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1.
用低能电子衍射谱计算过渡金属吸附CO的表面结构   总被引:3,自引:0,他引:3  
蓝田  徐峰 《计算物理》1994,11(2):203-211
本文用低能电子衍射谱研究了CO分子吸附在过渡金属上的表面结构。  相似文献   

2.
The superconductivity of ZnO-doped (Bi, Pb)-2223 thick film on the Ni and NiO substrates, which was prepared by the spray deposition technique with cold forging, was investigated by characterizing the critical current density (Jc), the critical temperature (Tc), the orientation factor (f), and the microstructure of the film. The thickness of the thick film prepared by the spray deposition method was approximately 10 μm. The maximum Jc value of (Bi, Pb)-2223 film on NiO substrate was approximately 2200 A/cm2 (Ic = 110 mA) when the film was sintered at 865 °C for 1 h with a cooling rate of 0.5 °C/min from 865 °C to 650 °C; in the case of Ni substrate, a maximum Jc value of approximately 2000 A/cm2 (Ic = 100 mA) was obtained for the (Bi, Pb)-2223 thick film when a cooling rate was 3 °C/min. Such a difference in the Jc values of (Bi, Pb)-2223 thick film on Ni and NiO substrates is attributed to the presence of reaction layer at the (Bi, Pb)-2223 and substrate interface. In addition, the variations in the orientation factor of (Bi, Pb)-2223 thick film on NiO substrate related to those of Jc values. The Jc values of (Bi, Pb)-2223 film on NiO substrate with ZnO doping extremely depended on the amount of ZnO doping and the 0.5 wt% ZnO-doped (Bi, Pb)-2223 thick film deposited on NiO substrate, which was sintered at 835 °C for 1 h in air with a cooling rate of 1 °C/min, showed a Jc value of approximately 1200 A/cm2 (Ic = 60 mA). Thus, it is considered that a small amount of ZnO doping was effective in lowering the sintering temperature of (Bi, Pb)-2223 thick film, resulting the improvement in the intragranular weak bonding or Josephson junction.  相似文献   

3.
Let (P) be the moduli space of irreducible connections of a G-principal bundle P over a closed Riemannian spin manifold M. Let DA be the Dirac operator of M coupled to a connection A of P and f a smooth function on M. We consider a smooth variation A(u) of A with tangent vector ω and denote Tω:= (DA(u)f) (u=0. The coefficients of the asymptotic expansion of trace (Tω · e-t(DAf)2) near t=0 define 1-forms a(k)f, K=0, 1, 2, … on (P). In this paper we calculate aa(0)f, a(1)f, a(2)f and study some of their properties. For instance using the 1-form a(2)f for suitable functions f we obtain a foliation of codimension 5 of the space of G-instantons of S4.  相似文献   

4.
The I3d5/2 binding energy has been measured in atomic iodine, thallium iodide and cesium iodide by high temperature gas-phase photoelectron spectrscopy using Al K (1486.6 eV) X-rays. The iodine M5N4,5N4,5 (1G4) Auger energies for TlI and CsI have also been measured and combined with binding energies to yield extra-atomic relaxation energies of 0.5 and O.3 eV, respectively, after corrections are applied to the Auger parameter. Charges were calculated using the simple potential model, which was also used to obtain an estimate of the atomic T14f binding energy. Two other estimates of the atomic T14f7/2 binding energy have also been calculated, both based on Dirac-Fock ΔSCF binding energies. The results of the three methods suggest a value of 125.3 ± 0.2 eV for T14f7/2.  相似文献   

5.
Bi2Te3 films were prepared by thermal evaporation technique. X-ray diffraction analysis for as-deposited and annealed films in vacuum at 150 °C were polycrystalline with rhombohedral structure. The crystallite size is found to increase as the film thickness increases and has values in the range 67–162 nm. The optical constants (the refractive index, n, and absorption index, k) were determined using transmittance and reflectance data in the spectral range 2.5–10 μm for Bi2Te3 films with different thicknesses (25–99.5 nm). Both n and k are independent on the film thickness in the investigated range. It was also found that Bi2Te3 is a high refractive index material (n has values of 4.7–8.8 in the wavelength range 2.5–10 μm). The allowed optical transitions were found to be direct optical transitions with energy gap  eV. The optical conductivities σ1 = ƒ() and σ2 = f() show distinct peaks at about 0.13 and 0.3 eV, respectively. These two peaks can be attributed to optical interband transitions.  相似文献   

