Absolute photoionization cross sections with ultra-high energy resolution for Ar, Kr, Xe and N2 in inner-shell ionization regions

The high-resolution absolute photoionization cross sections for Ar, Kr, Xe and N₂ in the inner-shell ionization region have been measured using a multi-electrode ion chamber and monochromatized synchrotron radiation. The energy ranges of the incident photons for the target gases were as follows: Ar: 242–252 eV (2p Rydberg excitation), Kr: 1650–1770 eV (near the 2p ionization thresholds), Xe: 665–720 eV (near the 3d ionization thresholds) and 880–1010 eV (near the 3p ionization thresholds), N₂: 400–425 eV (N 1s excitation and ionization). It is the first time to measure the absolute ionization cross sections of Ar, Kr, Xe and N₂ over the present energy ranges with the energy resolution of over 10,000. The natural lifetime widths of , , and resonances for Ar, resonance for Xe, and resonance for N₂ have been obtained based on the cross sections determined. The ionization energies into the Ar⁺ (), Ar⁺ () and Xe⁺ () ionic states are also determined using the Rydberg formula.     

Widely tunable high power OPO based on a periodically poled MgO doped lithium niobate crystal

An optical parametric oscillator (OPO) based on a highly MgO doped periodically poled lithium niobate (PPMgLN) crystal was experimentally demonstrated and the result is presented in this report. The PPMgLN wafer was fabricated from a MgO doped (with 6 mol% doping concentration) lithium niobate crystal by means of high voltage pulse trigged domain reversal technique and has 20 domain reversal periods from 27.8 to with a step of between the neighbor periods. An acousto-optic (AO) Q-switched Nd³⁺:YVO₄ laser was used as the pumping laser. A maximum laser output power of 4.8 W has been achieved for the OPO when the pumping power is 10.8 W and it corresponds to an optic-optic conversion efficiency of 44%. By shifting the PPMgLN wafer, the periods of the domain structure on the PPMgLN wafer can be changed, thus enabling a wide spectral tuning range of the laser output from 1.42 to (for the signal light) and from 2.76 to (for the idler light).     

Tree-level contributions to the rare decays , , and in the Standard Model

The tree-level contributions to the rare decays , , and are analyzed and compared to those occurring in , , and . It is shown that these purely long-distance contributions, arising from the exchange of a charged lepton, can be significant in B⁺ decays for an intermediate τ, potentially blurring the distinction between the modes used to extract B⁺→τ⁺ν_τ and those used to probe the genuine short-distance and FCNC transitions. Numerically, the tree-level contributions are found to account for 98%, 12% and 14% of the total , , and rates, respectively.     

Step formation on hydrogen-etched 6H-SiC{0 0 0 1} surfaces

The formation of step bunches and/or facets on hydrogen-etched 6H-SiC(0 0 0 1) and () surfaces has been studied, using both nominally on-axis and intentionally miscut (i.e. vicinal) substrates. It is found that small miscuts on the (0 0 0 1) surface produce full unit-cell high steps, while half unit-cell high steps are observed on the () surface. The observed step normal direction is found to be for both surfaces. Hence, for intentionally miscut material, a miscut oriented towards this direction produces much better order in the step array compared to a miscut oriented towards a direction. For (0 0 0 1) vicinal surfaces that are miscut towards the direction, the formation of surface ripples is observed for 3° miscut and the development of small facets (nanofacets) is found for higher miscut angles. Much less faceting is observed on miscut () surfaces. Additionally, the (0 0 01) surface is found to have a much larger spatial anisotropy in step energies than the () surface.     

Resonant Auger decay study of core-excited OCS

The present work aims at characterizing short-lived C1s⁽⁻¹⁾π^*(1) core-excited states of the OCS molecule based on the analysis of the vibrational fine structure and lineshape profiles of the high-resolution resonant Auger decay spectra recorded at the excitation energies along the C1s→π^* resonance in the binding energy region 15–19 eV. Very different behavior in terms of lineshape and resonant enhancement is observed for the , and final states. This is explained by (1) the variation in the C–O bond lengths for the states involved in the electronic relaxation and (2) different contributions in terms of Mulliken population to the molecular orbitals determining the electronic character of the corresponding states. Since the final-state geometries are known from a number of previous experiments and ab initio calculations, the geometry of the C1s⁽⁻¹⁾π^*(1) intermediate states can be predicted in analogy with e.g. the N₂, CO₂ and N₂O molecules.     

