| Type | Author(s) | Title | Other Titles | Citation | Citation(alt) | Issue Date |
| article | Yamasaki, Shuhei; Tachikawa, Hiroto | Intracluster Reaction Dynamics of Ionized Micro-Hydrated Hydrogen Peroxide (H2O2): A Direct Ab Initio Molecular Dynamics Study | - | ACS Omega | - | 27-Sep-2022 |
| article | Tachikawa, Hiroto; Lund, Anders | Structures and electronic states of trimer radical cations of coronene: DFT-ESR simulation study | - | Physical chemistry chemical physics | - | 7-May-2022 |
| article (author version) | Takada, Tomoya; Tachikawa, Hiroto | Direct ab initio molecular dynamics study on the reactions of multi-valence ionized states of water dimer | - | Journal of physics B-atomic molecular and optical physics | - | 14-Jul-2021 |
| article | Tachikawa, Hiroto | Reactions of Photoionization-Induced CO-H2O Cluster: Direct Ab Initio Molecular Dynamics Study | - | ACS Omega | - | 29-Jun-2021 |
| article | Tachikawa, Hiroto; Izumi, Yoshiki; Iyama, Tetsuji; Azumi, Kazuhisa | Molecular Design of a Reversible Hydrogen Storage Device Composed of the Graphene Nanoflake-Magnesium-H(2)System | - | ACS Omega | - | 23-Mar-2021 |
| bulletin (article) | 福澄, 孝博; 田地川, 浩人 | 星間分子PAHと分子，およびラジカルの 相互作用：量子化学的解明 | Interaction of interstellar Polycyclic aromatic hydrocarbons (PAH) with radicals and molecules: quantum chemical calculations | 低温科学 | - | 24-Mar-2020 |
| bulletin (article) | 田地川, 浩人 | 宇宙の化学反応を実時間で追う：ダイレクト・ アブイニシオ分子動力学法によるアプローチ | Reaction dynamics of molecular clusters in space: application of direct Ab initio molecular dynamics method | 低温科学 | - | 24-Mar-2020 |
| article (author version) | Tachikawa, Hiroto; Takada, Tomoya | Ionization dynamics of the branched water cluster: A long-lived non-proton-transferred intermediate | - | Computational and theoretical chemistry | - | 2-Aug-2016 |
| article (author version) | Tachikawa, Hiroto | Effects of single water molecule on proton transfer reaction in uracil dimer cation | - | Theoretical chemistry accounts | - | 20-Feb-2016 |
| article (author version) | Tachikawa, Hiroto; Kawabata, Hiroshi | Direct Ab-Initio Molecular Dynamics Study on the Radiation Effects on Catalytic Triad Composed of Ser-His-Glu Residues | - | International journal of quantum chemistry | - | 16-Jan-2016 |
| article (author version) | Tachikawa, Hiroto; Kawabata, Hiroshi | Addition reaction of alkyl radical to C-60 fullerene: Density functional theory study | - | Japanese Journal of Applied Physics (JJAP) | - | 21-Dec-2015 |
| article | Tachikawa, Hiroto | Alkali metal mediated C-C bond coupling reaction | - | Journal of Chemical Physics | - | 14-Feb-2015 |
| article (author version) | Yoshida, Hiroshi; Tomizawa, Akitoshi; Tachikawa, Hiroto; Fujita, Shin-ichiro; Arai, Masahiko | Molecular interactions with CO2 for controlling the regioselectivity of liquid phase hydrogenation of 2,4-dinitroaniline | - | Physical Chemistry Chemical Physics | - | 22-Jul-2014 |
| article (author version) | Tachikawa, Hiroto; Kawabata, Hiroshi | Direct ab initio MD study on the hydrogen abstraction reaction of triplet state acetone from methanol molecule | - | Theoretical Chemistry Accounts : Theory, Computation, and Modeling (Theoretica Chimica Acta) | - | Jan-2011 |
| article | Tachikawa, Hiroto; Abe, Shigeaki | Reaction dynamics following electron capture of chlorofluorocarbon adsorbed on water cluster : a direct density functional theory molecular dynamics study | - | The Journal of Chemical Physics | - | 21-May-2007 |
| article | Tachikawa, Hiroto | Electron hydration dynamics in water clusters: A direct ab initio molecular dynamics approach | - | The Journal of Chemical Physics | - | 14-Oct-2006 |
| article | Tachikawa, Hiroto | Direct ab initio molecular dynamics study on a microsolvated SN2 reaction of OH-(H2O) with CH3Cl | - | The Journal of Chemical Physics | - | 7-Oct-2006 |
| article | Enami, Shinichi; Yamanaka, Takashi; Hashimoto, Satoshi; Kawasaki, Masahiro; Aloisio, Simone; Tachikawa, Hiroto | Direct observation and reactions of Cl3 radical | - | The Journal of Chemical Physics | - | 7-Oct-2006 |
| bulletin (article) | 田地川, 浩人; 高田, 知哉 | 水クラスターのイオン化ダイナミックス : ダイレクト・アブイニシオ・ダイナミックス法によるアプローチ | Ionization dynamics of water clusters: a direct ab initio molecular dynamic (MD) approach | 低温科学 | Low temperature science | 22-Mar-2006 |
| article | Tachikawa, Hiroto | SN2 and SN2' reaction dynamics of cyclopropenyl chloride with halide ion : A direct ab initio molecular dynamics (MD) study | - | Canadian Journal of Chemistry | - | Sep-2005 |
