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A. E. Kobryn

Publications and source records attributed to A. E. Kobryn.

16 recordsLinked to original sources
arXiv2006

Statistical-mechanical theory of ultrasonic absorption in molecular liquids

We present results of theoretical description of ultrasonic phenomena in molecular liquids. In particular, we are interested in the development of microscopical, i.e., statistical-mechanical framework capable to explain the long living puzzle of the excess ultrasonic absorption in liquids. Typically, ultrasonic wave in a liquid can be generated by applying the periodically alternating external pressure with the angular frequency that corresponds to the ultrasound. If the perturbation introduced by such process is weak - its statistical-mechanical treatment can be done with the use of the linear response theory. We treat the liquid as a system of interacting sites, so that all the response/aftereffect functions as well as the energy dissipation and generalized (wave-vector and frequency dependent) ultrasonic absorption coefficient are obtained in terms of familiar site-site static and time correlation functions such as static structure factors or intermediate scattering functions. To express the site-site intermediate scattering functions we refer to the site-site memory equations in the mode-coupling approximation for the first-order memory kernels, while equilibrium properties such as site-site static structure factors, direct and total correlation functions are deduced from the integral equation theory of molecular liquids known as RISM or one of its generalizations. All the formalism is phrased in a general manner, hence the obtained results are expected to work for arbitrary type of molecular liquid including simple, ionic, polar, and non-polar liquids.

cond-mat.stat-mech↗
arXiv2005

Boson and Fermion Brownian Motion

Dynamics of quantum systems which are perturbed by linear coupling to the reservoir stochastically can be studied in terms of quantum stochastic differential equations (for example, quantum stochastic Liouville equation and quantum Langevin equation). To work it out one needs definition of quantum Brownian motion. Since till very recent times only its boson version has been known, in present paper we demonstrate definition which makes possible consideration also for fermion Brownian motion.

math-ph↗
arXiv2005

Pressure dependence of diffusion coefficient and orientational relaxation time for acetonitrile and methanol in water: DRISM/mode-coupling study

We present results of theoretical description and numerical calculation of the dynamics of molecular liquids based on the Reference Interaction Site Model / Mode-Coupling Theory. They include the temperature-pressure(density) dependence of the translational diffusion coefficients and orientational relaxation times for acetonitrile and methanol in water at infinite dilution. Anomalous behavior, i.e. the increase in mobility with density, is observed for the orientational relaxation time of methanol, while acetonitrile does not show any deviations from the usual. This effect is in qualitative agreement with the recent data of MD simulation and with experimental measurements, which tells us that presented theory is a good candidate to explain such kind of anomalies from the microscopical point of view and with the connection to the structure of the molecules.

physics.chem-ph↗
arXiv2005

Study of anomalous mobility of polar molecular solutions by means of the site-site memory equation formalism

In this work, the memory equation approach is applied for theoretical study of dynamics of polar molecular liquids described by the interaction site model. The study includes the temperature-density(pressure) dependence of the translational diffusion coefficients D and orientational relaxation times t for infinitely dilute solutions of acetonitrile and methanol in water, and methanol in acetonitrile. Calculations are performed over the range of temperatures and densities employing the SPC/E model for water and optimized site-site potentials for acetonitrile and methanol. Despite an approximate character of the model potentials and closure relation used, the theory is able to reproduce qualitatively all main features of temperature and density dependences of D and t observed in computer and real experiments. In particular, anomalous behavior, i.e. the increase in mobility with density(pressure), is obtained for D and t of methanol in water, while acetonitrile in water or methanol in acetonitrile do not show deviations from the usual. The observed enhancement in the molecular mobility is interpreted in accordance with the concept by Yamaguchi et al. [J. Chem. Phys. 119 (2003) 1021], i.e. in terms of two competing origins of friction, which interplay with each other as density increases: the collisional and dielectric frictions that have tendency, respectively, to strengthen and weaken with increasing density.

