Broadband third-harmonic generation in two-dimensional short-range ordered nonlinear photonic structure

We study parametric frequency conversion in two-dimensional nonlinear photonic crystal with short-range ordered ferroelectric domains. We demonstrate that the short-range order enables broadband third-harmonic generation via cascading of two second-order quasi-phase matched nonlinear processes. We obtain conversion efficiencies that are much higher than those achieved from a randomized medium, owing to the unique distribution of reciprocal lattice vectors in the short-range ordered structure.     

Twinning and short-range order in ordered titanium monoxide

Electron diffraction was used to study the annealed titanium monoxide TiO_1.087 containing the monoclinic ordered phase Ti₅O₅. The diffraction pattern of titanium monoxide in the (112)* _B1 plane of the reciprocal lattice of the parent B1 cubic structure contains not only structural, superstructural, and additional reflections but also a system of planar diffuse strips. It has been established that part of the additional reflections are twins of the superstructure reflections of the monoclinic ordered phase; the twinning plane is the ( $\overline 1 \overline 1 1$ ) plane of the reciprocal lattice of the parent cubic phase. The diffuse scattering contours cover finite plane areas in the reciprocal space characterized by the wave vectors K ₁₀₀ ～ ± (h + 0.07)k ₁₀₀, K ₀₁₀ ～ ±(k + 0.07)k ₀₁₀, and K ₀₀₁ ～ ±(l + 0.07)k ₀₀₁ in the B1 structure. The diffuse scattering is caused by short-range displacement order. Short-range substitution order and the corresponding diffuse scattering are absent.     

Investigation of short-range order in magnesium-terbium alloy

Using the model potential method with Ashcroft form factors, we predict the existence of short-range order in the alloy Mg−2.9 at. % Tb, which is experimentally confirmed by diffuse x-ray scattering. We use the diffuse x-ray scattering method to determine the characteristic temperature of the alloy: θ _D = 325 K. M. V. Lomonosov Moscow State University. Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 7, pp. 26–30, July, 1996     

Antisite-defect-induced surface segregation in ordered NiPt alloy

By means of first principles simulations we demonstrate that tiny deviations from stoichiometry in the bulk composition of the NiPt-L1(0) ordered alloy have a great impact on the atomic configuration of the (111) surface. We predict that at T=600 K the (111) surface of the Ni51Pt49 and Ni50Pt50 alloys corresponds to the (111) truncation of the bulk L1(0) ordered structure. However, the (111) surface of the nickel deficient Ni49Pt51 alloy is strongly enriched by Pt and should exhibit the pattern of the 2x2 structure. Such a drastic change in the segregation behavior is due to the presence of different antisite defects in the Ni- and Pt-rich alloys and is a manifestation of the so-called off-stoichiometric effect.     

New short-range electromagnetic current in the deuteron

A new model for short-range isoscalar current in the deuteron and NN system is developed and tested on a variety of isoscalar magnetic observables such as the deuteron magnetic moment, magnetic form factor, and the circular polarization of photons at radiative capture at thermal neutron energies. The model for electromagnetic two-nucleon current proposed in the paper is based on generation of an intermediate dibaryon in the short-range NN interaction. This intermediate dibaryon, in turn, is treated within the new model for intermediate and short-range NN interaction recently proposed by the present authors. The transition current model developed here satisfies the current conservation relation by the construction. Our calculations have demonstrated that the new current model, using only one parameter (with a clear physical meaning), is able to describe, in very good agreement with the experimental data, three basic deuteron observables of magnetic type, viz., the magnetic moment, the photon circular polarization in the process, and the structure function B(Q ²) up to Q ² ≃ 60 fm⁻². The text was submitted by the authors in English.     

Chemical short-range order in Zr2Ni amorphous alloy

Extended X-ray absorption fine structure (EXAFS) and molecular dynamic (MD) simulation were used to study the short-range order in Zr₂Ni amorphous alloy. It is found that the bond length is significantly shorter for unlike atoms but longer for like atoms in amorphous state than that in the crystalline state. Meanwhile, the coordination number of Ni atom in amorphous structure is only half of that in ideal Zr₂Ni crystalline. Based on these results, we proposed that there exists Zr₂Ni-like chemical short-range order in the Zr₂Ni amorphous alloy.     

X-ray investigation of short-range order in the liquid eutectic alloy Bi-Cd-Sn

From an analysis of the curves of the intensity of x-ray scattering and the atomic radial distribution function, information has been obtained about the formation of a complex polystructure in a liquid Bi-Cd-Sn melt near the melting point. The hypothesis is proposed that in the most probable structure of the liquid eutectic Bi-Cd-Sn alloy, in the neighborhood of the melting point, there are microscopic orbital regions containing bismuth atoms and microscopic regions with a statistical distribution of cadmium and tin. As the temperature is raised, this atomic distribution changes, and a homogeneous atomic solution is formed.Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 3, pp. 7–10, March, 1975.     

Change in the phase composition and defect structure of a multicomponent ordered Ni-based alloy upon high-temperature annealing

Phase transformations upon the high-temperature annealing of a multicomponent Ni-based alloy produced via direct crystallization are studied by diffraction electron microscopy. The alloy is annealed at T = 1000°C for a prolonged period. The phase composition is determined. The dislocation structure and behavior of the γ-phase during prolonged annealing are studied.     

