| Budget Amount *help |
¥24,050,000 (Direct Cost: ¥18,500,000、Indirect Cost: ¥5,550,000)
Fiscal Year 2016: ¥4,420,000 (Direct Cost: ¥3,400,000、Indirect Cost: ¥1,020,000)
Fiscal Year 2015: ¥5,850,000 (Direct Cost: ¥4,500,000、Indirect Cost: ¥1,350,000)
Fiscal Year 2014: ¥9,880,000 (Direct Cost: ¥7,600,000、Indirect Cost: ¥2,280,000)
Fiscal Year 2013: ¥3,900,000 (Direct Cost: ¥3,000,000、Indirect Cost: ¥900,000)
|
|---|
| Outline of Final Research Achievements |
It is necessary to understand the wettability in nano scale interface by using the electronic structure theory because those phenomena are based on the change of electronic structure. To solve the wettability and thermal energy transfer mechanism in nano scale interface, program code based on the non-Born-Oppenheimer quantum theory was developed. The model structure consisted of graphene and water nano droplet was prepared. The homogeneous and inhomogeneous hydrogen bond networks and vibrational frequencies of water which relates to the thermal energy transfer were analyzed. In addition, the electronic structure calculation induced by the electric field was performed. The different hydrogen bond structures were formed by the change of interaction near graphene and water interface.
|
