| Budget Amount *help |
¥4,680,000 (Direct Cost: ¥3,600,000、Indirect Cost: ¥1,080,000)
Fiscal Year 2012: ¥1,300,000 (Direct Cost: ¥1,000,000、Indirect Cost: ¥300,000)
Fiscal Year 2011: ¥1,950,000 (Direct Cost: ¥1,500,000、Indirect Cost: ¥450,000)
Fiscal Year 2010: ¥390,000 (Direct Cost: ¥300,000、Indirect Cost: ¥90,000)
Fiscal Year 2009: ¥390,000 (Direct Cost: ¥300,000、Indirect Cost: ¥90,000)
Fiscal Year 2008: ¥650,000 (Direct Cost: ¥500,000、Indirect Cost: ¥150,000)
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| Research Abstract |
In this project, our new resonance theory formulated on the basis of the second-quantized, biorthogonal operator was systematically examined, and extended togeneralized theories. The computed resonance weights were virtually independent not onlyon the choice of the orbital-localization scheme but also on basis set. The method wasfurther improved to treat four-electron systems. Furthermore, computations and analysisof many organic compounds in solution phase were performed.
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