Realistic interatomic potential for MD simulations

The coefficients of interatomic potential of simple form Exp-6 for neon are obtained. Repulsive part is calculated ab-initio in the Hartree-Fock approximation using the basis of atomic orbitals orthogonalized exactly on different lattice sites. Attractive part is determined empirically using single fitting parameter. The potential obtained describes well the equation of state and elastic moduli of neon crystal in wide range of interatomic distances and it is appropriate for molecular dynamic simulations of high temperature properties and phenomena in crystals and liquids.Comment: MikTex v.2.1 (AMS-TEX),11 pages, 3 EPS figure

Study of Photometric Variability of Selected SU UMa Dwarf Novae

In this work we present time-resolved photometry of several poorly-studied dwarf novae during recent superoutbursts. Observations were made with a CCD, mounted on 50- and 60-cm telescopes of the Sternberg Astronomical Institute in Crimea in April - May and October 2012 and June - July 2013. Superhumps were detected in light curves of all the dwarf novae. The amplitudes and periods of detected light variations were calculated. Superhumps evolution was also followed up for all systems and classification is improved

Thermodynamics and kinetics of solids fragmentation at severe plastic deformation

The approach of nonequilibrium evolution thermodynamics earlier offered is developed. It helps to describe the processes of defect formation within the adiabatic approximation. The basic equations system depends on the initial defects distribution (dislocations and grain boundaries). The phase diagram is determined with the domains of the realization of different limiting structure types. The interaction effect of several defect types on the formation of a limiting structure is investigated in terms of the internal energy. The conditions of the formation of two limiting structures are found. The kinetics of the steady-state values establishment of the defects density is investigated within the scope of the adiabatic approximation. The dislocations density change follows the evolution of the grain boundaries density in this approach. It is shown that grain sizes, in limiting structures, decrease with an increase of the elastic strains.Comment: 14 pages, 6 figure

Nonlinear effects in memristors with mobile vacancies

Because the local concentration of vacancies in any material is bounded, their motion must be accompanied by nonlinear effects. Here we look for such effects in a simple model for electric field driven vacancy motion in memristors, solving the corresponding nonlinear Burgers' equation with impermeable nonlinear boundary conditions analytically. We find non-monotonous relaxation of the resistance while switching between the stable (``on''/``off'') states of the memristor; and qualitatively different film thickness dependencies of switching time (under applied current) and relaxation time (under no current). Our exact solution can serve as a useful benchmark for simulations of more complex memristor models.Comment: 5 pages, 3 figures (v2: clarifications/improvements as per referee comments and other minor changes

Formation of the internal structure of solids under severe action

On the example of a particular problem, the theory of vacancies, a new form of kinetic equations symmetrically incorporation the internal and free energies has been derived. The dynamical nature of irreversible phenomena at formation and motion of defects (dislocations) has been analyzed by a computer experiment. The obtained particular results are extended into a thermodynamic identity involving the law of conservation of energy at interaction with an environment (the 1st law of thermodynamics) and the law of energy transformation into internal degree of freedom (relaxation). The identity is compared with the analogous Jarzynski identity. The approach is illustrated by simulation of processes during severe plastic deformation, the Rybin kinetic equation for this case has been derived.Comment: 9 pages, 5 figure