Theoretical structure and surface energy of the reconstructed {01.2} form of calcite (CaCO3) crystal

Two different reconstructions of the (01.2) face (Ca or CO₃ terminated) of calcite (CaCO₃) were studied: (i) R1 reconstruction: the outermost layer is based on the [0 1 0] × 1/3[2 1 1] rectangular mesh, which is symmetrical with respect to the c glide plane of the crystal, thus fulfilling the 2D symmetry of the face and (ii) R2 reconstruction: the outermost layer is based on a lozenge shaped mesh that does not respect the 2D symmetry of the face.The , , and slabs geometry optimizations of calcite (CaCO₃) were performed either at DFT level or by using empirical potentials; the results obtained with these two different calculation methodologies are in good agreement. With respect to their arrangement in the bulk, the CO₃ groups of the outermost layer are significantly rotated about the crystallographic a-axis and about the normal to the 01.2 plane; further, the thickness of the outermost layer is significantly lower than that of the underneath ones.The surfaces energies (γ) at 0 K, for relaxed and unrelaxed , , and faces, were determined either at DFT level or by using empirical potentials. Independently of the method of calculation employed, the stability order of the relaxed faces is < < < . Concerning the unrelaxed faces, whose energies were evaluated by using empirical potentials only, the stability order is instead < < < ; such different ordering shows the importance of geometry relaxation in the calculation of the surface energy. The values of the relaxed surface energies are , , and erg/cm².     

Type I quasi-phase-matched blue second harmonic generation with different polarizations in periodically poled LiNbO3

First-order type I quasi-phase-matched (QPM) blue second-harmonic generation was demonstrated in periodically poled LiNbO₃ with period of 14.5 μm using d₃₁. 52 μJ of harmonic blue light at 0.473 μm was generated pumped by 114 μJ 35 ps pulse laser at 0.946 μm at 150 °C with a conversion efficiency of 45.6%. The average conversion efficiencies of 41.3% and 19% were also obtained at 150 °C, respectively, in the conventional first- and third-order QPM blue second-harmonic generation at 0.473 μm. The temperature acceptance bandwidths of 20 mm length periodically poled LiNbO₃ with first-order grating periods of 14.5 and 4.5 μm are 2.0 and 0.9 °C, respectively. The larger acceptance bandwidths and grating period for than those for enhance the frequency conversion efficiency, which shows the polarization dependence of quasi-phase matching.     

Observation of the quantum Hall effect in cleaved InAs surfaces

We have performed the in-plane magnetotransport measurements on the two-dimensional electron gas at the cleaved p-InAs (1 1 0) surface by deposition of Ag. The surface electron density N_s is determined from the Hall coefficient at . The coverage dependence of N_s is well explained by the assumption that each adsorbed Ag atom denotes one electron into InAs until the surface Fermi level reaches the adsorbate-induced donor level. The electron mobility μ is about and does not show a clear dependence on the coverage over . In the high-magnetic field regime of B>1/μ, Shubnikov–de Hass oscillations were observed. A beating pattern due to the strong spin–orbit interaction appears for high N_s. For lower N_s of , an apparent quantum Hall plateau for ν=4 and vanishing of the longitudinal resistivity were observed around .     

Double-quantum NMR spectroscopy of P species submitted to very large CSAs

We introduce an original pulse sequence, , which is a block super-cycled sequence employing as basic element a π pulse sandwiched by ‘window’ intervals. This homonuclear dipolar recoupling method allows the efficient excitation of double-quantum coherences between spin-1/2 nuclei submitted to very large chemical shift anisotropy. We demonstrate that this technique can be employed in double-quantum ↔ single-quantum ³¹P homonuclear correlation experiment at high magnetic field (B₀  14 T) and high MAS frequencies (ν_R  30 kHz). The performances of are compared to those of the double-quantum recoupling methods, such as BABA and bracketed fp-RFDR, which were already employed at fast MAS rates. The sequence displays a higher robustness to CSA and offset than the other existing techniques.     

Entanglement degree measure and a criterion for sudden death as a phase transition in bipartite systems

We propose a method to compute the entanglement degree of bipartite systems having dimension 2 × 2 and demonstrate that the partial transposition of density matrix, the Peres criterion, arise as a consequence of our method. Differently from other existing measures of entanglement, the one presented here makes possible the derivation of a criterion to verify if an arbitrary bipartite entanglement will suffers sudden death (SD) based only on the initial-state parameters. Our method also makes possible to characterize the SD as a dynamical quantum phase transition, with order parameter , having a universal critical exponent −1/2.     

