Theory and computation-guided approach: Smart Materials Science
Development of “Predictive” Chemical Theory for Reaction, Electron, and Spectroscopy and programs, as well as advanced computational chemistry applications. First-principle excited-state reaction dynamics, theory-guiding catalytic design with element strategy, development of a large-scale electronic structure theory, near-field molecular theory, reaction informatics.
Faculty
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TAKETSUGU Tetsuya Professor
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KOBAYASHI Masato Associate Professor
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IWASA Takeshi Assistant Professor