Search Results (471)

We developed a comparatively simple and inexpensive approach for the determination of the concentration of alcohols in water. The method is based on the study of the optical properties of ethoxylate trimethylolpropane triacrylate (ETPTA) inverse photonic crystals (IPhCs). The position of the transmission minimum associated with the first photonic stop band (PSB) is used as the analytical signal. The PSB position depends on the swelling degree of ETPTA photoresist and the refractive index of the tested alcohols and their mixtures with water. The signal increases linearly with increasing concentration of ethylene glycol and increases nonlinearly but monotonically with the concentration of methanol and ethanol in water. Sensitivity to alcohols, in the case of the ethylene glycol–water mixtures, reached about 0.55 nm/v.% or 560 nm/RIU (refractive index unit), which is sufficient for various applications in bio/chemical detection and environmental monitoring. Full article

We explore the dynamics and interactions of multiple bright droplets and bubbles, as well as the interactions of kinks with droplets and with antikinks, in the extended one-dimensional Gross–Pitaevskii model including the Lee–Huang–Yang correction. Existence regions are identified for the one-dimensional droplets and bubbles in terms of their chemical potential, verifying the stability of the droplets and exposing the instability of the bubbles. The limiting case of the droplet family is a stable kink. The interactions between droplets demonstrate in-phase (out-of-phase) attraction (repulsion), with the so-called Manton’s method explicating the observed dynamical response, and mixed behavior for intermediate values of the phase shift. Droplets bearing different chemical potentials experience mass-exchange phenomena. Individual bubbles exhibit core expansion and mutual attraction prior to their destabilization. Droplets interacting with kinks are absorbed by them, a process accompanied by the emission of dispersive shock waves and gray solitons. Kink–antikink interactions are repulsive, generating counter-propagating shock waves. Our findings reveal dynamical features of droplets and kinks that can be detected in current experiments. Full article

A theoretical analysis was conducted to examine the electronic and optical properties of a confined electron and a hole in a type-II core-shell spherical quantum dot composed of CdSe/ZnTe and ZnTe/CdSe. The Schrödinger equation for the electron and the hole was numerically solved using COMSOL-Multiphysics software in the 2D axisymmetric module, which employs the finite element method under the effective mass approximation. A Fortran code was utilized to calculate excitonic energy, specifically designed to solve the Coulomb integral. The calculations encompassed variations in the inner radius ($R_1$), as well as variations in the electric ($F_z$) and magnetic (B) fields along the z-axis. The absorption coefficients were determined for transitions between the hole and electron ground states, considering z-polarized incident radiation. Including a magnetic field increases the transition energy, consequently causing the absorption peaks to shift toward the blue region of the spectrum. On the other hand, the electric field decreased the overlap of the electron and hole wavefunctions. As a result, the amplitude of the absorption peaks decreased with an increase in the electric field. Full article

In this paper, we conducted the calculation of the critical current of DC SQUID based on the Josephson junction on a multi-band superconductor with frustration effect. It is shown that the critical current of DC SQUID on the frustrated multi-band superconductor with a small geometrical inductance of the loop is determined by the supercurrent amplitude in different channels and by the external magnetic field. In the case of a DC SQUID with high inductance, frustration effects can be ignored. Full article

Adiabatic compressibility β_S of the 4-methylpyridine + water solution is investigated in a wide concentration and temperature variation interval using Mandelstam–Brillouin scattering spectroscopy. The adiabatic compressibility minimum caused by the microinhomogeneous structure of the solution is experimentally established at the concentration of 0.06 molar fractions of 4-methylpyridine in the solution. The results of the investigations allow the construction of a diagram of possible states caused by a continuous three-dimensional hydrogen bond network of water. The results of experimental study of the excessive hypersound absorption in acetone + water and 3-methylpyridine + water solutions are discussed based on the conclusions of the theory of high-frequency sound scattering near the critical point (developed by Chaban) and the Landau theory. These results are described within the framework of the Landau and Chaban theories and explained by the existence of two different states with minimum thermodynamic stability in the solution. Full article

The physical mechanisms supporting the existence of topological interface modes in photonic structures, formed with the concatenation of two finite, N-period, one-dimensional photonic crystals, are investigated. It is shown that these mechanisms originate from a specific configuration of bands and bandgaps of topological origin in the band structure of the concatenated structure. Our analysis reveals that the characteristics of such a configuration depend on the structural parameters, including the number, N, of unit cells, and determine the properties of the corresponding resonant transmission peak. It was shown that the width and maximum value of the transmission peaks decrease with N. These results not only provide new physical insight into the origin and nature of such modes, but also can be used to control and manipulate the transmission peak properties, such as peak values, full width at half maximum (FWHM), and Q-factor, which are of special interest in the fields of optical sensing, filters, etc. Full article

