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1.
Synthesis and study the influence of yttrium doping on band structure,optical, non-linear optical and dielectric results for Ca12Al14O33 (C12A7) single crystals grown using traveling-solvent floating zone (TSFZ) method 下载免费PDF全文
Ca12Al14O33(C12A7)and Y0.02Ca11.98Al14O33(Y-C12A7)single crystals were grown by using the traveling-solvent floating zone(TSFZ)method.The temperature was increased to avoid the bubbles and cracks which may be formed during the preparation of the ingot material.We have started with the flux higher than the normal to avoid the bubbles and make good treatment for the solid-liquid interface.The structures of both Ca12Al14O33(C12A7)and Y0.02Ca11.98Al14O33(Y-C12A7)were studied by using x-ray diffraction(XRD).Optical properties for C12A7 and Y-C12A7 single crystals have been studied in order to determine the optical parameters such as optical energy gap(Eg),refractive index n,oscillating energy(Eo),dispersion energy(Ed),volume energy loss function(VELF),and surface energy loss function(SELF).Finally,a new result for these samples is that the third-order nonlinear optical susceptibility(χ(3))was determined.The results have been discussed with effect of Y-doping on the C12A7 single crystals for optical and industrial applications. 相似文献
2.
E. Fischer
G. Gorodetsky
R. M. Hornreich
《Solid State Communications》1972,10(12):1127-1132The existence of the magnetoelectric (ME) effect in the transition metal niobates and tantalates A2M4O9(A = Ta, Nb; M = Mn, Co) has been confirmed by the observation of the electrically induced magnetic moment in these materials. Both parallel and prependicular ME susceptibilities were measured as a function of temperature in powder specimens. The transition temperatures were found to be 110 ±1 (Nb2Mn4O9), 103 ±1 (Ta2Mn4O9), 27.0 ±0.5 (Nb2Co4O9), and 20.6 ±0.5°K (Ta2Co4O9) from the ME measurements. 相似文献
3.
Z. Ovadyahu 《Physica A》1993,200(1-4):462-468
The optical gap, Eg, of amorphous indium-oxide films is measured as a function of static disorder near the metal-insulator transition. On the insulating side of the transition the optical gap obeys a scaling relation, ΔEg = -E*Δg where E* is of the order of the Fermi energy of the given sample and g≡KFl. These results are ascribed to the continuous shift of the mobility-edge in the conduction band with disorder. 相似文献
4.
采用分子动力学模拟计算方法,考察具有较高层错能的Al纳米线沿不同晶向的力学行为和变形机制。在相同计算条件下与具有较低层错能的Ni、Cu、Au和Ag等FCC金属纳米线进行比较。结果表明:在力学行为方面,Al纳米线的弹性模量呈现明显的结构各向异性,满足E[111] > E[110] > E[100]的关系,这一关系在FCC金属纳米线中普遍成立;Al纳米线的屈服应力随晶向呈现σy[100] > σy[111] > σy[110]的关系,这一关系在具有较低层错能的FCC金属纳米线中不具有普遍性,这与体系中位错形成机制密切相关。根据拉伸变形过程微观结构的演变规律,阐明Al纳米线不同晶向的变形机制,并与具有较低层错能的Ni、Cu、Au和Ag等FCC金属纳米线的变形机制进行比较。结果表明,对于尺度较小的高层错能Al纳米线,Schmid因子和广义层错能均难以准确预测其变形机制。 相似文献
5.
在B3LYP/6-311++G(d,p)水平上预测了Al2O3H3分子的较低能量构型.其基态构型具有C s对称性,电子态为1A′.通过研究Al2O3M3和M2(M=H,D,T)的能量E、定容热容C V和熵S,用电子振动近似讨论了Al2O3+3/2M2→Al2O3M3反应的氢同位素效应,得到了Al2O3氢化的热力学函数?H0,?S0,?G0,及平衡压力与温度的关系.研究表明,氧化物Al2O3吸附氢(氘,氚)反应的同位素排代效应顺序为氚排代氘,氘排代氢,与钛等金属的同位素排代顺序相反.但排代效应都非常弱,且随着温度的增加趋于消失. 相似文献
6.
