Dimension of an optimum impurity cluster and multiple-occupancy corrections in the theory of scattering of vibrational excitations in a solid solution

A relationship is derived for the correlation length L determining the size of the region in a solid solution in which excitations are scattered coherently. The correlation length depends on the fraction of impurity atoms x in the solid solution and the lattice dimension d. In the physical analysis of single-particle scattering processes in the solid solution and calculations, it is sufficient to take into account clusters with the number of cells n corresponding to the correlation volume L ^d . A theoretical analysis is illustrated by calculations of the spectral functions of the solid solution at different values of x and n. The multiple-occupancy corrections (polynomials in powers of x) to scattering diagrams are calculated using the method of sequential breaking apart of the interaction lines in the diagrams for the self-energy part. The method used was previously applied to the case of scattering by a single impurity. In this paper, the efficiency of the method is checked for scattering by multi-impurity clusters. It is demonstrated that the method can be useful in analyzing and estimating the contributions of scattering diagrams.     

Coordinate asymptotic behavior of the radial three-particle wave function for a bound state involving two charged particles

The asymptotic expression for the radial component of the wave function for a three-particle bound state involving two charged particles is derived in an explicit form. This expression contains a three-particle asymptotic normalization factor C(φ), where φ is a hyperangle in the six-dimensional space of intrinsic coordinates of the three-particle system. The resulting expressions are used to analyze the asymptotic behavior of the wave functions for the ⁹Be nucleus that were calculated within the α + α + n three-particle model for various forms of the an potential. A comparison of the asymptotic expression derived here and the asymptotic expressions for model wave functions makes it possible to extract C(φ) values, which turned out to be sensitive to the form of αn interaction. This permits deducing information about two-particle interaction from a comparison of the theoretical values of C(α) with their phenomenological counterparts found from an analysis of experimental differential cross sections for relevant nuclear reactions.     

Screened self-energy correction to the 2<Emphasis Type="Italic">p</Emphasis><Subscript>3/2</Subscript>-2<Emphasis Type="Italic">s</Emphasis> transition energy in Li-like ions

We present an ab initio calculation of the screened self-energy correction for 1s² 2p_3/2 and 1s² 2s states of Li-like ions with nuclear charge numbers in the range Z = 12?100. The evaluation is carried out to all orders in the nuclear strength parameter Zα. This investigation concludes our calculations of all two-electron QED corrections for the 2p_3/2-2s transition energy in Li-like ions and thus considerably improves theoretical predictions for this transition for high-Z ions.     

Temperature dependence of dark current-voltage characteristics of <Emphasis Type="Italic">n</Emphasis>InSb-<Emphasis Type="Italic">n</Emphasis>PbTe-<Emphasis Type="Italic">n</Emphasis>CdTe isotype structure

The temperature dependence of dark current-voltage characteristics of an nInSb-nPbTe-nCdTe structure is investigated. It is shown that in the temperature range from 115 K to 125 K an energy barrier exists for charge carriers through the InSb layer, which is strictly connected with different temperature dependences of electron concentrations in nInSb and nPbTe.     

Restricting Positive Energy Representations of Diff<Superscript>+</Superscript>(<Emphasis Type="Italic">S</Emphasis><Superscript>1</Superscript>) to the Stabilizer of <Emphasis Type="Italic">n</Emphasis> Points

Let G _n ? Diff⁺(S ¹) be the stabilizer of n given points of S ¹. How much information do we lose if we restrict a positive energy representation \(U^c_h\) associated to an admissible pair (c, h) of the central charge and lowest energy, to the subgroup G _n ? The question, and a part of the answer originate in chiral conformal QFT. The value of c can be easily “recovered” from such a restriction; the hard question concerns the value of h. If c ≤ 1, then there is no loss of information, and accordingly, all of these restrictions are irreducible. In this work it is shown that \(U^c_{h}|_{G_n}\) is always irreducible for n =  1 and, if h =  0, it is irreducible at least up to n ≤  3. Moreover, an example is given for c >  2 and certain values of \(h \neq \tilde{h}\) such that \(U^c_{h}|_{G_1}\simeq U^c_{\tilde{h}}|_{G_1}\) . It is also concluded that for these values \(U^c_{h}|_{G_n}\) cannot be irreducible for n ≥  2. For further values of c, h and n, the question is left open. Nevertheless, the example already shows that, on the circle, there are conformal QFT models in which local and global intertwiners are not equivalent.     