The observation of hot bands in the 288 nm system of the FeCl2 radical

The 288 nm band system of FeCl₂ has been recorded with a sample produced in a warmed, free-jet expansion at moderately high resolution (with a linewidth of 0.28 cm⁻¹). Under these conditions, several hot bands are observed involving excitation of the symmetric and anti-symmetric stretching vibrations. The wavenumbers determined as a result for FeCl₂ in its ground ⁵Δ_g,4 state are and . No hot, sequence bands in the bending vibration were observed. The most likely explanation is that the wavenumber for ν₂ is essentially the same in both the electronic states involved (88 cm⁻¹). Additional strong hot bands are observed that are unrelated to the previously assigned electronic transitions; they appear to emanate from a low-lying electronic state of FeCl₂.     

Energy surfaces of rare-earth silicide films on Si(1 1 1)

We report on angle-resolved photoelectron spectroscopy results of thin dysprosium-silicide layers formed on Si(1 1 1), taken with a toroidal analyzer allowing to image the energy surfaces in k_||-space. At monolayer dysprosium coverages, where hexagonal DySi₂ grows with a 1×1 superstructure, electron pockets are observed at the points with highly anisotropic effective masses, and around a hole pocket at the point also an anisotropic dispersion is found. The band filling of these two bands amounts to one, indicating an even number of electrons assigned to the surface unit cell. Similar features are found for multilayer coverages, where hexagonal Dy₃Si₅ layers are formed with a superstructure. Here, the influence of zone folding effects due to the reconstructed layers in the bulk silicide is only weak because of the high surface sensitivity of the experiments.     

First-principles study of benzene on noble metal surfaces: Adsorption states and vacuum level shifts

We have studied the interaction of benzene with Cu(1 1 1), Ag(1 1 1) and Au(1 1 1) surfaces using density functional theory (DFT) within a generalized gradient approximation (GGA) and the van der Waals density functional [vdW-DF; M. Dion, H. Rydberg, E. Schröder, D.C. Langreth, B.I. Lundqvist, Phys. Rev. Lett. 92 (2004) 246401]. The adsorption energies using vdW-DF are significantly more accurate than those using GGA, while the equilibrium adsorption distances between benzene and metal substrates () calculated by both GGA and vdW-DF are almost identical. The work function changes induced by the adsorption of benzene are significantly underestimated compared with the experimental values, as a result of the overestimation of by both GGA and vdW-DF. Instead of determining the values from first-principles calculations, we deduced the most probable adsorption distances in such a way as to reproduce the experimentally-observed work function changes. The deduced adsorption distance () is shortest on Cu(1 1 1) while it is longest on Ag(1 1 1), reflecting the strength of the interactions between benzene and the metal surfaces. It turns out that the substrate dependence of the work function change is mainly ascribed to the difference in the benzene–metal distance (Z_C). Charge transfer and work function changes by the adsorption of benzene were analyzed by means of the induced density of interface states (IDIS) model [H. Vázquez, R. Qszwaldowski, P. Pou, J. Ortega, R. Pérez, F. Flores, A. Kahn, Europhys. Lett. 65 (2004) 802], and compared with the self-consistent GGA calculations. The vacuum level shifts estimated by the IDIS model agree with the GGA results for . On the other hand, the discrepancy between the two methods becomes larger for , where the back donation from the metal substrates to the adsorbate becomes significant. We show that the IDIS model reasonably works well for benzene on Cu(1 1 1), Ag(1 1 1) and Au(1 1 1) surfaces because on all surfaces. However, our analysis reveals that the actual charge density redistribution induced by the adsorption of benzene is more complicated than that assumed in the IDIS model.     

Existence of different intermediate Hamiltonians in type A -fold supersymmetry

Type A -fold supercharge admits a one-parameter family of factorizations into product of first-order linear differential operators due to an underlying symmetry. As a consequence, a type A -fold supersymmetric system can have different intermediate Hamiltonians corresponding to different factorizations. We derive the necessary and sufficient conditions for the latter system to possess intermediate Hamiltonians for the case. We then show that whenever it has (at least) one intermediate Hamiltonian, it can admit second-order parasupersymmetry and a generalized 2-fold superalgebra. As an illustration, we construct a set of generalized Pöschl–Teller potentials of this kind.     

