Theory of the microstructure of disordered <Emphasis Type="Italic">AA</Emphasis>′BO<Subscript>3</Subscript> and <Emphasis Type="Italic">ABB</Emphasis>′O<Subscript>3</Subscript> perovskite-structure solid solutions

A model is considered in which atoms A and A′ or B and B′ of disordered solid solutions A _x A _1?x ^′ BO₃ and AB _x B _1?x ^′ O₃ are distributed over a regular system of points 1(a) and 1(b) of the symmetry group O _h ¹ characterizing the ideal perovskite structure. The probabilities P(G _i |x) of unit cells having crystal-field symmetry at their center lowered to G _i =T _d , D_3d, C_3v, C_4v, D_2h, C_2v, C _s , or C₂ are calculated as a function of the concentration x. The limits for x in which the Jahn-Teller and/or dipole ordering mechanism is probable are determined. In the approximation taking into account only effective pair interactions, the scattering amplitude F _hkl is found to depend on a single parameter r₀. The theory predicts that the dependence of the intensities of even and odd reflections on sin θ/λ is nonmonotonic and that the distributions of nonuniform strains and of values of the lattice parameters in solid solutions are discrete.     

Anisotropic<Emphasis Type="Italic">s</Emphasis>-wave or<Emphasis Type="Italic">d</Emphasis>-wave pairing? Analysis of experiments on ion irradiation of YBa<Subscript>2</Subscript>Cu<Subscript>3</Subscript>O<Subscript>7-x</Subscript> films

The effect of ion irradiation on the superconducting transition temperatureT _c and resistivityρ _ab (T) of YBa₂Cu₃O_7-x films with different oxygen content (initial temperatureT _c0≈90 K and 60 K) is studied experimentally. The dependenciesT _c /T _c0 on residual resistivityρ _o are obtained in very wide range 0.2<T _c /T _c0 <1 andρ _o μΩ·cm. The critical values ofρ _o , corresponding to the vanishing of superconductivity, are found to be an order of magnitude larger then those predicted by theory ford-wave pairing. At 0.5÷0.6<T _c /T _c0<1 the experimental data are in close agreement with theoretical dependencies, obtained for the anisotropics-wave superconductor within the BCS-framework.     

Quark-antiquark composite systems: The Bethe-Salpeter equation in the spectral-integration technique

The Bethe-Salpeter equations for the quark-antiquark composite systems, q\(\bar q\), are written in terms of spectral integrals. For the q\(\bar q\) mesons characterized by the mass M, spin J, and radial quantum number n, the equations are presented for the following (n, M²) trajectories: π _J , η _J , a _J , f _J , ρ _J , ω _J , h _J , and b _J .     

Testing the Distance-Duality Relation from Hubble,Galaxy Clusters and Type Ia Supernovae Data with Model Independent Methods

In this paper, we perform cosmological-model-independent tests for the distance-duality (DD) relation η(z)=D _L(1+z)^?2/D _A by combining the angular diameter distance D _A(or comoving distances D _c ) with the luminosity distance D _L. The D _A are provided by two galaxy clusters samples compiled by De Filippis et al. (the elliptical β model), Bonamente et al. (the spherical β model), the D _c are obtained from Hubble parameter data and D _L are given from the Union2.1 supernovae (SNe) Ia compilation. We employ two methods, i.e., method A: binning the SNe Ia data within the range Δz=|z?z _SNe|<0.005, and method B: reconstructing the D _L(z) by smoothing the noise of Union2.1 data set over redshift with the Gaussian smoothing function, to obtain D _L associated with the redshits of the observed D _A or D _c. Four parameterizations for η(z), i.e., η(z)=1+η ₀ z, η(z)=1+η ₀ z/(1+z), η(z)=1+η ₀ z/(1+z)² and η(z)=1?η ₀ ln(1+z), are adopted for the DD relation. We find that DD relation is consistent with the present observational data, and the results we obtained are not sensitive to the method and parameterization.     