Electromagnetic coupling reduction in dual-band microstrip antenna array using ultra-compact single-negative electric metamaterials for MIMO application 下载免费PDF全文
In this paper, an ultra-compact single negative(SNG) electric waveguided metamaterial(WG-MTM) is first investigated and used to reduce the mutual coupling in E H planes of a dual-band microstrip antenna array. The proposed SNG electric WG-MTM unit cell is designed by etching two different symmetrical spiral lines on the ground, and has two stopbands operating at 1.86 GHz and 2.40 GHz. The circuit size is very compact, which is only λ_0/33.6 ×λ_0/15.1(where λ_0 is the wavelength at 1.86 GHz in free space). Taking advantage of the dual-stopband property of the proposed SNG electric WG-MTM, a dual-band microstrip antenna array operating at 1.86 GHz and 2.40 GHz with very low mutual coupling is designed by embedding a cross shaped array of the proposed SNG electric WG-MTM. The measured and simulated results of the designed dual-band antenna array are in good agreement with each other, indicating that the mutual coupling of the fabricated dual-band antenna array realizes 9.8/11.1 d B reductions in the H plane, 8.5/7.9 d B reductions in the E plane at1.86 GHz and 2.40 GHz, respectively. Besides, the distance of the antenna elements in the array is only 0.35 λ_0(where λ_0 is the wavelength at 1.86 GHz in free space). The proposed strategy is used for the first time to reduce the mutual coupling in E H planes of the dual-band microstrip antenna array by using ultra-compact SNG electric WG-MTM. 相似文献
7.
采用第一性原理方法,对BaTi2Bi2O的电子结构和磁性进行计算.非磁性态的计算结果显示:费米能级处的态密度主要来自dz2,dx2-y2和dxy三个轨道,同时费米面也主要有三部分组成,并且将其沿着矢量q1=(π/a,0,0)和q2=(0,π/a,0)平移时,第三部分费米面(沿着X-R连线)与第一部分费米面(M-A连线)嵌套明显,计算得出磁化系数χ0(q)在X点出现峰值,与峰值出现在M点的FeAs基超导体不同.上述磁化率峰值可以诱导产生自旋密度波,使得BaTi2Bi2O材料的磁性基态是bi-collinear antiferromagnetism(AF3)与blocked checkerboard antiferromagnetism(AF4)的二度简并态.随着空穴掺杂,χ0(q)的峰值降低,而电子掺杂则导致峰值变大.当自旋涨落被完全压制时,超导出现,这可以解释为什么超导只出现在空穴掺杂型化合物而非电子掺杂型. 相似文献
8.
9.
We have investigated the low-lying energy spectrum and electromagnetic transition strengths in even–even 76Se using the proton–neutron interacting boson model (IBM-2). The theoretical calculation for the energy levels and E2 and M1 transition strengths is in good agreement with the experimental data. Specifically, the excitation energy and E2 transition of ${0}_{2}^{+}$ state, which is intimately associated with shape coexistence, can be accurately reproduced. The analysis on low-lying states and the key structure indicators R1, R2, R3 and R4 and M1 transitions indicates that there is a coexistence between spherical shape and γ-soft shape in 76Se. 相似文献
10.
11.
Rekha Govil S. S. Kapoor D. M. Nadkarni S. R. S. Murthy P. N. Rama Rao 《Nuclear Physics A》1983,410(3):458-474
A simultaneous measurement of mass (M), charge (Z) and kinetic energy (Ek) distributions of fragments in thermal-neutron fission of 235U has been carried out using a back-to-back ΔE-E detector system. A pair of gridded ionization chambers filled with P-5 gas measured the energy losses ΔE1, ΔE2 of the complementary fragments in the gas, and the residual fragment energies were measured with a pair of semiconductor detectors. The four-parameter data were analysed to obtain fragment Z-distributions using the mass-momentum conservation relations to obtain M and then using the dependence of ΔE on E/M and Z. The charge resolution for the light-fragment group was determined at the gas pressures of 44, 150, 270 Torr and the best Z-resolution was obtained at 270 Torr. The data at this latter gas pressure were analysed to obtain the variances σ2z of the fragment charge distributions for different Ek windows and this was compared with the measured variances σ2A of the fragment mass distribution as a function of Ek as obtained by twoparameter measurements of the correlated fragment energies. The dependence of the measured variances σ2A, σ2Z on Ek is considered with a view to learning about the degree of neutron-proton correlations in the nucleon exchanges taking place during the mass division in fission, in analogy with that used in the case of heavy-ion deep inelastic collisions (DIC). The variation of σ2A/σ2z with Ek observed in the present work, which is somewhat similar to that seen in heavy-ion DIC, implies that the fragment mass division in fission is governed by nucleon-exchange processes, where the degree of neutron-proton correlations is dependent on the total kinetic energy Ek. While for very large Ek the neutron-proton motion in the exchange processes is found to be uncorrelated, for lower Ek values the motion is seen to be correlated. Implications of these results regarding the applicability of fission models such as statistical model are pointed out. 相似文献
12.