Three equations of state for solids considering thermal effect

 The Einstein model to consider thermal effect in universal equations of state (UEOS) is modified. It is proposed that the zero-point vibration term should be deleted in a thermal UEOS, and the parameters cannot be directly taken as experimental data at a reference temperature, V_R, B_R, and , but their values at absolute zero temperature, V₀, B₀, and . An approach is proposed to solve V₀, B₀, and from V_R, B_R, and . The approaches are applied to three typical universal EOSs, including the Baonza, mGLJ and Morse EOSs. The numerical results show that the solved values of parameters are almost identical for different EOSs. And the thermo-physical properties predicted through different EOSs are almost identical at zero- and low-pressure conditions, once the same approach and input experimental data are used to solve the parameters. It is concluded that the prediction of thermo-physical properties at zero- and low-pressure conditions cannot be taken as the criteria to judge the applicability of a universal EOS.     

Observation of γ-delayed 3α breakup of the 15.11 and 12.71 MeV states in C

The reactions at 4.9 MeV and at 8.5 MeV have been used to investigate the γ decay of states in ¹²C. By measuring the four-body final state in complete kinematics we are able to detect γ transitions indirectly. We find γ transitions from the 15.11 MeV state in ¹²C to the 12.71, 11.83, 10.3 and 7.65 MeV states followed by their breakup into three α particles. The relative γ-ray branching ratios obtained are (1.2±0.3), (0.32±0.12), (1.4±0.2) and (4.4±0.8)%, respectively, with the remaining (92.7±1.0)% of the γ decays going to the bound states. We obtain Γ_α/Γ=(2.8±1.2)% for the isospin-forbidden α decay of the 15.11 MeV state. From the 12.71 MeV state we find γ transitions to the 10.3 and 7.65 MeV states. The relative γ-ray branching ratios are and , respectively, with the remaining of the γ decays going to the bound states. Finally, we discuss the relation between the β decay of ¹²N and ¹²B to states in ¹²C and the γ decay of the 15.11 MeV analog in ¹²C to the same states.     

Polarized neutron scattering studies of the kagomé lattice antiferromagnet

We report polarized neutron scattering studies of spin-wave excitations and spin fluctuations in the lattice antiferromagnet KFe₃(OH)₆(SO₄)₂ (jarosite). Inelastic polarized neutron scattering measurements at 10 K on a single crystal sample reveal two spin gaps, associated with in-plane and out-of-plane excitations. The polarization analysis of quasi-elastic scattering at 67 K shows in-plane spin fluctuations with XY symmetry, consistent with the disappearance of the in-plane gap above the Néel temperature . Our results suggest that jarosite is a promising candidate for studying the 2D XY universality class in magnetic systems.     

Electronic structure and charge distribution in : The ab initio approach

The full-potential linearized augmented plane wave (FP-LAPW) method was used for spin-polarized electronic structure calculations of stoichiometric superconductor. The generalized gradient approximation plus Hubbard correction (GGA + U) was employed for electrons. The reference calculations of were carried out in the spin-polarized mode to enable direct comparison. The determined total and atomic-projected densities of states (DOS), as well as charge distribution and on-site magnetic moments were analyzed and compared in detail. It was shown that in Dy123 system DOS in the close vicinity of the Fermi level is higher than in Y123. Also more efficient transfer of charge from CuO₂ planes was noticed in Dy123. The strongly localized magnetic spin moment of Dy is responsible for relatively weak magnetic interactions in the system, mostly in the CuO₂ planes. The obtained computational results are in agreement with the reported good superconducting properties of DyBa₂Cu₃O₇ compound.     

Magnetostructural phase transitions of DyFe4Ge2: Part II Neutron diffraction

We present the temperature magnetic phase diagram of the compound DyFe₄Ge₂ determined from neutron diffraction data for the entire magnetically ordered regime. DyFe₄Ge₂ undergoes at a simultaneous structural and magnetic transition of second order (or weakly first order) followed by two subsequent isostructural first-order magnetic transitions at and T_ic1=28K:

The re-entrant lock-in magnetic phase is stable in the high-temperature range T_ic2–T_N and in the low-temperature range 1.5 K–T_ic1 while the incommensurately modulated magnetic phase is sandwiched in the intermediate range T_ic1–T_ic2 between the two commensurate phases. The wave vector q₂ has a temperature-dependent length with a minimum in the middle of the incommensurate range and corresponds to a multiaxial amplitude modulated phase. Symmetry analysis leads for both propagation vectors in Cmmm to a twofold and fourfold splitting of the tetragonal Dy 2b site and the Fe 8i sites, respectively. The low temperature and the phases correspond to 3D canted magnetic structures described by the irreducible representations (Irreps) Γ₂+Γ₃ while the high-temperature q₁ phase to 2D canted magnetic structures described by a single Irrep Γ₂. The T_ic2 transition is connected with reorientations of both Fe and Dy moments.