Density functional study of $$\hbox {AgScO}_2$$: Electronic and optical properties

Dielectric relaxation studies of binary (jk) polar mixtures of tetrahydrofuran with N-methyl acetamide, N,N-dimethyl acetamide, N-methyl formamide and N,N-dimethyl formamide dissolved in benzene(i) for different weight fractions (w _{j k} ’s) of the polar solutes and mole fractions (x _j ’s) of tetrahydrofuran at 25 ^°C are attempted by measuring the conductivity of the solution under 9.90 GHz electric field using Debye theory. The estimated relaxation time (τ _{j k} ’s) and dipole moment (μ _{j k} ’s) agree well with the reported values signifying the validity of the proposed methods. Structural and associational aspects are predicted from the plot of τ _{j k} and μ _{j k} against x _j of tetrahydrofuran to arrive at solute–solute (dimer) molecular association upto x _j =0.3 of tetrahydrofuran and thereafter solute–solvent (monomer) molecular association upto x _j =1.0 for all systems except tetrahydrofuran + N,N-dimethyl acetamide.     

Scattering the Geometry of Weighted Graphs

Given two weighted graphs (X, b_k, m_k), k =?1,2 with b₁ ～ b₂ and m₁ ～ m₂, we prove a weighted L¹-criterion for the existence and completeness of the wave operators W_±(H₂, H₁, I_1,2), where H_k denotes the natural Laplacian in ?²(X, m_k) w.r.t. (X, b_k, m_k) and I_1,2 the trivial identification of ?²(X, m₁) with ?²(X, m₂). In particular, this entails a general criterion for the absolutely continuous spectra of H₁ and H₂ to be equal.     

Variations in thermal properties of diamond under isothermal compression

State equation P(V/V ₀, T) and baric dependences of thermal properties of diamond have been obtained without any fitting parameters from the interatomic pair Mie–Lennard-Jones potential and the Einstein model of a crystal. Calculations have been performed along two isotherms (at T = 300 and 3000 K) up to P = 10000 kbar = 1000 GPa, i.e., to a relative volume of V/V ₀ = 0.5. The baric dependences have been obtained for the following characteristics: isothermal elastic modulus B _T and B'(P), isochoric heat capacity C _v and C _v ' (P), isobaric heat capacity C _p ; thermal expansion coefficient α _p and α _p ' (P); and specific surface energy σ, as well as its derivatives σ'(P) and σ'(T). It is shown that for P → ∞, functions B _T (P) and σ(P) vary linearly, functions B'(P), α _p (P), C _v (P), C _p (P) and σ'(P) tend to constants, while functions α _p '(P), C _v '(P), and difference C _p (P)–C _v (P) tend to zero. Good agreement with experimental data has been demonstrated.     

<Emphasis Type="Italic">M</Emphasis>α and <Emphasis Type="Italic">M</Emphasis>β X-ray emission spectra of Au atoms upon photoionization of <Emphasis Type="Italic">L</Emphasis> subshells

The structure and relative intensity of the Mα and Mβ X-ray fluorescence spectra of Au atoms are studied experimentally at the energies of absorbed photons both below and above the ionization thresholds of L subshells (Kα_{1, 2} radiation of Cr, Cu, and Mo). The M ₅ N and M ₄ N high-energy satellites are separated from the total spectral profiles and their relative intensities are determined. A model of the M emission is proposed that allows one to take into account the main channels of vacancy transfer from L to M subshells, which are responsible for the generation of double vacancy (M _{4, 5} N and M _{4, 5} O) and triple vacancy (M _{4, 5} N ², M _{4, 5} NO, and M _{4, 5} O ²) states. Comparison of the experimental relative intensities of separated M ₅ N and M ₄ N satellites excited by the Mo Kα_{1, 2} radiation with the calculated results indicates the correctness of the model used. The partial and total M emission cross sections of Au in the absorbed photon energy range of 5–30 keV are calculated. It is found that, in the photon energy region above the ionization threshold of the L ₃ subshell, our results noticeably differ from the data calculated by other authors. Possible reasons for these discrepancies are discussed.     