physics.chem-ph↗
arXiv2005

Site-site memory equation approach in study of density/pressure dependence of translational diffusion coefficient and rotational relaxation time of polar molecular solutions: acetonitrile in water, methanol in water, and methanol in acetonitrile

We present results of theoretical study and numerical calculation of the dynamics of molecular liquids based on combination of the memory equation formalism and the reference interaction site model - RISM. Memory equations for the site-site intermediate scattering functions are studied in the mode-coupling approximation for the first order memory kernels, while equilibrium properties such as site-site static structure factors are deduced from RISM. The results include the temperature-density(pressure) dependence of translational diffusion coefficients D and orientational relaxation times t for acetonitrile in water, methanol in water and methanol in acetonitrile, all in the limit of infinite dilution. Calculations are performed over the range of temperatures and densities employing the SPC/E model for water and optimized site-site potentials for acetonitrile and methanol. The theory is able to reproduce qualitatively all main features of temperature and density dependences of D and t observed in real and computer experiments. In particular, anomalous behavior, i.e. the increase in mobility with density, is observed for D and t of methanol in water, while acetonitrile in water and methanol in acetonitrile do not show deviations from the ordinary behavior. The variety exhibited by the different solute-solvent systems in the density dependence of the mobility is interpreted in terms of the two competing origins of friction, which interplay with each other as density increases: the collisional and dielectric frictions which, respectively, increase and decrease with increasing density.

physics.chem-ph↗
arXiv2003

Quantum stochastic differential equations for boson and fermion systems -- Method of Non-Equilibrium Thermo Field Dynamics

A unified canonical operator formalism for quantum stochastic differential equations, including the quantum stochastic Liouville equation and the quantum Langevin equation both of the Itô and the Stratonovich types, is presented within the framework of Non-Equilibrium Thermo Field Dynamics (NETFD). It is performed by introducing an appropriate martingale operator in the Schrödinger and the Heisenberg representations with fermionic and bosonic Brownian motions. In order to decide the double tilde conjugation rule and the thermal state conditions for fermions, a generalization of the system consisting of a vector field and Faddeev-Popov ghosts to dissipative open situations is carried out within NETFD.

math-ph↗
arXiv2000

Enskog-Landau kinetic equation for multicomponent mixture. Analytical calculation of transport coefficients

The Enskog-Landau kinetic equation is considered to describe non-equilibrium processes of a mixture of charged hard spheres. This equation has been obtained in our previous papers by means of the non-equilibrium statistical operator method. The normal solution of this kinetic equation found in the first approximation using the standard Chapman-Enskog method is given. On the basis of the found solution the flows and transport coefficients have been calculated. All transport coefficients for multicomponent mixture of spherical Coulomb particles are presented analytically for the first time. Numerical calculations of thermal conductivity and thermal diffusion coefficient are performed for some specific mixtures of noble gases of high density. We compare the calculations with those ones for point-like neutral and charged particles.

physics.plasm-ph↗
arXiv1999

Kinetic equation for liquids with a multistep potential of interaction. II: Calculation of transport coefficients

We consider a new kinetic equation for systems with a multistep potential of interaction proposed by us recently in Physica A 234 (1996) 89. This potential consists of the hard sphere part and a system of attractive and repulsive walls. Such a model is a generalization of many previous semi-phenomenological kinetic theories of dense gases and liquids. In this article a normal solution to the new kinetic equation has been obtained, integral conservation laws in the first order on gradients of hydrodynamic parameters have been derived as well. The expressions for transport coefficients are calculated for the case of stationary process. We also consider limiting cases for this kinetic equation. For specific parameters of model interaction potential in shape of the multistep function, the obtained results rearrange to those of previous kinetic theories by means of the standard Chapman-Enskog method. In view of this, new theory can be considered as a generalized one which in some specific cases arrives at the results of previous ones and in such a way displays the connection of these theories between themselves. At the end of this article we present results of numerical computation of transport coefficients for Argon along curve of saturation and their comparison with experimental data available and MD simulations.

cond-mat.stat-mech↗
arXiv1999

Transport equations of a consistent description of the kinetics and hydrodynamics of dense quantum systems. I: General approach within the frame of nonequilibrium thermo field dynamics

