tailieunhanh - Combining the mie-lennard-jones and model atomic potentials in studying the elastic deformation of interstitial alloy FeSi with BCC structure under pressure

In present paper, we will present the theory of elastic deformation for binary interstitial alloys with FCC structure at zero pressure and under pressure builded by the SMM. Then, we apply this theory to study the elastic deformation of interstitial alloy AgC by combining the Mie-Lennard-Jones pair potential [14] and the Morse pair potential. | COMBINING THE MIE LENNARD JONES AND MODEL ATOMIC POTENTIALS IN STUDYING THE ELASTIC DEFORMATION OF INTERSTITIAL ALLOY FeSi WITH BCC STRUCTURE UNDER PRESSURE Abstract. The mean nearest neighbor distance between two atoms the Helmholtz free energy and characteristic quantities for elastic deformation such as elastic moduli E G K and elastic constants C11 C12 C44 for binary interstitial alloys with BCC structure under pressure are derived from the statistical moment method. The numerical calculations for interstitial alloy FeSi are performed by combining the Mie Lennard Jones potential and the model atomic potential. Our calculated results are compared with other calculations and the experimental data. Keywords elastic deformation interstitial alloy Mie Lennard Jones potential model atomic potential and statistical moment method By the statistical moment method SMM we have been studied the elastic deformation for body centered cubic BCC and face centered cubic FCC ternary and binary interstitial alloys under pressure in 1 10 . In these papers we always apply the Mie Lennard Jones pair potential 11 the Morse pair potential 12 and the Finnis Sinclair N body potential 13 . Transition metals such as iron gold silver etc. and their alloys are widely used in structural electrical and other technological applications. The dependence of elastic and nonlinear deformations of materials on temperature and pressure has very important role in order to predict and understand their interatomic interactions strength mechanical stability phase transition mechanisms and dynamical response. Iron silicides have paid attention in recent decades due to their unusual physical properties and functional applications. Silicon has been proposed to be a potential light element in the Earth s core based on density velocity isotopic and geochemical data 14 15 . In order to assess Si as a constituent of the core it is necessary to determine physical properties of Si bearing iron .

• Hoá học
• Elastic deformation
• Interstitial alloy
• Mie Lennard Jones potential
• Model atomic potential
• Statistical moment method
• Communications in Physics
• Investigation of thermodynamic properties
• Metal thin film
• The statistical moment method
• The power moments
• Semiconductor superlattice
• Mathematical sciences
• Physical sciences
• Moment method
• Statistical dynamics
• Oxygen vacancy diffusion
• Yttria doped ceria
• Vacancy activation energies
• YSZ systems
• Investigation of thermodynamic quantities
• Thermodynamic quantities
• Cubic zirconia
• Coefficients of thermal expansion
• Thermal expansion
• Face centered cubic structure
• Helmholtz free energy
• Thin film
• Lattice constant
• Mathematical and physical
• The moment method in statistical
• Lattice constant of CeO2
• Natural sciences
• High pressure
• Oxide superlattice
• Analytic expression
• Electronic industry
• Lindemann criterion
• High pressure melting curves
• Elastic moduli
• Yttria doped ceria crystal
• Investigation of lattice constants
• Applications of q deformed Fermi Dirac statistics
• Statistical moment
• Thermodynamic properties
• Magnetic properties
• Metallic thin films
• Tạp chí khoa học
• Khoa học tự nhiên
• Melting Temperature of Iron
• Self consistent field method
• Molecular cryocrystal
• Face centered cubic
• Mathematical science
• Physical science
• Anharmonic approximations
• The melting temperature of agce alloy
• Rare earth alloys
• Ag containing in the alloys
• The melting temperatures
• Thermodynamic properties of free standing thin metal films
• Temperature and pressure dependences
• The moment method in the statistical dynamics
• Fcc metal thin films
• Gibbs thermodynamic potential
• Structural phase transition temperature
• Atomistic dynamics
• Electrical property
• Yttria stabilized zirconia
• Buckingham potential
• Substitution and interstitial alloy
• Concentration of equilibrium vacancies
• Body centered cubic
• Equilibrium vacancies
• Absolute stability of the crystalline state
• Interstitial alloys FeH
• Body centred cubic structure
• Substitutional alloy
• Equilibrium vacancy concentration
• Absolute stability for crystalline state
• BCC structure
• The thermal expansion coefficient
• The heat capacities
• Tạp chí khóa học
• Limiting temperature
• Absolute stability
• Ternary interstitial alloy
• Young modulus
• Bulk modulus
• Rigidity modulus
• Elastic constant
• Structural transition temperature
• Rare earth metals
• Previous experiments