Structural correlations in highly asymmetric binary charged colloidal mixtures.

We explore structural correlations of strongly asymmetric mixtures of binary charged colloids within the primitive model of electrolytes considering large charge and size ratios of 10 and higher. Using computer simulations with explicit microions, we obtain the partial pair correlation functions between the like-charged colloidal macroions. Interestingly the big-small correlation peak amplitude is smaller than that of the big-big and small-small macroion correlation peaks, which is unfamiliar for additive repulsive interactions.

Branched droplet clusters and the Kramers theorem.

Scaling laws inherent for polymer molecules are checked for the linear and branched chains constituting two-dimensional (2D) levitating microdroplet clusters condensed above the locally heated layer of water. We demonstrate that the dimensionless averaged end-to-end distance of the droplet chain r[over ¯] normalized by the averaged distance between centers of the adjacent droplets l[over ¯] scales as r[over ¯]/l[over ¯]∼n^{0.76}, where n is the number of links in the chain, which is close to the power exponent ¾, predicted for 2D polymer chains with excluded volume in the dilution limit.

Streamer formation processes trigger intense x-ray and high-frequency radio emissions in a high-voltage discharge.

For a laboratory discharge initiated in a long air gap by a microsecond megavolt pulse, we simultaneously register wideband high-frequency microwave and hard-x-ray emissions and thoroughly analyze the temporal relationship of the emissions depending on the discharge evolution. The temporal structure of microwave radiation is found to consist of numerous short intense bursts with high-frequency components. We directly show that x-ray and microwave emissions can appear almost synchronously in the discharge but only when a complex net of countless plasma channels forms and spans the entire discharge gap.

CFD simulation of updrafts initiated by a vertically directed jet fed by the heat of water vapor condensation.

This paper presents the results of the development of a mathematical model and numerical simulation of the ascent in the atmosphere of a vertically directed jet fed by the heat of condensation of water vapor on a hygroscopic aerosol introduced into the jet at the start. The possibility of creating artificial convective clouds depending on jet parameters, condensation heat value and vertical profiles of wind speed, air temperature and humidity has been evaluated. Numerical experiments showed that the motion of a high-speed and high-temperature jet in the atmosphere has a complex turbulent nature.

Motion of a self-propelled particle with rotational inertia.

Overdamped active Brownian motion of self-propelled particles in a liquid has been fairly well studied. However, there are a variety of situations in which the overdamped approximation is not justified, for instance, when self-propelled particles move in a low-viscosity medium or when their rotational diffusivity is enhanced by internal active processes or external control. Examples of various origins include biofilaments driven by molecular motors, living and artificial microflyers and interfacial surfers, field-controlled and superfluid microswimmers, vibration-driven granular particles and autonomous mini-robots with sensorial delays, All of them extend active Brownian motion to the underdamped case, , to active Langevin motion, which takes into account inertia.

Graphene: Hexagonal Boron Nitride Composite Films with Low-Resistance for Flexible Electronics.

The structure and electric properties of hexagonal boron nitride (h-BN):graphene composite with additives of the conductive polymer PEDOT:PSS and ethylene glycol were examined. The graphene and h-BN flakes synthesized in plasma with nanometer sizes were used for experiments. It was found that the addition of more than 10 mass% of PEDOT:PSS to the graphene suspension or h-BN:graphene composite in combination with ethylene glycol leads to a strong decrease (4-5 orders of magnitude, in our case) in the resistance of the films created from these suspensions.

Hard-to-soft transition-enhanced piezoelectricity in poly(vinylidene fluoride) relaxor-like secondary crystals activated by high-power ultrasonication.

Although high piezoelectric coefficients have recently been observed in poly(vinylidene fluoride--trifluoroethylene) [P(VDF-TrFE)] random copolymers, they have low Curie temperatures, which makes their piezoelectricity thermally unstable. It has been challenging to achieve high piezoelectric performance from the more thermally stable PVDF homopolymer. In this report, we describe how high-power ultrasonic processing was used to induce a hard-to-soft piezoelectric transition and improve the piezoelectric coefficient in neat PVDF.

Active Brownian motion of strongly coupled charged grains driven by laser radiation in plasma.

The systems of active Brownian grains can be considered as open systems, in which there is an exchange of energy and matter with the environment. The collective phenomena of active Brownian grains can demonstrate analogies with ordinary phase transitions. We study the active Brownian motion of light-absorbing and strongly interacting grains far from equilibrium suspended in gas discharge under laser irradiation when the nature and intensity of the active motion depend on the effect of radiation.