6.
In this report we present an experimental investigation of the reflectivity (R) and the dielectric permeability () for Cu and Al ultra-thin films ranging in thickness from a few monolayers to 12 nm at infrared and visible wavelengths. The metal films were prepared by RF-sputtering on SiO2 (glass) and Si substrates. IR reflectivity was measured at 9.2 μm, while was measured with the help of laser ellipsometer at a wavelength of 632.8 nm. Two types of oscillations on R(d) and (d) were discovered for two thickness regions determined by the critical thickness value d*. Oscillations at d<d* with periods near 0.3 nm for Al and Cu films were observed on R(d) and (d) due to quantum sized effects (QSEs). At d>d* (thickness between 6–12 nm) we discover a new type of strong oscillation of R(d) and (d) with an oscillating period of 0.2 nm. For thickness larger than 12 nm all the oscillations tend to disappear and R and behave almost as their volume values. A possible explanation for the appearance of these two kinds of oscillations is based on the introduction of the critical film thickness d*.  相似文献   

7.
This paper gives an analysis of the high temperature susceptibility of diluted semimagnetic-semiconductor Zn1 − xMnxS. The high-temperature susceptibility of Zn1 − xMnxS was found to behave in accordance with the Curie-Weiss law. From χ(T) measurements the exchange integral of Mn2+ -Mn2+ interaction 2J1/kB = (-34.6±0.5) K (effective exchange integral) was obtained. A spin S = 2.6±0.1, close to its atomic value S = , was also found. The role of the superexchange in this alloy is shortly discussed at the end of the paper.  相似文献   

8.
YBa2Cu3O7−δ (YBCO) films with high critical current density (Jc) were successfully fabricated on nickel tapes buffered with epitaxial NiO. NiO was prepared on the textured nickel tape by the surface-oxidation epitaxy (SOE) method. We have reported so far a critical temperature (Tc) of 87 K and Jc=4–6×104 A/cm2 (77 K, 0 T) for the YBCO films on NiO/Ni tapes. To enhance the superconducting properties of the YBCO films on the SOE-grown NiO, depositions of thin oxide cap layers such as YSZ, CeO2, and MgO on NiO were investigated. These oxide cap layers were epitaxially grown on NiO and provided the template for the epitaxial growth of YBCO films. Substantially improved data of Tc=88 K and Jc=3×105 A/cm2 (77 K, 0 T) and 1×104 A/cm2 (77 K, Hc, 4 T) were obtained for YBCO film on NiO, by using a MgO cap layer with a thickness of 50 nm. The method described in this paper is a simple way to produce long YBCO tape conductors with high-Jc values.  相似文献   

9.
By making use of high-temperature series expansions (HTSE) of the correlation functions, we study the thermal and disorder variation of the short-range order (SRO) in the particular B-spinel ZnCr2xAl2−2xS4. We developed the HTSE for the q-dependent static structure factor S(q) to the order 6 in reciprocal temperature including both the nearest- and next-nearest-neighbour interactions J1 and J2, respectively. Respecting the experimental fact that the broad diffuse peak of the neutron is situated at the particular wave vector q0=[0 0 0.79] and is insensitive to the temperature for a given ratio of dilution x, we have estimated the thermal variation of J1 and J2 in the case of the pure compound.

The bond percolation threshold xp of the ZnCr2xAl2−2xS4 is determined by studying the disorder variation of the correlation length ξ. The xp is considered as the concentration at which ξ vanishes. The obtained values are xp=0.27 when only J1 is considered and 0.23 when both J1 and J2 are taken into account.  相似文献   


10.
We have investigated the magnetic behavior of cobalt ferrite nanoparticles with a mean diameter of 7.2 nm. AC susceptibility of colloidal cobalt ferrite nanoparticles was measured as a function of temperature T from 2 to 300 K under zero external DC field for frequencies ranging from f=10 to 10,000 Hz. A prominent peak appears in both χ′ and χ″ as a function of T. The peak temperature T2 of χ″ depends on f following the Vogel–Fulcher law. The particles show superparamagnetic behavior at room temperature, with transition to a blocked state at TBm94 K in ZFC and 119 K in AC susceptibility measurements, respectively, which depends on the applied field. The saturation magnetization and the coercivity measured at 4.2 K are 27.3 emu/g and 14.7 kOe, respectively. The particle size distribution was determined by fitting a magnetization curve obtained at 295 K assuming a log-normal size distribution. The interparticle interactions are found to influence the energy barriers yielding an enhancement of the estimated magnetic anisotropy, K=6×106 erg/cm3. Mössbauer spectra obtained at higher temperatures show a gradual collapse of the magnetic hyperfine splitting typical for superparamagnetic relaxation. At 4.2 K, the Mössbauer spectrum was fitted with two magnetic subspectra with internal fields Hint of 490, 470 and 515 kOe, corresponding to Fe3+ ions in A and B sites.  相似文献   

