41st National Conference on Theoretical Physics (NCTP-41)
Hội nghị Vật lý lý thuyết toàn quốc lần thứ 41
Nha Trang, 1-4 August 2016
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ProgramP.43 -- Poster, NCTP-41 Date: Wednesday, 3 August 2016> Time: 08h30 - 10h00> Atomic structure of nanometer-sized amorphous TiO$_2$Phan Thanh Hung (1), Le Thi Hong Diep (2), Le Thi Cam Loan (1), Huynh Anh Huy (2) (1) Tra Vinh University (2) Can Tho University TiO$_2$ nanoparticles with different configuration and size from 0.8 nm to 2.7 nm in anatase and rutile phases are studied by Density Functional theory based on Tight-Binding (DFTB). The structure and properties of amorphous TiO$_2$ greatly depend on their size. The surface energies are calculated to provide useful instructions to the fabrication of TiO$_2$ nanoparticles. Presenter: Phan Thanh Hùng |
Institute of Physics, VAST
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Center for Theoretical Physics |
Center for Computational Physics
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