| Project/Area Number |
25889054
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| Research Category |
Grant-in-Aid for Research Activity Start-up
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| Allocation Type | Single-year Grants |
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| Research Field |
Thermal engineering
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| Research Institution | Tokyo University of Science |
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Principal Investigator |
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| Project Period (FY) |
2013-08-30 – 2015-03-31
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| Project Status |
Completed (Fiscal Year 2014)
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| Budget Amount *help |
¥2,730,000 (Direct Cost: ¥2,100,000、Indirect Cost: ¥630,000)
Fiscal Year 2014: ¥1,300,000 (Direct Cost: ¥1,000,000、Indirect Cost: ¥300,000)
Fiscal Year 2013: ¥1,430,000 (Direct Cost: ¥1,100,000、Indirect Cost: ¥330,000)
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| Keywords | 化学物理 / 計算物理 / 熱工学 / 氷 / 分子動力学 / 相転移 / ナノ細孔 / 蓄熱材料 |
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| Outline of Final Research Achievements |
The melting points of the molecules in nanoporous materials are tunable and they are potentially used as thermal storage media. In this research project, it is studied that how the size of nanoporous materials effects melting points and free energy barriers for crystallization by theory and numerical simulation.
First, the free energy barrier for crystallization is computed by numerical simulation and at some specific sized pore, the system show lower energy barrier than other sized pore. Second, the melting points computed by numerical simulation and predicted by Gibbs-Thomson theory are compared. Then, the complex variation of melting points computed by numerical simulation is partially explained by the theory.
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