Difference approach to the analysis of resistivity recovery data for irradiated short-range ordered alloys

Electrical resistivity recovery (RR) data for irradiated concentrated alloys typically consist of two inseparable parts, one resulting from defect annihilation and the other from short-range order (SRO) effects. These parts exhibit different behaviour and often follow opposite trends. Therefore, in this case, analysis of RR data within the conventional method is too complicated. A new approach to data analysis of such a two-component RR is proposed. The approach involves a new quantity, the difference RR (DRR), which is composed of RR dependences of two similar samples irradiated to different defect concentrations. It is shown that the SRO formation proper and the stages corresponding to the onset of long-range migration of Frenkel pair defects, formed in each part of RR, can be clearly related to certain features of the DRR plots. This interrelationship allows detecting and identifying these stages in each part of RR separately. The validity of the approach is illustrated by analysis of the available pairwise RR data for Fe–16Cr–20Ni and Fe–4Cr alloys. It makes it possible to detect the small contribution from the SRO formation to RR in Fe–4Cr, which we failed to observe previously. It is shown that stage III of Fe–4Cr, which has a negligible contribution to the part of RR induced by defect annihilation, is clearly observed in the part induced by SRO formation.     

High-energy phenomena,short-range nuclear structure and QCD

A systematic review and theoretical analysis of the experimental data on multi GeV lepton, photon, hadron, deuteron (nucleus) reactions from nuclei forbidden in the case of scattering from free nucleons is presented. It is shown that all these data can be quantitatively described as a manifestation of short-range few nucleon correlations. Calculations for elastic and (deep)inelastic electromagnetic and weak form factors of the deuteron and other nuclei, are given. The inclusive production of leading particles in the nucleus fragmentation region in high-energy lepton, hadron or nucleus-induced collisions is analyzed. The straightforward correspondence between the Weinberg equation for the light-cone wave functions of the deuteron and the non-relativistic Schrödinger equation is found. It is shown that the predictions of quantum chromodynamics for short-distance phenomena in nuclei are in agreement both with experimental data and theoretical expectations due to short range correlations in nuclei. Several feasible experiments are considered which could establish the existence of relativistic nuclear physics.     

Modification of short-range repulsive interactions in ReaxFF reactive force field for Fe-Ni-Al alloy

The short-range repulsive interactions of any force field must be modified to be applicable for high energy atomic collisions because of extremely far from equilibrium state when used in molecular dynamics (MD) simulations. In this work, the short-range repulsive interaction of a reactive force field (ReaxFF), describing Fe-Ni-Al alloy system, is well modified by adding a tabulated function form based on Ziegler-Biersack-Littmark (ZBL) potential. The modified interaction covers three ranges, including short range, smooth range, and primordial range. The short range is totally predominated by ZBL potential. The primordial range means the interactions in this range is the as-is ReaxFF with no changes. The smooth range links the short-range ZBL and primordial-range ReaxFF potentials with a taper function. Both energies and forces are guaranteed to be continuous, and qualified to the consistent requirement in LAMMPS. This modified force field is applicable for simulations of energetic particle bombardments and reproducing point defects' booming and recombination effectively.     

Coronene—An ordered structure

It is shown that there is no disorder in coronene crystals at room temperature, and that the crystallographic data in the literature is of sufficient quality to show down less than 2% of disorder if it existed.     

Atomistic simulation of the point defects in TaW ordered alloy

Combining molecular dynamics (MD) simulation with modified analytic embedded-atom method (MAEAM), the formation, migration and activation energies of the point defects for six-kind migration mechanisms in B₂-type TaW alloy have been investigated. The results showed that the anti-site defects Ta_W and W_Ta were easier to form than Ta and W vacancies owing to their lower formation energies. Comparing the migration and activation energies needed for six-kind migration mechanisms of a Ta (or W) vacancy, we found that one nearest-neighbour jump (1NNJ) was the most favourable because of its lowest migration and activation energies, but it would lead to a disorder in the alloy. One next-nearest-neighbour jump (1NNNJ) and one third-nearest-neighbour jump (1TNNJ) could maintain the ordered property of the alloy but required higher migration and activation energies. So the 1NNNJ and 1TNNJ should be replaced by straight [100] six nearest-neighbor cyclic jumps (S[100]6NNCJ) (especially) or bent [100] six nearest-neighbour cyclic jumps (B[100]6NNCJ) and [110] six nearest-neighbor cyclic jumps ([110]6NNCJ), respectively.     

Role of magnetism in the formation of a short-range order in an Fe-Ga alloy

The formation of a short-range order in an Fe-Ga bcc alloy has been studied by Monte Carlo simulation with the use of effective interaction potentials calculated within the density functional theory for the ferromagnetic and paramagnetic states. It has been found that the pronounced short-range order of the D0₃ type is formed at Ga concentrations close to the boundary of the two-phase region at T < T _c, whereas no short-range order is observed at T < T _c. The results obtained are in agreement with the experimental X-ray diffraction analysis. The relation of the features of the short-range order in the Fe-Ga alloy to the magnetostriction value has been discussed.     

Self-oscillations of an ordered magnetic structure

The first observation of self-oscillations of an ordered magnetic structure is reported. They were detected by the Mössbauer effect in the Tb_0.8Y_0.2Fe₂ ferrimagnetic compound and occur with a period of several days. The oscillations were initiated by a single electric-field pulse (～10⁸ kV cm^?1 s^?1). A phenomenological model of the phenomenon is proposed.