11.
Fe/Fe1−xSix/Fe (x=0.4–1.0) wedge-type epitaxial trilayers with improved homogeneity are grown by co-evaporation from two electron-beam sources. The coupling strengths of the bilinear (J1) and biquadratic (J2) coupling terms are derived from Brillouin light scattering (BLS) spectra and longitudinal MOKE hysteresis loops. The total coupling strength J=J1+J2 increases dramatically with increasing x and reaches values in excess of 6 mJ/m2.  相似文献   

12.
Two chiral organic nonlinear optical materials, (3S,4S)-(−)-6-cyano-2,2-dimethyl-3,4-epoxychroman (1) and (3R,4R)-(+)-6-nitro-2,2-dimethyl-3,4-epoxychroman (2), have been grown into single crystals of cm3-size. Although both compounds crystallise in the orthorhombic P212121 space group, they are not isomorphous and their crystal packings are quite different. Angle tuned type II phase-matched second harmonic generation between 0.8 and 1.064 μm has been evidenced, with effective nonlinear coefficients deff of 1 and 5 pm/V at 0.96 μm for 1 and 2, respectively. These values are in agreement with those estimated in the oriented gas model approximation using EFISH first order hyperpolarisability values (β0=2.6 and 4.0×10−30 esu for 1 and 2, respectively).  相似文献   

13.
We use a non-perturbative approach which combines coupled channel Lippmann-Schwinger equations with meson-meson potentials provided by the lowest order chiral Lagrangian. By means of one parameter, a cut off in the momentum of the loop integrals, which results of the order of 1 GeV, we obtain singularities in the S-wave amplitudes corresponding to the σ, f0 and a0 resonances. The ππ → ππ, phase shifts and inelasticities in the T = 0 scalar channel are well reproduced as well as the π0η and mass distributions in the T = 1 channel. Furthermore, the total and partial strong decay widths of the f0 and a0 resonances are properly reproduced. The results seem to indicate that chiral symmetry constraints at low energy and unitarity in coupled channels is the basic information contained in the meson-meson interaction below GeV.  相似文献   

14.
刘天时  魏国柱 《计算物理》1994,11(1):107-112
本文用实空间重整化群方法讨论了准周期层状铁磁超晶格的磁自旋波,用Reduce语言推导了decimation变换公式,从而求得了局域格林函数、局域态密度和约化磁矩。发现局域态密度的带宽和约化磁矩与最近邻相互作用J1J2及格点自旋sasb密切相关。  相似文献   

15.
Silver-sheathed TlBa2Ca2Cu3O9+δ (Tl-1223) tapes, with a transport critical current density, Jct, of 6200 A/cm2 at 75 K under zero magnetic field, were fabricated by the oxide-powder-in-tube (OPIT) method and characterized using an X-ray diffractometer (XRD), scanning electron microscope (SEM), transmission electron microscope (TEM), and superconducting quantum interference device (SQUID) magnetometer. The results of the magnetization and SEM study indicate that, in these tapes, individual grains are distributed randomly in orientation and weak links exist. However, strongly linked percolative current paths within the tape persisting in increasing fields, accompanied by strong intrinsic interplanar coupling, sustain a significant Jct at high fields and lead to the plateau in the Jct-H curve. Dislocation networks, which may act as effective pinning centers, are the common features observed in the tapes. To investigate the effects on flux pinning due to thermomechanical processing, magnetic relaxation at 1 and 2 T over 5–50 K was measured. The tape shows slightly lower normalized relaxation rates (S=-(1/Mo)dM/ dln t) than the cauliflower-like precursor powder. Analyses of the relaxation data obtained from the tape, after incorporating temperature dependence and field scaling, yield an expression for the effective pinning energy Ueff(J,T,H) = (U1/H0.54)[1-(T/ 72.5)2]4(J/Ji)μ. This result was compared with the prediction of the collective flux-creep model, which suggests that Tl-1223 has a three-dimension-like (3D-like) vortex lattice. Presumably, a more plate-like powder morphology may result in improved texturing by the OPIT process. Tl0.5Bi0.5Sr2CaCu2O7+δ ((Tl,Bi)-1212) powder with this morphology was therefore synthesized for comparison.  相似文献   

