Researcher Information

Takeshi Iwasa

Assistant Professor

Department of Chemistry, Physical Chemistry

basic_photo_1

Representative Achievements

Combined Computational Quantum Chemistry and Classical Electrodynamics Approach for Surface Enhanced Infrared Absorption Spectroscopy
M. Takenaka, T. Taketsugu, T. Iwasa*, J. Chem. Phys., 152, 164103 (2020).
Single-molecule resonance Raman effect in a plasmonic nanocavity
R. B. Jaculbia, H. Imada*, K. Miwa, T. Iwasa, M. Takenaka, B. Yang, E. Kazuma, N. Hayazawa*, T. Taketsugu, Y. Kim*, Nat. Nanotechnol., 15, 105-110 (2020).
Combined Automated Reaction Pathway Searches and Sparse Modeling Analysis for Catalytic Properties of Lowest Energy Twins of Cu13
T. Iwasa*, T. Sato, M. Takagi, M. Gao, A. Lyalin, M. Kobayashi, K. Shimizu, S. Maeda, T. Taketsugu*, J. Phys. Chem. A, 123, 210-217 (2019).
First principles calculations toward understanding SERS of 2,2′-bipyridyl adsorbed on Au, Ag and Au-Ag alloy
M. Takenaka, Y. Hashimoto, T. Iwasa*, T. Taketsugu, G. Seniutinas, A. Balčytis, S. Juodkazise, Y. Nishijima*, J. Comput. Chem., 40, 925-932 (2019).
Time-Dependent Density Functional Theory Study on Higher Low-Lying Excited States of Au25(SR)18–
M. Ebina, T. Iwasa*, Y. Harabuchi, T. Taketsugu*, J. Phys. Chem. C, 122, 4097-4104 (2018).