Intuitionistic Quantum Logic of an <Emphasis Type="Italic">n</Emphasis>-level System

A decade ago, Isham and Butterfield proposed a topos-theoretic approach to quantum mechanics, which meanwhile has been extended by Döring and Isham so as to provide a new mathematical foundation for all of physics. Last year, three of the present authors redeveloped and refined these ideas by combining the C*-algebraic approach to quantum theory with the so-called internal language of topos theory (Heunen et al. in arXiv:0709.4364). The goal of the present paper is to illustrate our abstract setup through the concrete example of the C*-algebra M _n (?) of complex n×n matrices. This leads to an explicit expression for the pointfree quantum phase space Σ _n and the associated logical structure and Gelfand transform of an n-level system. We also determine the pertinent non-probabilisitic state-proposition pairing (or valuation) and give a very natural topos-theoretic reformulation of the Kochen–Specker Theorem.In our approach, the nondistributive lattice ?(M _n (?)) of projections in M _n (?) (which forms the basis of the traditional quantum logic of Birkhoff and von Neumann) is replaced by a specific distributive lattice \(\mathcal{O}(\Sigma_{n})\) of functions from the poset \(\mathcal{C}(M_{n}(\mathbb{C}))\) of all unital commutative C*-subalgebras C of M _n (?) to ?(M _n (?)). The lattice \(\mathcal{O}(\Sigma_{n})\) is essentially the (pointfree) topology of the quantum phase space Σ _n , and as such defines a Heyting algebra. Each element of \(\mathcal{O}(\Sigma_{n})\) corresponds to a “Bohrified” proposition, in the sense that to each classical context \(C\in\mathcal{C}(M_{n}(\mathbb{C}))\) it associates a yes-no question (i.e. an element of the Boolean lattice ?(C) of projections in C), rather than being a single projection as in standard quantum logic. Distributivity is recovered at the expense of the law of the excluded middle (Tertium Non Datur), whose demise is in our opinion to be welcomed, not just in intuitionistic logic in the spirit of Brouwer, but also in quantum logic in the spirit of von Neumann.     

Generating Function for GL<Subscript><Emphasis Type="Italic">n</Emphasis></Subscript>-Invariant Differential Operators in the Skew Capelli Identity

Let Alt _n be the vector space of all alternating n × n complex matrices, on which the complex general linear group GL _n acts by \({x \mapsto gxg^t}\). The aim of this paper is to show that Pfaffian of a certain matrix whose entries are multiplication operators or derivations acting on polynomials on Alt _n provides a generating function for the GL _n -invariant differential operators that play an essential role in the skew Capelli identity, with coefficients the Hermite polynomials.     

Mechanism of charge transfer in <Emphasis Type="Italic">n</Emphasis>-CdS/<Emphasis Type="Italic">p</Emphasis>-CdTe heterojunctions

The capacitance-voltage and current-voltage characteristics of the n-CdS/p-CdTe heterosystem are investigated. Analysis of these characteristics demonstrates that the CdTe_1?x S _x solid solution formed at the n-CdS/p-CdTe heterointerface is inhomogeneous in both the conductivity and composition. The thickness of solid solutions is estimated from the capacitance-voltage characteristics. It is shown that, for the n-CdS/p-CdTe heterosystem, the current-voltage characteristic in the current density range 10^?8-10^?5 A cm^?2 is governed by the thermal electron emission, whereas the current in the heterostructure at current densities in the range 10^?4-10^?2 A cm^?2 is limited by recombination of charge carriers in the electroneutral region of the CdTe_1?x S _x solid solution. The lifetime and the diffusion length of minority charge carriers in the CdTe_1?x S _x solid solution and the surface recombination rate at the interface between the CdS layer and the CdTe_1?x S _x solid solution are determined. It is demonstrated that the n-CdS/p-CdTe heterostructure operates as a p-i-n structure in which CdTe is a p layer, CdTe_1?x S _x is an i layer, and CdS is an n layer.     

