“Molecular dynamics simulation study of post-transition state bifurcation: A case study on the ambimodal transition state of dipolar/Diels-Alder cycloaddition”, T. Murakami, Y. Kikuma, D. Hayashi, S. Ibuki, S. Nakagawa, H. Ueno, T. Takayanagi, J. Phys. Org. Chem., 37(8), e4611 (2024).
“Theoretical Study of the Thermal Rate Coefficients of the H3+ + C2H4 Reaction: Dynamics Study on a Full-Dimensional Potential Energy Surface”, T. Murakami, S. Takahashi, Y. Kikuma, T. Takayanagi, Molecules, 29(12), 2789 (2024).
“Computational study of the post-transition state dynamics for the OH + CH3OH reaction probed by photodetachment of the CH3O–(H2O) anion”, T. Murakami, T. Takayanagi, Phys. Chem. Chem. Phys., 26, 19195-19206 (2024).
“Temperature effects on the branching dynamics in the model ambimodal (6 + 4)/(4 + 2) intramolecular cycloaddition reaction”, T. Murakami, D. Hayashi, Y. Kikuma, K. Yamaki, T. Takayanagi, J. Comput. Chem., Early View (2024).
“Computational study on the bifurcation mechanism in the H2CO– + CH3Cl → CH3CH2O + Cl– / H2CO + CH3 + Cl– reaction: The importance of intramolecular vibrational redistributions”, T. Murakami, N. Matsumoto, T. Takayanagi, Comput. Theor. Chem., 1240, 114835 (2024).