The Effect of Surface Processing on the Shear Strength of Cobalt-Chromium Dental Alloy and Ceramics.

Porcelain fused to metal is widespread dental prosthetic restoration. The survival rate of metal-ceramic restorations depends not only on the qualifications of dentists, dental technicians but also on the adhesive strength of ceramics to a metal frame. The goal of the research is to determine the optimal parameters of the surface machining of the metal frame to increase the adhesion of metal to ceramics.

Toward size-dependent thermodynamics of nanoparticles from quantum chemical calculations of small atomic clusters: a case study of (BO).

We present a method for obtaining canonical partition functions and, accordingly, temperature-dependent thermodynamics of arbitrary-sized (nano) particles from electronic structure calculations of the corresponding small size atomic clusters. The guiding idea here is to extrapolate the basic properties underlying the thermochemistry of clusters (electronic energies, rotational constants, and vibrational frequencies) rather than the thermodynamic functions themselves. The thus obtained scaling dependences for these basic properties expressed in a simple analytical form provide an efficient tool for fast evaluation of the size-selected thermochemical data for particles of any nuclearity.

Transverse Kerker effect in all-dielectric spheroidal particles.

Kerker effect is one of the unique phenomena in modern electrodynamics. Due to overlapping of electric and magnetic dipole moments, all-dielectric particles can be invisible in forward or backward directions. In our paper we propose new conditions between resonantly excited electric dipole and magnetic quadrupole in ceramic high index spheroidal particles for demonstrating transverse Kerker effect.

The Action of the Pulsed Electric Field of the Subnanosecond Range on Human Tumor Cells.

The action of the pulsed electric field of the subnanosecond range on Jurkat, HEK 293, and U-87 MG human cell lines was studied. The cells were treated in a waveguide in 0.18 ml electrodeless Teflon cuvettes.

The Degassing Processes for Oil Media in Acoustic Fields and Their Applications.

Numerous experiments on the effect of acoustic fields on oil media have shown the changing nature of oil physicochemical properties. In the present paper, we present a concept of internal airlift for oil medium with dissolved gas which could be propelled by external acoustic field. The mechanism determining gas bubble size as a function of pressure change is discussed.

Radiothermometric Study of the Effect of Amino Acid Mutation on the Characteristics of the Enzymatic System.

The radiothermometry (RTM) study of a cytochrome-containing system (CYP102 A1) has been conducted in order to demonstrate the applicability of RTM for monitoring changes in the functional activity of an enzyme in case of its point mutation. The study has been performed with the example of the wild-type cytochrome (WT) and its mutant type A264K. CYP102 A1 is a nanoscale protein-enzymatic system of about 10 nm in size.

Continuous Kubo-Greenwood formula: Theory and numerical implementation.

In this paper, we present the so-called continuous Kubo-Greenwood formula intended for the numerical calculation of the dynamic Onsager coefficients and, in particular, the real part of dynamic electrical conductivity. In contrast to the usual Kubo-Greenwood formula, which contains the summation over a discrete set of transitions between electron energy levels, the continuous one is formulated as an integral over the whole energy range. This integral includes the continuous functions: the smoothed squares of matrix elements, D(ɛ,ɛ+ℏω), the densities of state, g(ɛ)g(ɛ+ℏω), and the difference of the Fermi weights, [f(ɛ)-f(ɛ+ℏω)]/(ℏω).

Effect of asymmetric cooling of sessile droplets on orientation of the freezing tip.

Hypothesis: The shape of the "freezing tip" formed by the crystallization of water droplets demonstrated remarkable universality - no dependence on the cooling rate and physico-chemical properties of the substrate has been observed. At the same time, the spatial orientation of the freezing cone may be varied. We hypothesized that the orientation of the freezing tip is determined by the direction of heat flux at the base of the sessile droplet.

Experimental evolution of active Brownian grains driven by quantum effects in superfluid helium.

Complex structures, consisting of a large number of interacting subsystems, have the ability to self-organize and evolve, when the scattering of energy coming from the outside ensures the maintenance of stationary ordered structures with an entropy less than the equilibrium entropy. One of the fundamental problems here is the role of quantum phenomena in the evolution of macroscopic objects. We provide experimental evidence for the active Brownian motion and evolution of structures driven by quantum effects for micron-sized grains levitating in superfluid helium.