Extremal Theory for Spectrum of Random Discrete Schrödinger Operator. II. Distributions with Heavy Tails

We study the asymptotic structure of the first K largest eigenvalues λ _k,V and the corresponding eigenfunctions ψ(?;λ _k,V ) of a finite-volume Anderson model (discrete Schrödinger operator) \(\mathcal{H}_{V}= \kappa \Delta_{V}+\xi(\cdot)\) on the multidimensional lattice torus V increasing to the whole of lattice ? ^ν , provided the distribution function F(?) of i.i.d. potential ξ(?) satisfies condition ?log(1?F(t))=o(t ³) and some additional regularity conditions as t→∞. For z∈V, denote by λ ⁰(z) the principal eigenvalue of the “single-peak” Hamiltonian κΔ _V +ξ(z)δ _z in l ²(V), and let \(\lambda^{0}_{k,V}\) be the kth largest value of the sample λ ⁰(?) in V. We first show that the eigenvalues λ _k,V are asymptotically close to \(\lambda^{0}_{k,V}\). We then prove extremal type limit theorems (i.e., Poisson statistics) for the normalized eigenvalues (λ _k,V ?B _V )a _V , where the normalizing constants a _V >0 and B _V are chosen the same as in the corresponding limit theorems for \(\lambda^{0}_{k,V}\). The eigenfunction ψ(?;λ _k,V ) is shown to be asymptotically completely localized (as V↑?) at the sites z _k,V ∈V defined by \(\lambda^{0}(z_{k,V})=\lambda^{0}_{k,V}\). Proofs are based on the finite-rank (in particular, rank one) perturbation arguments for discrete Schrödinger operator when potential peaks are sparse.     

Fundamental Entangling Operators in Quantum Mechanics and Their Properties

For the first time, we introduce so-called fundamental entangling operators \(e^{iQ_{1} P_{2}}\) and \(e^{iP_{1} Q_{2} }\) for composing bipartite entangled states of continuum variables, where Q_i and P_i (i = 1, 2) are coordinate and momentum operator, respectively. We then analyze how these entangling operators naturally appear in the quantum image of classical quadratic coordinate transformation (q₁, q₂) → (Aq₁ + Bq₂, Cq₁ + Dq₂), where AD?BC = 1, which means even the basic coordinate transformation (Q₁, Q₂) → (AQ₁ + BQ₂, CQ₁ + DQ₂) involves entangling mechanism. We also analyse their Lie algebraic properties and use the integration technique within an ordered product of operators to show they are also one- and two- mode combinatorial squeezing operators.     

Change in the lattice properties and melting temperature of a face-centered cubic iron under compression

All four parameters of the Mie–Lennard-Jones pair interatomic potential have been determined, and the state equation (P) and baric dependences of the lattice properties of an fcc iron are calculated using a previously proposed method. The dependences have been studied for the following properties: Debye temperature; the first, second, and third Gruneisen parameters; isothermal bulk modulus B _T and B′(P); isochoric specific heat C _v and C _v ′(P); isobaric specific heat C _p ; coefficient of thermal expansion α _p and α _p ′(P); specific surface energy σ and σ′(P). Calculations performed along two isotherms (1500 and 3000 K) have shown good agreement with the experimental data. Analytical approximations of the baric dependences for B′(P), α _p (P), C _p (P), and σ′(P) have been obtained, and it is shown that at P → ∞ the functions B _T (P) and σ(P) change linearly, while the functions α _p′(P) and C _p ′(P) tend to zero. The calculated baric dependence of the melting temperature shows good agreement with the experimental data.     

Reciprocal Time Relation of Noncolliding Brownian Motion with Drift

We consider an N-particle system of noncolliding Brownian motion starting from x ₁≤x ₂≤…≤x _N with drift coefficients ν _j , 1≤j≤N satisfying ν ₁≤ν ₂≤…≤ν _N . When all of the initial points are degenerated to be zero, x _j =0, 1≤j≤N, the equivalence is proved between a dilatation with factor 1/t of this drifted process and the noncolliding Brownian motion starting from ν ₁≤ν ₂≤…≤ν _N without drift observed at reciprocal time 1/t, for arbitrary t>0. Using this reciprocal time relation, we study the determinantal property of the noncolliding Brownian motion with drift having finite and infinite numbers of particles.     

