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Unveiling the mechanical properties and Grüneisen parameter of superconductors at high pressure: universality of EOSs
This research paper presents a comprehensive theoretical analysis of the bulk modulus, pressure derivative of bulk modulus, and Grüneisen parameter...
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Prediction of melting curves of ionic and partially covalent compounds using the Jeanloz equation for the Grüneisen parameter
We have predicted melting temperatures of ionic and partially covalent compounds viz. NaCl, NaF, LiF, MgO, CaF 2 , SiC at high pressures. The volume...
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Vibrational Density of States-Weighted Grüneisen Parameters of Graphite
The vibrational spectrum determines, to a large extent, a material’s thermal expansion. However, extracting information on the material’s vibrational...
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Analysis of melting of some metals using pressure dependence of the Grüneisen parameter in the Lindemann law
In order to obtain the melting curves representing the relationship between melting temperature and pressure for a material with the help of...
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Dependence of the Ratio of Squared Acoustic Wave Velocities in Solids on the Grüneisen Parameter
It is found that in the Leont’ev and Belomestnykh–Tesleva formulas for the Grüneisen parameter, the righthand sides of the equalities depend on the...
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On the Leontiev Formula for the Grüneisen Parameter of Solid States
Abstract—It has been established that the Leontiev formula is in satisfactory agreement with the Grüneisen equation. A comment on the derivation of...
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Model of the Grüneisen Coefficient for a Wide Range of Densities on the Example of Copper
AbstractA method for describing the Grüneisen coefficient, which makes it possible to describe in a unified way both continuous materials, for which...
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Isotherm of Aluminum Based on the Generalized Equation for the Grüneisen Coefficient
AbstractA method of constructing the curve of cold compression and the isotherm for the metal based on the generalized equation for the Grüneisen...
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Deriving Morse Pair Potentials for Nickel and Cobalt, Based on the Grüneisen Parameter and Refined Values of Atomic Compressibility
AbstractMorse pair potentials of nickel and cobalt are developed for atomistic calculations of phase transformations. Values of the equilibrium...
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Anisotropy of the Grüneisen Coefficient Determining the “Thermal” Part of the Pressure in the Equations of State of a Deformable Solid Body
Modeling of deformation processes under shock loading of a barrier made of single-crystal of zinc is carried out taking into account the anisotropy...
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On the Influence of Pressure and Porosity on the Parameters of the Equation of State of a Porous Substance
AbstractThe influence of porosity and pressure on the parameters of the equation of state of a porous material is studied. The model takes into...
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DFT Study of Electronic, Optical, Thermoelectric, and Thermodynamic Properties of the HfO2 Material
In this study, our primary objective is to examine the effect of strain on the HfO 2 compound, delving into its diverse array of physical attributes....
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The influence of chiral arrangement in the magnetocaloric and thermoelectric properties of the intermetallic CeMn2Si2 compound: a first-principle and Monte Carlo simulation
Based on the first-principle calculations, we examine the effect of the ferromagnetism and Dzyaloshinskii–Moriya interaction (DMI) for CeMn 2 Si 2 -sandwi...
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Mechanical, Elastic and Microstructural Investigations on HCP Phase High-Entropy Alloys
Hexagonal-structured high-entropy alloys (HEAs) are in use for engineering materials, for critical components in chemical processing, power...
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Phonon anharmonicity and thermal conductivity of two-dimensional van der Waals materials: A review
Two-dimensional (2D) van der Waals (vdW) materials have extraordinary thermal properties due to the effect of quantum confinement, making them...
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Theoretical Investigation on Thermophysical, Mechanical, and Ultrasonic Properties of NbN Layers Deposited on MgO(001) Substrates at High Temperature
AbstractIn the present paper, we calculated the elastic, mechanical, and thermophysical properties of NbN/MgO(001) layers in the temperature range...
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Investigation on electronic structure, magnetic, elastic, mechanical, thermodynamic and thermoelectric properties of Co2MnTi and Co2VZn full heusler alloys
In the current article we have presented a thorough study on structural stability, elastic, mechanical, electronic, magnetic, thermoelectric and...
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Study on Liquid Phase Transition of Shaped Charge Jet Penetrating Liquid
AbstractThe study of shaped charge jet penetrating liquid is increasing gradually in recent years, but the research of liquid phase transition in the...
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Compressible models of shaped charge jet in water
AbstractShaped charge jet penetration belongs to hypervelocity penetration, and compressibility of projectile/target material should be considered in...
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Continuous Displacement Cluster Variation Method for the Study of Local Lattice Distortion in an Alloy
Systematic studies on the lattice expansion and order-disorder phase equilibria are attempted for the A-B binary alloy on the two-dimensional square...