16.
All electronic devices are plagued with 1/f noise originating from many causes. The most important factors contributing to 1/f noise in a semiconductor is believed to be recombination of carriers and their trapping at defects and impurity sites. Adsorption of moisture and electron acceptor molecules enhances the intensity of 1/f noise. Amazingly, some molecular species that strongly chelate to the semiconductor surface, suppress 1/f noise owing to passivation of the recombination sites. Thus in addition to sensitization, the dye adsorbed on the nanocrystallites plays a key role in mitigation of recombinations. For this reason dye-sensitized heterojunctions could also find application as low noise NIR photon detectors. Experiments conducted with oxide semiconductors (TiO2, ZnO, SnO2) indicate that the mode of binding of dyes at specific sites determines the extent to which the recombination and 1/f noise are suppressed. The transport of electrons in a nanocrystalline matrix is diffusive with a diffusion coefficient D depending on the trapping and detrapping processes. Thus passivation of trapping sites by the adsorbed dye is expected to increase the response time which can be expressed as τ  L2/D, where L = thickness of the nanocrystalline film. Measurement techniques and construction of a dye-sensitized NIR photon detector will be discussed.  相似文献   

17.
The low-temperature (5 K < T < 300 K) magnetic properties of a set of nine isostructural fcc Fe-Cr-Ni (Fe ≈ 68 at %, Cr ≈ 20 at%, Ni ≈ 9 at%) alloys were studied by SQUID magnetometry, neutron diffraction and ultrasonic techniques. Type-1 antiferromagnetic (AF) ordering was observed below the Néel temperature, TN. The dc susceptibility, χ(T), did not exhibit a simple Curie-Weiss dependence. Above TN, atemperature independent component χ0 was observed, i.e., χ(T) = χ0 + C / (itT + θ. TN was systematically influenced by the lattice parameter, a, decreasing from (47.9 ± 0.5) K to (35.0 ± 0.5) K as a increased by only 0.25%. The average magnetic moment of ≈ 0.6μB obtained from neutron scattering was lower than the ≈ 1 μB obtained from the SQUID data. Mean field estimates of antiferromagnetic nearest-neighbors exchange interaction (J1) and ferromagnetic second-nearest-neighbors interaction (J2) indicate that |J2/J1|≈ 1.5. We believe that this is evidence of the RKKY interaction, and self-consistently argue that only the external d electrons are responsible for the localized average moment. This may mean that s-d hybridization of the external electrons is weak in these alloys.  相似文献   

18.
The magnetic susceptibility of dilute magnetic alloys of Mn in Rh and Fe in a Nb-Mo solid solution deviates from the Curie-Weiss law. The following temperature dependence is observed: Δχ = C/(T + TK) + log (TK/T), with ≡ 0 for T > TK0.  相似文献   

19.
孙晓燕  朱军芳 《物理学报》2015,64(11):114502-114502
本文根据实际交通中经常遇到的交通事故或部分道路施工等情况, 建立了部分道路关闭的交通流模型. 采用平均场理论分析和确定性NS元胞自动机规则分别对模型进行解析和数值模拟, 结果表明, 系统存在三种稳定的物理状态:低密度相、激波相和高密度相, 并找到了系统发生相变的临界密度. 理论分析和数值模拟能很好地符合.  相似文献   

20.
We systematically construct all the tetraquark currents of JPC = 1++ with the quark configurations $[{cq}][\bar{c}\bar{q}]$, $[\bar{c}q][\bar{q}c]$, and $[\bar{c}c][\bar{q}q]$ (q = u/d). Their relations are derived using the Fierz rearrangement of the Dirac and color indices, through which we study decay properties of the X(3872) under both the compact tetraquark and hadronic molecule interpretations. We conduct a search for the X(3872) → χc0π, ηcππ, and χc1ππ decay processes in particle experiments.  相似文献   

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