Semiconductor nanowhiskers, particularly nanostructured whiskers based on zero-dimensional (0D) C₇₀ fullerene, are being actively discussed due to the great potential of their application in modern electronics. For the first time, we proposed and implemented a method for the synthesis of nanostructured C₇₀ fullerene whiskers based on the self-organization of C₇₀ molecules during the thermal evaporation of C₇₀ droplets on the substrate surface. We found that the onset of the synthesis of C₇₀ nanowhiskers upon the evaporation of drops of a C₇₀ solution in toluene on the substrate surface depends on the substrate temperature. We have provided experimental evidence that an increase in both the C₇₀ concentration in the initial drop and the substrate temperature leads to an increase in the geometric dimensions of C₇₀ nanowhiskers. The obtained results provide useful vision on the role of solute concentration and substrate temperature in the synthesis of one-dimensional materials. Full article

We present a comprehensive study on the structural, electronic, and optical properties of $V_{x}A{l}_{1-x}N$ ternary alloys using first-principles calculations. Our investigations employ the full-potential linearized augmented-plane-wave (FP-LAPW) method within the density functional theory (DFT) framework. The impact of varying vanadium composition (x = 0, 0.25, 0.5, 0.75, 1) on the structural, electronic, and optical characteristics of wurtzite $V_{x}A{l}_{1-x}N$ alloys is examined in detail. Our findings reveal a distinct nonlinear relationship between the lattice constant, bulk modulus, and the concentration of vanadium (x) in the $V_{x}A{l}_{1-x}N$ alloys. An analysis of the electronic band structures and densities of states reveals a metallic behavior in the $V_{x}A{l}_{1-x}N$ alloys, primarily driven by the V-d states near the Fermi energy. These results shed light on the electronic properties of the alloys, contributing to a deeper understanding of their potential for various applications. Furthermore, we calculate various optical properties, including the real and imaginary dielectric functions, refractive index, energy loss spectrum, and reflectivity. The obtained optical functions provide valuable insights into the optical behavior of the $V_{x}A{l}_{1-x}N$ alloys. The results contribute to the fundamental knowledge of these materials and their potential applications in various fields. Full article

The study of molecular nanoelectronic devices has recently gained significant interest, especially their potential use as functional junctions of molecular wires. Aromatic systems with $\pi$-conjugated bonds within their chemical backbones, such as catechol, have attracted particular attention in this area. In this work, we focused on calculating and determining catechol’s electrical and thermal transport properties using the theoretical method of Green’s functions renormalized in a real space domain within a framework of tight-binding approximation to the first neighbors. Thus, we studied two theoretical models of catechol as a function of its geometry, obtaining striking variations in the profiles of electrical and thermal conductance, the Seebeck coefficient, and the figure of merit. The analyses of the results suggest the potential application of catechol as a likely conductive and thermoelectric molecule serving as a novel material to use in molecular electronic devices. Full article

Recently, there has been a growing interest in two-dimensional van der Waals (vdW) magnets owing to their unique two-dimensional magnetic phenomena and potential applications. Most vdW ferromagnets have the Curie temperature below room temperature, highlighting the need to explore how to enhance their magnetism. In our previous report, we successfully increased the Curie temperature of the prototypical vdW magnet Cr₂Ge₂Te₆ using a NiO overlayer. In layered materials, the presence of wrinkles is often observed and evaluating them using optical microscopy proves to be useful; however, there have been limited investigations into the optical constants of vdW magnets, hampering progress in understanding their optical properties. In this study, we present the optical constants of Cr₂Ge₂Te₆ obtained through ellipsometry measurements. To account for the presence of wrinkles, we model a vacuum region between the substrate and the vdW magnet, and we calculate the reflectivity as a function of wavelength and vacuum thickness to visualize the optical image. Furthermore, we discuss the relationship between the optical constants and the electronic structure of the material. Full article

This paper deals with the results of quantum chemical modeling of the monoacyl-sn-glycerol 2D cluster formation at the air/water interface using a semi-empirical PM3 method. The impact of the 2 or 3 positions of the acyl substituent on the thermodynamics of the monolayer formation is assessed for surfactants with an acyl substituent C_nH_2n+1COO chain length of n = 6–17 carbon atoms. The calculation shows a significant change in the spontaneous clusterization threshold for isomeric compounds, which differs only in the position of the acyl substituent with respect to the glycerol backbone. This change is almost equal to substituent shortening by approximately two methylene fragments. At the same time, the geometric parameters of the unit cell for resulting monolayers are not affected so drastically. The 2D films in question possess an oblique or orthorhombic unit cell with parameters for 2 and 3-monoacyl-sn-glycerol monolayers, as follows: a = 4.91 Å and 4.82 Å and b = 5.00 Å and 4.92 Å, with hydrocarbon chains tilted at t = 23.0° and 23.5°. The calculated results are in accordance with existing experimental data obtained using grazing incidence X-ray diffraction measurements and the π-A isotherm technique. Full article