The diffusion of W on a (211) plane of a W field emitter has been re-examined by means of the fluctuation autocorrelation method. Diffusion along channels yielded E = 16.8 ± 0.5 kcal, D0 = (3 ± 1) × 10−5 cm2 s−1. For diffusion across channels E =6.6 kcal, D0 = 4 × 10−9cm2 s−1 at T < 752 K, and E = 24 kcal, D0 = 5 × 10−4 cm2 s−1 at T > 752 K. The results for diffusion along channels yield E and D0 values intermediate between recent results by Wang and Ehrlich [Surf. Sci. 206 (1988) 451] using field ion microscopy (E = 19 kcal, D0 = 7.7 × 10−3 cm2 s−1) and Tringides and Gomer [J. Chem. Phys. 84 (1986) 4049], using the same method as the present work but a larger slit (E = 13.3 kcal, D0 = 7 × 10−7 cm2 s−1). The results for cross channel diffus good agreement with those of Tringides and Gomer below 752 K, where these authors stopped. The new high temperature results suggest that the channel wall exchange mechanism postulated by Tringides and Gomer for cross channel diffusion at low T gives way to diffusion by climbing over the channel walls with higher E but also higher D0 above 752 K. Possible reasons for the discrepancies between these three sets of results and the absence of cross channel diffusion in the work of Wang and Ehrlich are briefly discussed. 相似文献
13.
Investigation of inhomogeneous barrier height of Au/Bi4Ti3O12/n-Si structure through Gaussian distribution of barrier height 下载免费PDF全文
Au/Bi4Ti3O12/n-Si structure is fabricated in order to investigate its current-voltage (I-V) characteristics in a temperature range of 300 K-400 K. Obtained I-V data are evaluated by thermionic emission (TE) theory. Zero-bias barrier height (ΦB0) and ideality factor (n) calculated from I-V characteristics, are found to be temperature-dependent such that ΦB0 increases with temperature increasing, whereas n decreases. Obtained temperature dependence of ΦB0 and linearity in ΦB0 versus n plot, together with lower barrier height and Richardson constant values obtained from Richardson plot, indicate that the barrier height of the structure is inhomogeneous in nature. Therefore, I-V characteristics are explained on the basis of Gaussian distribution of barrier height. 相似文献
14.
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J1、J2及格点自旋sa、sb密切相关。 相似文献
15.
Y. Atalay A. Baolu D. Avc M. Arslan T. Ozturk E. Ertas 《Physica B: Condensed Matter》2008,403(12):1983-1989
The synthesis and optical properties of the 5,5′,6,6′-tetraphenyl-2,2′-bi([1,3]dithiolo [4,5-b] [1,4]dithiinylidene)–2,3-dichloro-5,6-dicyano-p-benzoquinone (DDQ) complex thin film were investigated by the optical characterization. The optical constants such as refractive index, extinction coefficient and absorption coefficient were determined using the transmittance T(λ) and reflectance R(λ) spectra and the refractive index dispersion was analyzed using single oscillator of Wemple–Didomenico model. The single oscillator energy E0 and the dispersion energy Ed were calculated. The effect of temperature on refractive dispersion and optical band gap Eg is also discussed. As a result, the annealing temperatures have an important effect on refractive index of thin film. 相似文献
16.