Effect of the Lattice and Spin-Phonon Contributions on the Temperature Behavior of the Ground State Splitting of Gd<Superscript>3+</Superscript> in SrMoO<Subscript>4</Subscript>

The temperature behavior of the EPR spectra of the Gd³⁺ impurity center in single crystals of SrMoO₄ in the temperature range T = 99–375 K is studied. The analysis of the temperature dependences of the spin Hamiltonian b ₂ ⁰ (T) = b₂(F) + b₂(L) and P ₂ ⁰ (T) = P₂(F) + P₂(L) (for Gd¹⁵⁷) describing the EPR spectrum and contributing to the Gd³⁺ ground state splitting ΔE is carried out. In terms of the Newman model, the values of b₂(L) and P₂(L) depending on the thermal expansion of the static lattice are estimated; the b₂(F) and P₂(F) spin-phonon contributions determined by the lattice ion oscillations are separated. The analysis of b ₂ ⁰ (T) and P ₂ ⁰ (T) is evidence of the positive contribution of the spin-phonon interaction; the model of the local oscillations of the impurity cluster with close frequencies ω describes well the temperature behavior of b₂(F) and P₂(F).     

High-resolution X-ray emission <Emphasis Type="Italic">M</Emphasis>α and <Emphasis Type="Italic">M</Emphasis>β spectra of Bi atoms

The structure and relative intensity of x-ray fluorescence Mα and Mβ spectra of Bi atoms have been studied experimentally under excitation by Cr and Cu Kα_1,2 radiation. It has been found that observed short-wavelength satellites are mostly caused by the radiative transitions M ₅ N-N _6,7 N (M ₅ N satellites) and M ₄ N-N ₆ N (M ₄ N satellites), whereas the transitions M ₅ O-N _6,7 O and M ₄ O-N ₆ O are overlapped with the profiles of x-ray diagram Mα_1,2 and Mβ lines and are not observed as individual structures. The M ₅ N and M ₄ N satellites have been separated from total spectral profiles, and the relative intensities of such groups of lines have been determined. A model has been proposed for calculation of emission cross sections of the M ₄ N and M ₄ N satellites, as well as the Mα_1,2 lines along with the M ₅ O satellites and the Mβ line with the M ₄ O satellites. The model takes into account main channels of generation and migration of vacancies in M subshells connected with the Coster-Kronig transitions M _i -M _j N and M _i -M _j O, radiative transitions M _i -M _j and M _i -N _j , and shaking processes upon production of the M _i vacancy, as well as with cascades of such processes. Comparison of experimental values of the relative intensity of the separated satellites with calculated results indicates the correctness of the model used.     

The structure of a vortex line and the lower critical field in superconducting alloys

The structure of an isolated vortex line, and the lower critical fieldH _c 1, is calculated by means of the generalized Ginzburg-Landau (GL) theory for arbitrary values of the GL-parameterk(≧1/√2) and the mean free pathl at temperaturesT in the vicinity ofT _c . The free energy functional including the corrections of order [1?(T/T _c )] to the GL-functional is derived exactly. The corresponding Euler-Lagrange equations determining the zero-order (GL) contributions and the corrections of order [1?(T/T _c )] to the order parameter,f(r), and the superfluid velocity,v(r), have been solved numerically. The shapes of the first-order corrections off(r), v(r), and the magnetic field,h(r) are found to depend markedly, for a given value ofκ, on a second parameter,α=0.882(ξ ₀ /l) (whereξ ₀ is theBCS-coherence-distance). The deviations from the GL-solutions become largest forh(r) at parameter valuesk≈ 1 andα ≈ 0(the deviation ofh(0) is about 6% atT=0.9T _c forκ=1 andα=0). The ratioH _c1/H _c (where the thermodynamic criticalH _c has the BCS-temperature-dependence) is found to increase slightly in the “clean” limit (α=0), and to decrease slightly in the “dirty” limit (α=∞) asT decreases (the variation ofH _c 1/H _c is always less than 3% for arbitrary values ofκ andα asT decreases fromT _c to 0.9T _c ).     