We present basic equations of nonequilibrium thermo field dynamics of dense quantum systems. A formulation of nonequilibrium thermo field dynamics has been performed using the nonequilibrium statistical operator method by D.N.Zubarev. Generalized transfer and hydrodynamic equations of a consistent description of kinetics and hydrodynamics have been obtained in thermo field representation. To demonstrate how obtained results do work at the description of kinetics and hydrodynamics of a dense nuclear matter we consider quantum system with strongly coupled states.

nucl-th↗
arXiv1999

A consistent description of kinetics and hydrodynamics of systems of interacting particles by means of the nonequilibrium statistical operator method

A statistical approach to a self-consistent description of kinetic and hydrodynamic processes in systems of interacting particles is formulated on the basis of the nonequilibrium statistical operator method by D.N.Zubarev. It is shown how to obtain the kinetic equation of the revised Enskog theory for a hard sphere model, the kinetic equations for multistep potentials of interaction and the Enskog-Landau kinetic equation for a system of charged hard spheres. The BBGKY hierarchy is analyzed on the basis of modified group expansions. Generalized transport equations are obtained in view of a self-consistent description of kinetics and hydrodynamics. Time correlation functions, spectra of collective excitations and generalized transport coefficients are investigated in the case of weakly nonequilibrium systems of interacting particles.

cond-mat.stat-mech↗
arXiv1999

Thermo field hydrodynamic and kinetic equations of dense quantum nuclear systems

Basic equations of nonequilibrium thermo field dynamics of dense quantum systems are presented. A formulation of nonequilibrium thermo field dynamics has been performed using the nonequilibrium statistical operator method by D.N.Zubarev. Hydrodynamic equations have been obtained in thermo field representation. Two levels of the description of kinetics and hydrodynamics of a dense nuclear matter are considered. The first one is a quantum system with strongly coupled states, the second one is a quark-gluon plasma. Generalized transfer equations of a consistent description of kinetics and hydrodynamics have been obtained, as well as limiting cases are considered.

nucl-th↗
arXiv1999

Normal solution and transport coefficients to the Enskog-Landau kinetic equation for a two-component system of charged hard spheres. The Chapman-Enskog method

An Enskog-Landau kinetic equation for a many-component system of charged hard spheres is proposed. It has been obtained from the Liouville equation with modified boundary conditions by the method of nonequilibrium statistical operator. On the basis of this equation the normal solutions and transport coefficients such as bulk kappa and shear eta viscosities, thermal conductivity lambda, mutual diffusion D^{αβ} and thermal diffusion D_T^αhave been obtained for a binary mixture in the first approximation using the Chapman-Enskog method. Numerical calculations of all transport coefficients for mixtures Ar-Kr, Ar-Xe, Kr-Xe with different concentrations of compounds have been evaluated for the cases of absence and presence of long-range Coulomb interactions. The results are compared with those obtained from other theories and experiment.

physics.plasm-ph↗
arXiv1999

Normal solution to the Enskog-Landau kinetic equation. Boundary conditions method

Nonstationary and nonequilibrium processes are considered on the basis of an Enskog-Landau kinetic equation using a boundary conditions method. A nonstationary solution of this equation is found in the pair collision approximation. This solution takes into account explicitly the influence of long-range interactions. New terms to the transport coefficients are identified. An application of the boundary conditions method to hydrodynamic description of fast processes is discussed.

physics.plasm-ph↗
arXiv1999

The modified group expansions for construction of solutions to the BBGKY hierarchy

A solution to the BBGKY hierarchy for nonequilibrium distribution functions is obtained within modified boundary conditions. The boundary conditions take into account explicitly both the nonequilibrium one-particle distribution function as well as local conservation laws. As a result, modified group expansions are proposed. On the basis of these expansions, a generalized kinetic equation for hard spheres and a generalized Bogolubov-Lenard-Balescu kinetic equation for a dense electron gas are derived within the polarization approximation.

cond-mat.stat-mech↗