| Budget Amount *help |
¥3,250,000 (Direct Cost: ¥2,500,000、Indirect Cost: ¥750,000)
Fiscal Year 2010: ¥1,170,000 (Direct Cost: ¥900,000、Indirect Cost: ¥270,000)
Fiscal Year 2009: ¥1,170,000 (Direct Cost: ¥900,000、Indirect Cost: ¥270,000)
Fiscal Year 2008: ¥910,000 (Direct Cost: ¥700,000、Indirect Cost: ¥210,000)
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| Research Abstract |
I developed new time-domain ab initio simulation methods to study photo-excited dynamics in promising nanomaterials such as a DNA duplex helix and quantum dots. The results I obtained can contribute to developing next-generation photovoltaic devices. Furthermore, I developed a new semiquantum molecular dynamics simulation method to investigate nuclear quantum effects in condensed phases. This new method can be used to study not only simple liquid dynamics, but also chemical/biochemical reaction dynamics in a condensed phase, leading to get interesting and useful information in such complex systems.
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