Spectra and mean energies of prompt neutrons from <Superscript>238</Superscript>U fission induced by primary neutrons of energy in the region <Emphasis Type="Italic">E</Emphasis><Subscript><Emphasis Type="Italic">n</Emphasis></Subscript><20 MeV

The time-of-flight technique is used to measure the ratios R(E, E _n )=N(E, E _n )/N_Cf(E) of the normalized (to unity) spectra N(E, E _n ) of neutrons accompanying the neutron-induced fission of ²³⁸U at primary-neutron energies of E _n =6.0 and 7.0 MeV to the spectrum N_Cf(E) neutrons from the spontaneous fission of ²⁵²Cf. These experimental data and the results of their analysis are discussed together with data that were previously obtained for the neutron-induced fission of ²³⁸U at the primary energies of E _n =2.9, 5.0, 13.2, 14.7, 16.0, and 17.7 MeV.     

Two-loop self-energy correction in a strong Coulomb nuclear field

The two-loop self-energy correction to the ground-state energy levels of hydrogen-like ions with nuclear charges Z≥10 is calculated without the Zα expansion, where α is the fine-structure constant. The data obtained are compared with the results of analytical calculations within the Zα expansion; significant disagreement with the analytical results of order α²(Zα)⁶ has been found. Extrapolation is used to obtain the most accurate value for the two-loop self-energy correction for the 1s state in hydrogen.     

Dynamical screening of AMM and QED effects for large-<Emphasis Type="Italic">Z</Emphasis> hydrogen-like atoms

The effective interaction ΔU_AMM of the anomalous magnetic moment (AMM) of an electron with the Coulomb field of an extended nucleus is analyzed. As soon as the q² dependence of the electron formfactor F₂(q²)is taken into account from the beginning, the AMM is found to be dynamically screened at small distances of r ? 1/m. The ΔU_AMM effects on the low-lying electronic levels of a superheavy extended nucleus with Zα > 1are analyzed using the nonperturbative approach. The growth rate of the ΔU_AMM contribution with increasing Z is shown to be essentially nonmonotonic. At the same time, the energy shifts of electronic levels in the vicinity of the threshold of the lower continuum monotonically decrease in the region Z ?Z_cr,1s. The latter result is generalized to the whole self-energy contribution to energy shifts of electronic levels, thus also referring to the possible behavior of QED radiative effects with virtual-photon exchange, considered beyond the framework of the perturbative expansion in Zα.     

Refractometry of mechanically compressed (NH<Subscript>4</Subscript>)<Subscript>2</Subscript>SO<Subscript>4</Subscript> crystals

The effect of uniaxial mechanical pressure σ _m ≤ 150 bar on the spectral (300–800 nm) dependence of the birefringerence Δn _i and refractive indices n _i of (NH₄)₂SO₄ crystals has been investigated. It is shown that the dispersion of n _i (λ) and Δn _i (λ) is normal and sharply increases with approach to the absorption edge. It is established that uniaxial pressure does not change the character of the dispersions dn _i /dλ and dΔn _i /dλ and only affects their magnitudes. It is shown that the increase in the refractive indices under uniaxial stress is mainly due to the increase in the refraction caused by the increase in the band gap and long-wavelength shift of the UV absorption band maximum.     

Electron gas induced in SrTiO<Subscript>3</Subscript>

This mini-review is dedicated to the 85th birthday of Prof. L.V. Keldysh, from whom we have learned so much. In this paper, we study the potential and electron density depth profiles in surface accumulation layers in crystals with a large and nonlinear dielectric response such as SrTiO₃ (STO) in the cases of planar, spherical, and cylindrical geometries. The electron gas can be created by applying an induction D₀ to the STO surface. We describe the lattice dielectric response of STO using the Landau–Ginzburg free energy expansion and employ the Thomas–Fermi (TF) approximation for the electron gas. For the planar geometry, we arrive at the electron density profile n(x) ∝ (x + d)^–12/7, where d ∝ D₀^–12/7. We extend our results to overlapping electron gases in GTO/STO/GTO heterojunctions and electron gases created by spill-out from NSTO (heavily n-type doped STO) layers into STO. Generalization of our approach to a spherical donor cluster creating a big TF atom with electrons in STO brings us to the problem of supercharged nuclei. It is known that for an atom with a nuclear charge Ze where Z > 170, electrons collapse onto the nucleus, resulting in a net charge Zn < Z. Here, instead of relativistic physics, the collapse is caused by the nonlinear dielectric response. Electrons collapse into the charged spherical donor cluster with radius R when its total charge number Z exceeds the critical value Z_c ≈ R/a, where a is the lattice constant. The net charge eZ_n grows with Z until Z exceeds Z* ≈ (R/a)^9/7. After this point, the charge number of the compact core Z_n remains ≈ Z*, with the rest Z* electrons forming a sparse TF atom with it. We extend our studies of collapse to the case of long cylindrical clusters as well.     

