A simple theoretical model has been proposed to study the diameter-dependent properties of metallic nanoparticles, i.e. Ag, Au, Al, Ni, Pb, Cu and Fe. The diameter-dependent thermodynamic properties includes melting temperature, Debye temperature, evaporation temperature, melting enthapy and melting entropy. The model is also extended to study the diameter-dependent elastic properties including bulk modulus, Young's modulus and thermal expansion coefficient. On comparison with available experimental findings and other theoretical approaches, the results obtained with the present formulation depict a close agreement and demonstrate the validity of the method proposed in the present paper.
Compression behavior of carbon nanotube bundles and individual carbon nanotubes within the bundle has been studied by using the Suzuki, Shanker, and usual Tait formulations. It is found that the Suzuki formulation is not capable of explaining the compression behavior of nanomaterials. Shanker formulation slightly improves the results obtained by the Suzuki formulation, but only usual Tait’s equation (UTE) of state gives results in agreement to the experimental data. The present study reveals that the product of bulk modules and the coefficient of volume thermal expansion remain constant for carbon nanotubes. It has also been found that the individual carbon nanotubes are less compressible than bundles of carbon nanotubes.
A simple theoretical model is developed to study the high pressure behavior of solids and is applied to evaluate the pressure for MgO in case of large compression along with Shanker, Tait, Vinet, and Birch-Murnaghan equation of states (EOSs). These EOSs are also tested for the basic requirements revealed from the fundamental thermodynamics for solids in the limit of extreme compressions, as given by Stacey. It is found that for the high pressure compression behavior of MgO the present model, Tait, Vinet, and Birch-Murnaghan EOSs give the results compatible with the experimental data. It has also been found that in the regime of ultrahigh pressure the present model and Birch-Murnaghan EOS satisfy the Stacey criterion.
The high-pressure compression behaviour of the nanomaterials 3C-SiC, Zr 0.1 Ti 0.9 O 2 , CuO, AlN, TiO 2 (anatase), TiO 2 (rutile), ␣-Fe 2 O 3 , ␥-Fe 2 O 3 , -Fe and Rb 3 C 60 was studied in two theoretical equation of state (EOS) models. In the first model, we considered the pressure to be quadratic in terms of relative volume change, while in the second model pressure was considered to be quadratic in density. The experimental data show that the second model gives better results. The two models were also studied for their suitability in cases of very high compression.
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