Structural modulation and physical properties of cobalt-doped layered La_2M_5As_3O_2(M=Cu,Ni) compounds 下载免费PDF全文
《中国物理 B》2021,30(7):76106-076106
We investigate the structural variation and physical properties of layered La_2M_5As_3O_2(M=Cu,Ni) compound upon Co doping. It is found that the substitution of Co ion just induces the monotonous change of lattice constants without observing the anomalous kink in superconducting La_2(Cu~(1-x)Nix)_5 As_3O_2 solid-solutions. Meanwhile, this doping barely changes As–As bond length in [M_5As_3]~(2-) subunit(±2%), being significantly smaller than 7% shrinkage of that in La_2(Cu~(1-x)Nix)_5 As_3 O_2. Therefore, the doping dependence of crystal structure exhibits similar trend with Ba~(1-x)K_xFe_2 As_2 without the interference of As1–As 2 bonding, implying that the Co substitution for Cu/Ni is hole-doped. In terms of physical property, La2(Cu1-xCox)~5As_3O_2 turns into itinerant ferromagnetic metal, while La2(Ni1-x Cox)5 As3 O2 shows paramagnetism and suppressed structural phase transition upon Co-doping. The distinct structural variation and absence of superconductivity provide important clues to understand the effect of As–As bond in [M_5 As_3]~(2-) subunit. 相似文献
17.
MC与$lt;i$gt;M$lt;/i$gt;$lt;sub$gt;$lt;i$gt;n$lt;/i$gt;+1$lt;/sub$gt;$lt;i$gt;AC$lt;/i$gt;$lt;sub$gt;$lt;i$gt;n$lt;/i$gt;$lt;/sub$gt;稳定性与电子特征的第一性原理研究 下载免费PDF全文
研究MC与Mn+1ACn(M=Sc, Ti, V, Cr, Mn; A=Al, Si, P, S; n=1, 2, 3)结构的稳定性与电子特征有利于探究三元层状结构Mn+1ACn稳定性的内在原因和设计新型Mn+1ACn结构. 第一性原理计算研究表明, M-3d与C-2p轨道间的电子转移对MC与Mn+1ACn 的形成焓有较大影响. 供电子能力较强的前过渡金属可以形成稳定的MC结构. 计算结果显示, MC结构是缺电子体系, 其趋向于与具有一定供电子能力的MA结构结合形成Mn+1ACn. 与M2PC和M2SC 相比, M2AlC和M2SiC可以更为容易地被分离成二维 M2C结构.
关键词:
MAX相结构
第一性原理
电子结构
过渡金属碳化物 相似文献
18.
V. R. Shaginyan A. Z. Msezane G. S. Japaridze K. G. Popov J. W. Clark V. A. Khodel 《Frontiers of Physics》2016,11(2):117102
We reveal and explain the scaling behavior of the thermopower S/T exhibited by the archetypal heavy-fermion (HF) metal YbRh2Si2 under the application of magnetic field B at temperature T. We show that the same scaling is demonstrated by different HF compounds such as β-YbAlB4 and the strongly correlated layered cobalt oxide [BiBa0.66K0.36O2]CoO2. Using YbRh2Si2 as an example, we demonstrate that the scaling behavior of S/T is violated at the antiferromagnetic phase transition, while both the residual resistivity ρ0 and the density of states, N, experience jumps at the phase transition, causing the thermopower to make two jumps and change its sign. Our elucidation is based on flattening of the single-particle spectrum that profoundly affects ρ0 and N. To depict the main features of the S/T behavior, we construct a T –B schematic phase diagram of YbRh2Si2. Our calculated S/T for the HF compounds are in good agreement with experimental facts and support our observations. 相似文献
19.
An analysis is made of Tougaard-style backgrounds for homogeneous materials to show how parameters interact together and comprise the general inelastic scattering background in electron spectroscopy. It is shown that insight is usefully gained by rewriting the Tougaard universal loss function in terms of two parameters, the characteristic energy, E1, of the exponential decay observed in multiple self-convolutes of the Tougaard universal single loss function, and the centroid energy
of the single loss function. Close fits to the measured background may be made over a wide energy range for only one value of E1 which defines a unique relation between Tougaard’s B and C values but does not give the unique values themselves. For the single value of E1, the centroid energy
may be varied such that the background subtracted spectra range from those shown by Tougaard, where the intrinsic shake-up and losses may constitute two thirds of the peak intensity, to spectra similar to those of Jo in which all of the intrinsic losses are removed. Studies of Al X-ray excited Sc, Cu, Sm and Au photoelectron spectra, each of which has an extensive range of peaks, show that the relative intensities of the peaks are unaffected by the choice of the value of
even though the absolute peak areas may change by a factor of 3. 相似文献
20.
Let M be a symplectic manifold with a Hamiltonian circle action with isolated fixed points. We prove that σ (M) = b0(M) − b2(M) + b4(M) − b6(M) + … where σ (M) is the signature of M and bi(M) is the ith Betti number of M. 相似文献