BaPb_1−xBi_xO₃ (BPBO) bismuthate, showing high T_C superconductivity for 0.05 < x < 0.35, is an archetypal system for studying the complex inhomogeneity of perovskite lattice favoring the emergence of quantum coherence, called the superstripes phase. Local lattice fluctuations, detected by EXAFS; nanoscale stripes, detected by electron microscopy; and two competing crystalline structures, detected by diffraction, are known to characterize the superconducting phase. At nanoscale [BaBiO₃] centered nanoscale units (BBO) coexist with BaPbO₃ centered (BPO) units in the BPBO perovskite; therefore, we expect a tensile microstrain in BPO units due the misfit strain between the two different lattices. Here, we report the measurement of the spatial micro-fluctuations of the local tensile microstrain ε in the BaPO units in superconducting Ba(Pb_1−xBi_x)O₃ crystals with x₁ = 0.19 an x₂ = 0.28. We show here the feasibility of applying the scanning dispersive micro-X-ray absorption near edge structure (SdμXANES) technique, using focused synchrotron radiation, to probe the microscale spatial fluctuations of the microstrain in BPO units. This unconventional real-space SdμXANES microscopy at the Pb L₃ edge has been collected in the dispersive mode. Our experimental method allows us to measure either the local Bi chemical concentration x and the local lattice microstrain of local BBO and BPO units. The 5 × 5 micron-size spots from the focused X-ray beam allowed us to obtain maps of 1600 points covering an area of 200 × 200 microns. The mapping shows a substantial difference between the spatial fluctuations of the microstrain ε and the chemical inhomogeneity x. Moreover, we show the different relations ε(x) in samples with lower (x₁ = 0.19) and higher (x₂ = 0.28) doping respect to the optimum doping (x = 0.25). Full article

In order to elucidate the unusual superconducting properties of cuprates in the strongly overdoped region, i.e., at hole-doping levels $p\gtrsim 0.4$/Cu in the CuO${}_2$ plane, we study the structural and superconducting properties of a series of Cu${}_{0.75}$Mo${}_{0.25}$Sr${}_2$YCu${}_2$O${}_{7+x}$ powder samples oxygenated under high pressure using different concentrations of KClO${}_3$ up to 35 mol %. The analysis of X-ray diffraction data indicates a high purity ∼90% of all samples and suggests that the concentration, x, of extra oxygen atoms increases with increasing KClO${}_3$ concentration. Surprisingly, the $T_c$ values remain nearly constant within the 80–85 K range independent of KClO${}_3$ concentration, which suggests a scenario of $T_c$ saturation. In order to account for this unexpected behaviour, we put forward the hypothesis that overdoping enhances the density of unpaired holes, which is supported by the observation of large values of the Sommerfeld coefficient in all samples. We therefore propose a scenario of electronic phase separation between normal and superconducting holes. Full article

Taking into consideration the research that has been conducted on the optical and electrical properties of molecular systems, especially the good thermoelectric energy conversion at a nanometric scale that such systems have presented, here we present a new alternative by using a particular diphenyl-ether molecule as a functional device. Such a molecular system is modeled as a planar segment coupled to two electrodes in the first-neighbor approximation within a tight-binding Hamiltonian. We study the electrical and thermal properties of diphenyl-ether molecules such as the electric current, electrical and thermal conductance, Seebeck coefficient, and figure of merit, in the strong and weak coupling regimes, considering different structural configurations and variations with temperature. Our results could be valuable for laboratory applications and/or verification since we characterize the diphenyl-ether molecule as a semiconductor device for different structural models. Full article

Increasing experimental evidence suggests the occurrence of filamentary superconductivity in different (quasi) two-dimensional physical systems. In this piece of work, we discuss the proposal that under certain circumstances, this occurrence may be related to the competition with a phase characterized by charge ordering in the form of charge-density waves. We provide a brief summary of experimental evidence supporting our argument in two paradigmatic classes of materials, namely transition metal dichalcogenides and cuprates superconductors. We present a simple Ginzburg–Landau two-order-parameters model as a starting point to address the study of such competition. We finally discuss the outcomes of a more sophisticated model, already presented in the literature and encoding the presence of impurities, and how it can be further improved in order to really address the interplay between charge-density waves and superconductivity and the possible occurrence of filamentary superconductivity at the domain walls between different charge-ordered regions. Full article