Density Functional Based Tight Binding Study on Wurtzite ZnO Prismatic Nanoparticles
نویسندگان
چکیده
منابع مشابه
Density Functional Based Tight Binding Study on Wurtzite Zno Prismatic Nanoparticles
We have performed the Density Functional Tight Binding (DFTB) study on the structural properties of Zinc Oxide Nanoparticles (NP), focusing on the effects induced by the surfaces and quantum size effect. Effects of surface relaxation and surface stress which is absent in atomistic model are taken carefully into account. The studying Nanoparticle size range up to 2.3nm. We illustrated the struct...
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ژورنال
عنوان ژورنال: Communications in Physics
سال: 2011
ISSN: 0868-3166,0868-3166
DOI: 10.15625/0868-3166/21/3/173