Coulomb Rydberg electron <Emphasis Type="Italic">L</Emphasis>-mixing in collisions with atomic ions

The cross sections of the Rydberg electron L-mixing in a hydrogen atom and a hydrogen-like ion are calculated for slow collisions with atomic ions H*(n, L) + A⁺ = H*(n, L′) + A⁺ without variation of the principal quantum number n. The probability of the L-mixing L → L′ is associated with the quantum interference of the wave functions of adiabatic states, i.e., with the mixing of the time phases of these functions exp(?i∫E _k (t)dt). The effective cross section of such L-mixing for the states with n = 28 are 4–5 orders of magnitude greater than the cross sections determined in previous investigations. The expansion coefficients of spherical Coulomb wave functions in terms of parabolic ones and vice versa, which are necessary for determining cross sections, are calculated on the basis of a comprehensive analysis of the spatial properties of these functions.     

<Emphasis Type="Italic">Ab initio</Emphasis> theory of the electronic structure and spectra of impurity <Emphasis Type="Italic">nl</Emphasis> ions

The fundamentals of the theory of the electronic structure of impurity clusters and the results of numerical calculations for the iron-, lanthanum-, and actinium-group ions in Me⁺ⁿ: [L]_k clusters are presented. The effects of the interionic distance and ligands in the Me⁺ⁿ: [L]_k clusters on the electronic structure of the nl ^N and nl^N?1n′l′ configurations of the 3d, 4f, and 5f ions are considered. The correspondence between the optical and x-ray spectra of different impurity crystals is also analyzed.     

Congratulations to Akusticheskii Zhurnal on the occasion of its 50th anniversary. Vibrations of spherical inclusions in elastic solids

Variational principles are derived for the analysis of dynamical phenomena associated with spherical inclusions embedded in homogeneous isotropic elastic solids. The starting point is Hamilton’s principle, with the material properties assumed to vary only with the radial distance r from the origin. Attention is restricted to disturbances that are symmetric about the polar (z) axis, such that the nonzero displacement components in spherical coordinates, u _r and u_θ, are independent of the polar coordinate φ. The symmetry allows for a decoupling of the polar components, the nth of which is described by U _{r, n} (r, t)P _n (cosθ) and U_{θ, n}(r, t)dP _n /dθ. A variational principle is subsequently derived for the field quantities U _{r, n} and U_{θ, n}. Concepts analogous to those of the theory of matched asymptotic expansions are used to embellish the principle in order to allow for the damping associated with the outward radiation of elastic waves. Examples illustrating the use of the variational principle for formulating plausible lumped-parameter models are given for the cases of n = 0 and n = 1.     

The Study of (<Emphasis Type="Italic">n</Emphasis>, 2<Emphasis Type="Italic">n</Emphasis>) Reaction Cross Sections for Ce and Nd Isotopes up to 20 MeV

Neutron cross section calculations for ¹³⁶Ce(n, 2n)¹³⁵Ce, ¹³⁸Ce(n, 2n)¹³⁷Ce, ¹⁴⁰Ce(n, 2n)¹³⁹Ce, ¹⁴²Ce(n, 2n)¹⁴¹Ce, ¹⁴²Nd(n, 2n)¹⁴¹Nd, ¹⁴⁴Nd(n, 2n)¹⁴³Nd, ¹⁴⁶Nd(n, 2n)¹⁴⁵Nd, ¹⁴⁸Nd(n, 2n)¹⁴⁷Nd, and ¹⁵⁰Nd(n, 2n)¹⁴⁹Nd were done in the incident energy range from 10 to 20 MeV. The calculations were performed using three codes TALYS-1.6 for two-component Exciton model, EMPIRE-3.2 Malta for Exciton model, and ALICE/ASH for the Geometry-Dependent Hybrid (GDH) model. The results of model calculations were compared with the available experimental data and also with the evaluated data in the TENDL-2015 (based on the modified TALYS code), ENDF/B-VII.1 libraries. The calculated cross section data were compared with the available experimental data obtained from EXFOR and also compared with semiempirical formulas around 14–15 MeV. The results of model calculation were found to be in good agreement with the experimental data given in literature and semiempirical data around 14–15MeV.     

