Effects of third-order susceptibility in sum frequency generation spectra: a molecular dynamics study in liquid water T Joutsuka, T Hirano, M Sprik, A Morita Physical Chemistry Chemical Physics 20 (5), 3040-3053, 2018 | 96 | 2018 |
Recent progress in simulating microscopic ion transport mechanisms at liquid–liquid interfaces A Morita, A Koizumi, T Hirano The Journal of Chemical Physics 154 (8), 2021 | 14 | 2021 |
Revealing transient shuttling mechanism of catalytic ion transport through liquid–liquid interface A Koizumi, H Tahara, T Hirano, A Morita The Journal of Physical Chemistry Letters 11 (4), 1584-1588, 2020 | 14 | 2020 |
Electron transfer mechanism at the oil/water interface revealed by multidimensional free energy calculations T Hirano, A Morita The Journal of Physical Chemistry B 124 (18), 3811-3827, 2020 | 9 | 2020 |
Boundary effects and quadrupole contribution in sum frequency generation spectroscopy T Hirano, A Morita The Journal of Chemical Physics 156 (15), 2022 | 5 | 2022 |
Comment on “Toward unraveling the puzzle of sum frequency generation spectra at interface of aqueous methanol solution: Effects of concentration-dependent hyperpolarizability” T Ishiyama, S Takagi, T Hirano, L Wang, A Morita The Journal of Physical Chemistry C 124 (45), 25160-25162, 2020 | 4 | 2020 |
Comment on “Sum-frequency vibrational spectroscopy of centrosymmetric molecule at interfaces”[J. Chem. Phys. 158, 074701 (2023)] T Hirano, K Kumagai, T Ishiyama, A Morita The Journal of Chemical Physics 160 (10), 2024 | 3 | 2024 |
Development of efficient computational analysis of difference infrared and Raman spectroscopies T Hirano, N Yazawa, L Wang, A Morita The Journal of Chemical Physics 157 (12), 2022 | 3 | 2022 |
Singularity-free constraint on molecular dynamics beyond Lagrange multiplier T Hirano, L Wang, A Morita Molecular Simulation 44 (12), 965-972, 2018 | 2 | 2018 |
Detecting Centrosymmetric Molecular Ions at an Interface with Vibrational Sum Frequency Generation Spectroscopy B Mandal, S Dadashi, K Kumagai, T Hirano, T Ishiyama, S Abou-Hatab, ... The Journal of Physical Chemistry C, 2024 | | 2024 |
和周波発生分光法における三次感受率の効果: 水の分子動力学シミュレーションによる研究 T Joutsuka, T Hirano, M Sprik, A Morita | | |
油水界面における塩基触媒反応の理論研究 A Koizumi, H Tahara, T Hirano, L Wang, A Morita | | |