• Advances in materials Research
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• 제13권4호
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• pp.285-297
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• 2024

The theory of nonlinear elastic wave propagation is important in multiple scientific and engineering fields. In this study, we present a comprehensive examination of nonlinear elastic wave profiles through a contemporary approach of successive approximation. This research is related to nonlinear elastic wave models along different types of nonlinearities. Murnaghan potential is used due to the assumption of the hyper-elastic materials. We explore the complication of the governing equations and go through the behaviors of nonlinear waves in one dimension. The comparative aspect of our study is a distinctive feature, as we evaluate and contrast the results obtained using successive approximation along different nonlinearities. Additionally, we present graphical representations of our findings, enhancing the visual comprehension of the wave profiles and their evolution. This study contributes to the nonlinear elastic wave analysis and comparison.

• Nuclear Engineering and Technology
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• 제51권5호
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• pp.1373-1380
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• 2019

Besides promising implications as fertile nuclear materials, thorium carbonitrides are of great interest owing to their peculiar physical and chemical properties, such as high density, high melting point, good thermal conductivity. This paper reports first-principles simulation results on the structural, electronic and magnetic properties of cubic thorium carbonitrides $ThC_xN_{(1-x)}$ (X = 0.03125, 0.0625, 0.09375, 0.125, 0.15625) employing formalism of density-functional-theory. For the simulation of physical properties, we incorporated full-potential linearized augmented plane-wave (FPLAPW) method while the exchange-correlation potential terms in Kohn-Sham Equation (KSE) are treated within Generalized-Gradient-Approximation (GGA) in conjunction with Perdew-Bruke-Ernzerhof (PBE) correction. The structural parameters were calculated by fitting total energy into the Murnaghan's equation of state. The lattice constants, bulk moduli, total energy, electronic band structure and spin magnetic moments of the compounds show dependence on the C/N concentration ratio. The electronic and magnetic properties have revealed non-magnetic but metallic character of the compounds. The main contribution to density of states at the Fermi level stems from the comparable spectral intensity of Th (6d+5f) and (C+N) 2p states. In comparison with spin magnetic moments of ThSb and ThBi calculated earlier with LDA+U approach, we observed an enhancement in the spin magnetic moments after carbon-doping into ThN monopnictide.