Water formation through a quantum tunneling surface reaction, OH+ H2, at 10 K Y Oba, N Watanabe, T Hama, K Kuwahata, H Hidaka, A Kouchi
The Astrophysical Journal 749 (1), 67, 2012
122 2012 The mechanism of surface diffusion of H and D atoms on amorphous solid water: Existence of various potential sites T Hama, K Kuwahata, N Watanabe, A Kouchi, Y Kimura, T Chigai, ...
The Astrophysical Journal 757 (2), 185, 2012
88 2012 Signatures of quantum-tunneling diffusion of hydrogen atoms on water ice at 10 K K Kuwahata, T Hama, A Kouchi, N Watanabe
Physical review letters 115 (13), 133201, 2015
56 2015 MXene Phase with C3 Structure Unit: A Family of 2D Electrides S Bae, W Espinosa‐García, YG Kang, N Egawa, J Lee, K Kuwahata, ...
Advanced Functional Materials 31 (24), 2100009, 2021
16 2021 Nuclear Quantum Effect on the Geometry of NH4 + (H2 O) K Kuwahata, M Tachikawa
Bulletin of the Chemical Society of Japan 93 (12), 1558-1563, 2020
4 2020 Muon spin rotation (μSR) for characterizing radical addition to C= S in xanthene-9-thione and thioxanthene-9-thione S Ito, H Akama, KM Kojima, I McKenzie, K Kuwahata, M Tachikawa
Bulletin of the Chemical Society of Japan 96 (5), 461-464, 2023
3 2023 Competitive nuclear quantum effect and H/D isotope effect on torsional motion of H2O2: An ab initio path integral molecular dynamics study T Udagawa, K Kuwahata, M Tachikawa
Computational and Theoretical Chemistry 1208, 113542, 2022
3 2022 Carbon Monoxide Hydrogenation on Ice Surfaces K Kuwahata, K Ohno
ChemPhysChem 19 (11), 1382-1389, 2018
3 2018 Low-Barrier Hydrogen Bond in Fujikurin A–D: A Computational Study H Tanaka, K Kuwahata, M Tachikawa, T Udagawa
ACS omega 7 (16), 14244-14251, 2022
2 2022 Direct Elucidation of the Vibrationally Averaged Structure of Benzene: A Path Integral Molecular Dynamics Study T Udagawa, H Tanaka, T Hirano, K Kuwahata, M Tachikawa, M Baba, ...
The Journal of Physical Chemistry A 127 (4), 894-901, 2023
1 2023 Nuclear quantum and H/D isotope effects on intramolecular hydrogen bond in curcumin T Udagawa, H Yabushita, H Tanaka, K Kuwahata, M Tachikawa
Physical Chemistry Chemical Physics 25 (23), 15798-15806, 2023
1 2023 Path Integral Molecular Dynamics Study on K Kuwahata, M Tachikawa
Few-Body Systems 62, 1-5, 2021
1 2021 Location of the Shared Proton in Proton-Bound Dimer Compound of Hydrogen Sulfate and Formate: Path Integral Molecular Dynamics Study T Udagawa, H Tanaka, K Kuwahata, M Tachikawa
The Journal of Physical Chemistry A, 2024
2024 A path integral molecular dynamics study on the muoniated xanthene-thione molecule K Kuwahata, S Ito, M Tachikawa
The Journal of Chemical Physics 159 (10), 2023
2023 Atomic mass dependence of the nuclear quantum effect in NH4+ (H2O) K Kuwahata, M Tachikawa
Chemical Physics 553, 111381, 2022
2022 A path integral molecular dynamics study on the NH 4+ rotation in NH 4+⋯ XH 2 (X= Be or Mg) dihydrogen bond systems T Udagawa, A Kinoshita, K Kuwahata, M Tachikawa
Physical Chemistry Chemical Physics 24 (28), 17295-17302, 2022
2022 2D Electrides: MXene Phase with C3 Structure Unit: A Family of 2D Electrides (Adv. Funct. Mater. 24/2021) S Bae, W Espinosa‐García, YG Kang, N Egawa, J Lee, K Kuwahata, ...
Advanced Functional Materials 31 (24), 2170174, 2021
2021 Role of quantum tunneling for the formation of H2O by reaction of H-2 with OH on interstellar grains Y Oba, N Watanabe, T Hama, K Kuwahata, H Hidaka, A Kouchi
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 247, 2014
2014 Diffusion of hydrogen atom on amorphous solid water: Thermal or tunneling? N Watanabe, K Kuwahata, T Hama, A Kouchi
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 247, 2014
2014 Surface Chemical Reactions to the Formation of Solid H2O and its Isotopologues on Interstellar Grains at 10 K Y Oba, N Watanabe, T Hama, K Kuwahata, H Hidaka, A Kouchi
Asteroids, Comets, Meteors 2012 1667, 6032, 2012
2012