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About one version of the nodal method of characteristics
Computer Research and Modeling, 2023, v. 15, no. 1, pp. 29-44A variant of the inverse method of characteristics (IMH) is presented, in whose algorithm an additional fractional time step is introduced, which makes it possible to increase the accuracy of calculations due to a more accurate approximation of the characteristics. The calculation formulas of the modified method for the equations of the one-velocity model of a gas-liquid mixture are given, with the help of which one-dimensional and also flat test problems with self-similar solutions are calculated. When solving multidimensional problems, the original system of equations is split into a number of one-dimensional subsystems, for the calculation of which the inverse method of characteristics with a fractional time step is used. Using the proposed method, the following were calculated: the one-dimensional problem of the decay of an arbitrary discontinuity in a dispersed medium; a twodimensional problem of the interaction of a homogeneous gas-liquid flow with an obstacle with an attached shock wave, as well as a flow with a centered rarefaction wave. The results of numerical calculations of these problems are compared with self-similar solutions and their satisfactory agreement is noted. On the example of the Riemann problem with a shock wave, a comparison is made with a number of conservative, non-conservative, first and higher orders of accuracy schemes, from which, in particular, it follows that the presented calculation method, i. e. MIMC, quite competitive. Despite the fact that the application of MIMC requires many times more time than the original inverse method of characteristics (IMC), calculations can be carried out with an increased time step and, in some cases, more accurate results can be obtained. It is noted that the method with a fractional time step has advantages over the IMC in cases where the characteristics of the system are significantly curvilinear. For this reason, the use of MIMC, for example, for the Euler equations is inappropriate, since for the latter the characteristics within the time step differ little from straight lines.
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Modeling the response of polycrystalline ferroelectrics to high-intensity electric and mechanical fields
Computer Research and Modeling, 2022, v. 14, no. 1, pp. 93-113A mathematical model describing the irreversible processes of polarization and deformation of polycrystalline ferroelectrics in external electric and mechanical fields of high intensity is presented, as a result of which the internal structure changes and the properties of the material change. Irreversible phenomena are modeled in a three-dimensional setting for the case of simultaneous action of an electric field and mechanical stresses. The object of the research is a representative volume in which the residual phenomena in the form of the induced and irreversible parts of the polarization vector and the strain tensor are investigated. The main task of modeling is to construct constitutive relations connecting the polarization vector and strain tensor, on the one hand, and the electric field vector and mechanical stress tensor, on the other hand. A general case is considered when the direction of the electric field may not coincide with any of the main directions of the tensor of mechanical stresses. For reversible components, the constitutive relations are constructed in the form of linear tensor equations, in which the modules of elasticity and dielectric permeability depend on the residual strain, and the piezoelectric modules depend on the residual polarization. The constitutive relations for irreversible parts are constructed in several stages. First, an auxiliary model was constructed for the ideal or unhysteretic case, when all vectors of spontaneous polarization can rotate in the fields of external forces without mutual influence on each other. A numerical method is proposed for calculating the resulting values of the maximum possible polarization and deformation values of an ideal case in the form of surface integrals over the unit sphere with the distribution density obtained from the statistical Boltzmann law. After that the estimates of the energy costs required for breaking down the mechanisms holding the domain walls are made, and the work of external fields in real and ideal cases is calculated. On the basis of this, the energy balance was derived and the constitutive relations for irreversible components in the form of equations in differentials were obtained. A scheme for the numerical solution of these equations has been developed to determine the current values of the irreversible required characteristics in the given electrical and mechanical fields. For cyclic loads, dielectric, deformation and piezoelectric hysteresis curves are plotted.
The developed model can be implanted into a finite element complex for calculating inhomogeneous residual polarization and deformation fields with subsequent determination of the physical modules of inhomogeneously polarized ceramics as a locally anisotropic body.
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Development of a computational environment for mathematical modeling of superconducting nanostructures with a magnet
Computer Research and Modeling, 2023, v. 15, no. 5, pp. 1349-1358Now days the main research activity in the field of nanotechnology is aimed at the creation, study and application of new materials and new structures. Recently, much attention has been attracted by the possibility of controlling magnetic properties using a superconducting current, as well as the influence of magnetic dynamics on the current–voltage characteristics of hybrid superconductor/ferromagnet (S/F) nanostructures. In particular, such structures include the S/F/S Josephson junction or molecular nanomagnets coupled to the Josephson junctions. Theoretical studies of the dynamics of such structures need processes of a large number of coupled nonlinear equations. Numerical modeling of hybrid superconductor/magnet nanostructures implies the calculation of both magnetic dynamics and the dynamics of the superconducting phase, which strongly increases their complexity and scale, so it is advisable to use heterogeneous computing systems.
In the course of studying the physical properties of these objects, it becomes necessary to numerically solve complex systems of nonlinear differential equations, which requires significant time and computational resources.
The currently existing micromagnetic algorithms and frameworks are based on the finite difference or finite element method and are extremely useful for modeling the dynamics of magnetization on a wide time scale. However, the functionality of existing packages does not allow to fully implement the desired computation scheme.
The aim of the research is to develop a unified environment for modeling hybrid superconductor/magnet nanostructures, providing access to solvers and developed algorithms, and based on a heterogeneous computing paradigm that allows research of superconducting elements in nanoscale structures with magnets and hybrid quantum materials. In this paper, we investigate resonant phenomena in the nanomagnet system associated with the Josephson junction. Such a system has rich resonant physics. To study the possibility of magnetic reversal depending on the model parameters, it is necessary to solve numerically the Cauchy problem for a system of nonlinear equations. For numerical simulation of hybrid superconductor/magnet nanostructures, a computing environment based on the heterogeneous HybriLIT computing platform is implemented. During the calculations, all the calculation times obtained were averaged over three launches. The results obtained here are of great practical importance and provide the necessary information for evaluating the physical parameters in superconductor/magnet hybrid nanostructures.
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