Probing the sign-changeable interaction between dark energy and dark matter with current observations

We consider the models of vacuum energy interacting with cold dark matter in this study, in which the coupling can change sigh during the cosmological evolution. We parameterize the running coupling b by the form b(a) = b_0 a + b_e(1-a), where at the earlytime the coupling is given by a constant b_e and today the coupling is described by another constant b_0. We explore six specific models with(i) Q = b(a)H_0ρ_0,(ii) Q = b(a)H_0ρ_(de),(iii) Q = b(a)H_0ρ_c,(iv) Q = b(a)Hρ_0,(v) Q = b(a)Hρ_(de), and(vi) Q = b(a)Hρ_c.The current observational data sets we use to constrain the models include the JLA compilation of type Ia supernova data, the Planck 2015 distance priors data of cosmic microwave background observation, the baryon acoustic oscillations measurements,and the Hubble constant direct measurement. We find that, for all the models, we have b_0 0 and b_e 0 at around the 1σ level,and b_0 and b_e are in extremely strong anti-correlation. Our results show that the coupling changes sign during the evolution at about the 1σ level, i.e., the energy transfer is from dark matter to dark energy when dark matter dominates the universe and the energy transfer is from dark energy to dark matter when dark energy dominates the universe.     

Exact expressions for the energy current and stress tensor operators in many-particle systems

For some purposes in statistical physics, such as, for example, the calculation of various transport coefficients, it is necessary to have expressions for the energy current operatorS and stress tensor operatorT _lm . In this work it is shown that by using a simple identity, exact expressions forS andT _lm which satisfy the conservation laws for the energy density? and momentum densityP, respectively, exist.S andT _lm can each be written as a sum of two parts,S=S ^(A) +S ^(B) T _lm =T _lm ^(A) +T _lm ^(B) . The “A” part is the ordinary convective or kinetic part while the “B” part is shown to be expressible as a gradient and hence its homogeneous component vanishes identically. The expressions are compared with approximate forms found in the literature. The operators are Fourier analyzed and written in terms of the field operators in the second quantization formalism.     

Electro-optical properties of strontium-barium niobate crystals and their relation to the domain structure of the crystals

The electro-optical coefficients r _ij and half-wave voltage V_λ/2 of strontium-barium niobate crystals poled in the ferroelectric phase are shown to vary along the polar axis. The r _ij (z) and V_λ/2(z) dependences indicate the presence of a residual domain density D(z) and clearly depend on the sign of the polarizing field, with r _ij being minimum (D being maximum) near the negative electrode. This character of the D(z) distribution and, hence, the r _ij (z) and V_λ/2(z) coordinate dependences can be explained by predominant domain nucleation near the negative electrode, which is revealed when the switching processes are studied using 90° (Rayleigh) light scattering from domain walls.     

Quantifying Correlations via the Wigner-Yanase-Dyson Skew Information

In this paper, based on a discussion about the Wigner-Yanase-Dyson (WYD) skew information, the measure F_a,α(ρ_ab) for correlations in terms of the WYD skew information is introduced and discussed. The following conclusions are obtained. For a classical-quantum state ρ_ab, F_a,α(ρ_ab)=0 if and only if ρ_ab is a product state; F_a,α(ρ_ab) is locally unitary invariant and convex on the set of states with the fixed marginal ρ_a; F_a,α(ρ_ab) decreases under local random unitary operation on H_b; For a quantum-classical state ρ_ab, F_a,α(ρ_ab) decreases under local operation on H_b; Lastly, F_a,α(ρ_ab) is computed for the pure states and the Bell-diagonal states, respectively.