The Line of Ideal Isothermal Compressibility.

We have considered the line along which the values of the isothermal compressibility of a system are the same as they would be for an ideal gas. It was called the κ line. Various substances and models have been studied with the use of the multi-parameter equations of states, implemented in REFPROP (Lemmon, E.

Gas-liquid crossover in the Lennard-Jones system.

It is demonstrated that the crossover between gas- and liquid-like regions on the phase diagram of the Lennard-Jones system occurs at a fixed value of the density divided by its value at the freezing point, ρ/ρ ≃ 0.35. This definition is consistent with other definitions proposed recently.

Freezing Temperature and Density Scaling of Transport Coefficients.

It is demonstrated that the freezing density scaling of transport coefficients in fluids, similar to the freezing temperature scaling, originates from the quasi-universal excess entropy scaling approach proposed by Rosenfeld. The freezing density scaling has a considerably wider applicability domain on the phase diagram of Lennard-Jones and related systems. As an illustration of its predictive power, we show that it reproduces with an excellent accuracy the shear viscosity coefficients of saturated liquid argon, krypton, xenon, and methane.

Spatial distribution of dust density wave properties in fluid complex plasmas.

Complex plasmas consist of microparticles embedded in a low-temperature plasma and allow investigating various effects by tracing the motion of these microparticles. Dust density waves appear in complex plasmas as self-excited acoustic waves in the microparticle fluid at low neutral gas pressures. Here we show that various properties of these waves depend on the position of the microparticle cloud with respect to the plasma sheath and explain this finding in terms of the underlying ion-drift instability.

Dynamic Entropy of Two-Dimensional Active Brownian Systems in Colloidal Plasmas.

We analyze the experimental data on the motion of active Brownian micrograins in RF discharge plasmas. In the experiments, two types of microparticles were used: first-plastic grains fully covered with metal, and second-Janus particles with a thin metal cap. We have tracked the trajectories of the separate grains and plotted the pair correlation functions of the observed structures.

Prediction of Monomeric and Dimeric Structures of CYP102A1 Using AlphaFold2 and AlphaFold Multimer and Assessment of Point Mutation Effect on the Efficiency of Intra- and Interprotein Electron Transfer.

The three-dimensional structure of monomers and homodimers of CYP102A1/WT (wild-type) proteins and their A83F and A83I mutant forms was predicted using the AlphaFold2 (AF2) and AlphaFold Multimer (AFMultimer) programs, which were compared with the rate constants of hydroxylation reactions of these enzyme forms to determine the efficiency of intra- and interprotein electron transport in the CYP102A1 hydroxylase system. The electron transfer rate constants (), which determine the rate of indole hydroxylation by the CYP102A1 system, were calculated based on the distances (R) between donor-acceptor prosthetic groups (PG) FAD→FMN→HEME of these proteins using factor β, which describes an exponential decay from R the speed of electron transport (ET) according to the tunnelling mechanism. It was shown that the structure of monomers in the homodimer, calculated using the AlpfaFold Multimer program, is in good agreement with the experimental structures of globular domains (HEME-, FMN-, and FAD-domains) in CYP102A1/WT obtained by X-ray structural analysis, and the structure of isolated monomers predicted in AF2 does not coincide with the structure of monomers in the homodimer, although a high level of similarity in individual domains remains.

Invasion Into Sheep Kidney Epithelial Cells Depends on InlB, and Invasion Efficiency Is Modulated by Phylogenetically Defined InlB Isoforms.

The facultative intracellular pathogen is of major veterinary importance in small ruminants. Nevertheless, details of interactions with cells of small ruminants are not fully established. To study the potential of to infect sheep cells, we used the finite sheep kidney cell line (shKEC), which was infected with the wild-type strain EGDe.

Magnetic Nanomotors in Emulsions for Locomotion of Microdroplets.

The locomotion of droplets in emulsions is of practical significance for fields related to medicine and chemical engineering, which can be done with a magnetic field to move droplets containing magnetic materials. Here, we demonstrate a new method of droplet locomotion in the oil-in-water emulsion with the help of a nonuniform magnetic field in the case where magnetic nanoparticles (MNPs) are dispersed in the continuous phase of the emulsion. The paper analyses the motion of the droplets in a liquid film and in a capillary for various diameters of droplets, their number density, and viscosity of the continuous phase of the emulsion.