics : PCCP
|
April 2, 2010
Driving force of metallo (Mg-H and Mg-Cl)-ene reaction mechanisms
Tomoyuki Yamada, Taro Udagawa, Shogo Sakai
Organic Letters
|
November 10, 2020
Determining if Reaction Selectivity Can Be Controlled by the H/D Isotope Effect in CH···O Interactions
Haruki Funahashi, Masanori Tachikawa, Taro Udagawa
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
August 22, 2015
Multicomponent Molecular Orbital-Climbing Image-Nudged Elastic Band Method to Analyze Chemical Reactions Including Nuclear Quantum Effect
Taro Udagawa, Kimichi Suzuki, Masanori Tachikawa
ACS Omega
|
May 13, 2022
Low-Barrier Hydrogen Bond in Fujikurin A-D: A Computational Study
Hikaru Tanaka, Kazuaki Kuwahata, Masanori Tachikawa, et al.
The Journal of Chemical Physics
|
August 22, 2025
Nuclear quantum and H/D isotope effects on hydrogen-bond symmetrization in lithium hydroxide crystals at high pressure
Hikaru Tanaka, Kazuaki Kuwahata, Masanori Tachikawa, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 12, 2024
Nuclear quantum and H/D isotope effects on aromaticity: path integral molecular dynamics study
Hikaru Tanaka, Kazuaki Kuwahata, Masanori Tachikawa, et al.
Journal of Computational Chemistry
|
December 20, 2024
Comprehensive Analysis of Deuterium Isotope Effects on Ionic H<sub>3</sub>O<sup>+…</sup>π Interactions Using Multi-Component Quantum Mechanics Methods
Taro Udagawa, Yusuke Kanematsu, Takayoshi Ishimoto, et al.
Chemistryopen
|
March 9, 2022
Stereoselective Transesterification of P-Chirogenic Hydroxybinaphthyl Phosphinates
Akari Kawajiri, Taro Udagawa, Mao Minoura, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 11, 2022
A path integral molecular dynamics study on the NH<sub>4</sub><sup>+</sup> rotation in NH<sub>4</sub><sup>+</sup>⋯XH<sub>2</sub> (X = Be or Mg) dihydrogen bond systems
Taro Udagawa, Amane Kinoshita, Kazuaki Kuwahata, et al.
The Journal of Physical Chemistry. A
|
February 28, 2024
Location of the Shared Proton in Proton-Bound Dimer Compound of Hydrogen Sulfate and Formate: Path Integral Molecular Dynamics Study
Taro Udagawa, Hikaru Tanaka, Kazuaki Kuwahata, et al.
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Search research articles
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Showing results (11-20 of 60) with videos related to
Sort By:
Page
of 6
Physical Chemistry Chemical Physics : PCCP
|
April 2, 2010
Driving force of metallo (Mg-H and Mg-Cl)-ene reaction mechanisms
Tomoyuki Yamada, Taro Udagawa, Shogo Sakai
Organic Letters
|
November 10, 2020
Determining if Reaction Selectivity Can Be Controlled by the H/D Isotope Effect in CH···O Interactions
Haruki Funahashi, Masanori Tachikawa, Taro Udagawa
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
August 22, 2015
Multicomponent Molecular Orbital-Climbing Image-Nudged Elastic Band Method to Analyze Chemical Reactions Including Nuclear Quantum Effect
Taro Udagawa, Kimichi Suzuki, Masanori Tachikawa
ACS Omega
|
May 13, 2022
Low-Barrier Hydrogen Bond in Fujikurin A-D: A Computational Study
Hikaru Tanaka, Kazuaki Kuwahata, Masanori Tachikawa, et al.
The Journal of Chemical Physics
|
August 22, 2025
Nuclear quantum and H/D isotope effects on hydrogen-bond symmetrization in lithium hydroxide crystals at high pressure
Hikaru Tanaka, Kazuaki Kuwahata, Masanori Tachikawa, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 12, 2024
Nuclear quantum and H/D isotope effects on aromaticity: path integral molecular dynamics study
Hikaru Tanaka, Kazuaki Kuwahata, Masanori Tachikawa, et al.
Journal of Computational Chemistry
|
December 20, 2024
Comprehensive Analysis of Deuterium Isotope Effects on Ionic H<sub>3</sub>O<sup>+…</sup>π Interactions Using Multi-Component Quantum Mechanics Methods
Taro Udagawa, Yusuke Kanematsu, Takayoshi Ishimoto, et al.
Chemistryopen
|
March 9, 2022
Stereoselective Transesterification of P-Chirogenic Hydroxybinaphthyl Phosphinates
Akari Kawajiri, Taro Udagawa, Mao Minoura, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 11, 2022
A path integral molecular dynamics study on the NH<sub>4</sub><sup>+</sup> rotation in NH<sub>4</sub><sup>+</sup>⋯XH<sub>2</sub> (X = Be or Mg) dihydrogen bond systems
Taro Udagawa, Amane Kinoshita, Kazuaki Kuwahata, et al.
The Journal of Physical Chemistry. A
|
February 28, 2024
Location of the Shared Proton in Proton-Bound Dimer Compound of Hydrogen Sulfate and Formate: Path Integral Molecular Dynamics Study
Taro Udagawa, Hikaru Tanaka, Kazuaki Kuwahata, et al.
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of 6