Reliability of the data on the cross sections of the partial photoneutron reaction for <Superscript>63,65</Superscript>Cu and <Superscript>80</Superscript>Se nuclei

The cross sections of partial photoneutron reactions are evaluated for the ^63,65Cu and ⁸⁰Se isotopes. The cross sections are free of systematic uncertainties from shortcomings of the experimental methods for neutron multiplicity sorting based on measurements of neutron energy used in experiments with quasimonoenergetic annihilation photon beams. An experimental-theoretical method is used to evaluate cross sections σ^eval(γ, in)= F_i^theor σ^exp(γ, xn), where ratios F_i^theor = σ^theor(γ, in)/σ^theor(γ, xn) = σ^theor(γ, in)/σ^theor[(γ, 1n) + 2(γ, 2n) + …] are calculated using a combined model of photonuclear reactions, and σ^exp(γ, xn) is the experimental cross section of the neutron yield reaction free from neutron multiplicity sorting problems. The cross sections are evaluated for reactions (γ, 1n) and (γ, 2n) for the ^63,65Cu and ⁸⁰Se isotopes, and for the total photoneutron reaction σ(γ, Sn) = σ[(γ, 1n) + (γ, 2n) + …]. It is shown that noticeable deviations of the experimental cross sections from the evaluated values result from the unreliable sorting of neutrons between the channels with multiplicities 1 and 2.     

Role of (<Emphasis Type="Italic">n</Emphasis>,2<Emphasis Type="Italic">n</Emphasis>) reactions in transmutation of long-lived fission products

The conditions under which (n,γ) and (n,2n) reactions can help or hinder each other in neutron transmutation of long-lived fission products (LLFPs) are considered. Isotopic and elemental transmutation for the main long-lived fission products, ⁷⁹Se, ⁹³Zr, ⁹⁹Tc, ¹⁰⁷Pd, ¹²⁶Sn, ¹²⁹I, and ¹³⁵Cs, are considered. The effect of (n,2n) reactions on the equilibrium amount of nuclei of the transmuted isotope and the neutron consumption required for the isotope processing is estimated. The aim of the study is to estimate the influence of (n,2n) reactions on efficiency of neutron LLFP transmutation. The code TIME26 and the libraries of evaluated nuclear data ABBN-93, JEF-PC, and JANIS system are applied. The following results are obtained: (1) The effect of (n,2n) reactions on the minimum number of neutrons required for transmutation and the equilibrium amount of LLFP nuclei is estimated. (2) It is demonstrated that, for three LLFP isotopes (¹²⁶Sn, ¹²⁹I, and ¹³⁵Cs), (n,γ) and (n,2n) reactions are partners facilitating neutron transmutation. The strongest effect of (n,2n) reaction is found for ¹²⁶Sn transmutation (reduction of the neutron consumption by 49% and the equilibrium amount of nuclei by 19%).     

Experimental study of the ignition of <Emphasis Type="Italic">n</Emphasis>-hexane- and <Emphasis Type="Italic">n</Emphasis>-decane-based surrogate fuels

Surrogate fuels on the basis of mixtures of n-hexane, n-decane, and benzene are fuels alternative to petroleum motor fuels, similar to the former in thermodynamic and kinetic properties. The fact the surrogate fuels are composed of a limited number of components makes it possible to develop both detailed and global kinetic mechanisms of their ignition in mixtures with oxidizers. In turn, the possibility of the kinetic modeling of the ignition of such fuels over wide temperature and pressure ranges is of critical importance for the numerical modeling of combustion-to-detonation transition phenomena. An experimental method for measuring ignition delay times of mixtures of air with liquid fuels with low vapor pressure under normal conditions is developed and tested. In the present work, the ignition of stoichiometric mixtures of air with n-hexane, n-decane, and surrogate fuels composed of 20% n-hexane and 80% n-decane, 20% benzene and 80% n-decane, and 9.1% n-hexane, 18.2% benzene, and 72.7% n-decane is experimentally investigated in a static reactor. The ignition delay time is determined by recording pressure oscillograms at temperatures of 530–1030 K and pressures of 1–9 atm.