A non-standard auxiliary integrating sphere and correction method for the realization of diffuse reflectance

To realize spectral diffuse reflectance scale in 0/d geometric condition at National Institute of Metrology in China (NIM), a facility based on a non-standard auxiliary integrating sphere method with special structure has been built up and a correction method for the influence on the thickness of PTFE (polytetrafluoroethylene) coating at the port of auxiliary integrating sphere is mainly discussed. The uncertainty of spectral diffuse reflectance in NIM is approximately 0.25% (k = 2) in 380–800 nm. This facility has been used to establish China diffuse reflectance scales in the VIS–NIR part of the spectrum. This system and correction method presented in this paper can be easily implemented on most commercial spectrophotometers with a lower cost.     

Effects of Soret diffusion on the laminar flame speed and Markstein length of syngas/air mixtures

The effects of Soret diffusion on premixed syngas/air flames at normal and elevated temperatures and pressures are investigated numerically including detailed chemistry and transport. The emphasis is placed on assessing and interpreting the influence of Soret diffusion on the unstretched and stretched laminar flame speed and Markstein length of syngas/air mixtures. The laminar flame speed and Markstein length are obtained by simulating the unstretched planar flame and positively-stretched spherical flame, respectively. The results indicate that at atmospheric pressure the laminar flame speed of syngas/air is mainly reduced by Soret diffusion of H radical while the influence of H₂ Soret diffusion is negligible. This is due to the facts that the main reaction zone and the Soret diffusion for H radical (H₂) are strongly (weakly) coupled, and that Soret diffusion reduces the H concentration in the reaction zone. Because of the enhancement in the Soret diffusion flux of H radical, the influence of Soret diffusion on the laminar burning flux increases with the initial temperature and pressure. Unlike the results at atmospheric pressure, at elevated pressures the laminar flame speed is shown to be affected by the Soret diffusion of H₂ as well as H radical. For stretched spherical flame, it is shown that the Soret diffusion of both H and H₂ should be included so that the stretched flame speed can be accurately predicted. Similar to the laminar flame speed, the Markstein length is also reduced by Soret diffusion. However, the reduction is found to be mainly caused by Soret diffusion of H₂ rather than that of H radical. Moreover, the influence of Soret diffusion on the Markstein length is demonstrated to decrease with the initial temperature and pressure.     

The electronic and magnetic properties with intrinsic defects in ZnO nanosheets: First-principles prediction

Using full-potential linearized augmented plane wave (FLAPW) method, we investigated the effects of intrinsic vacancies on electronic and magnetic properties in graphene-like ZnO nanosheets. The results show that the oxygen vacancy (V_O) has no influence on magnetism in ZnO nanosheet, whereas the Zn vacancy (V_Zn) lead to spin polarization of the nanostructures with a total magnetic moment of 2.0μ_B due to O-2p and Zn-3d hybridization. When the distance of two V_Zn defects increases to 6.499 Å, the system shows an intriguing half-metallic character with 100% spin-polarized carriers due to O(2p)–Zn(3d)–O(2p) coupling chain between two V_Zn defects.     

Spin-Hamiltonian parameters,defect model and defect structure for the tetragonal Mo5+ center in x-ray-irradiated α-ZnMoO4 crystals

ABSTRACT

The spin-Hamiltonian parameters (g factors g_i, hyperfine structure constants A_i (⁹⁵Mo⁵⁺) and A_i (⁹⁷Mo⁵⁺), i?=?// and ⊥) assigned to the tetragonal Mo⁵⁺ (4d¹) tetrahedral center in α-ZnMoO₄ crystal caused by a Mo⁶⁺(1) ion trapping an electron after x-ray irradiation are calculated from the high-order perturbation formulas resting on the two-mechanism model. The model takes account of both the effects of crystal-field (CF) mechanism concerning the CF excited states in the CF theory and that of the charge-transfer (CT) mechanism related to CT excited states. The calculated results are reasonably consistent with the experimental values, confirming this assignment (or defect model). The calculations also indicate that the effect of CT mechanism cannot be neglected. The defect structure (particularly, the angular distortion) and signs of constants A_i (⁹⁵Mo⁵⁺) and A_i (⁹⁷Mo⁵⁺) of this Mo⁵⁺ defect center are also decided from the calculations. The outcomes are discussed.     

Tetragonal distortions of the octahedral environments of Cr3+, Fe3+ and Gd3+ ions in A2CdF4 (A = Rb,Cs) and ACdF3 crystals

Abstract

The tetragonal distortions of local octahedral environments of Cr³⁺, Fe³⁺ and Gd³⁺ ions in Rb₂CdF₄, Cs₂CdF₄, RbCdF₃ and CsCdF₃ crystals have been studied by analyzing their EPR spectra. From the studies, it is found that the tetragonal distortions for Cr³⁺ and Fe³⁺ impurity ions, which substitute Cd²⁺ and have nearly the same ionic radius, are close to each other, whereas that for Gd³⁺ impurity ion, having a larger ionic radius, is larger than those for Cr³⁺ and Fe³⁺ ions in the same crystal. It appears that not only the impurity-ligand distance, but also the tetragonal distortions of impurity centres in crystals are closely related to the size of impurity.     

夹芯梁的精确解法

夹芯梁与普通梁的本质区别在于剪切引起芯层横截面严重的而又不均匀的翘曲变形,其应力分布已远非初等理论所能描述,而正在广泛应用的经典夹层理论却都建立在平面假设基础上,尤其不能正确反映弱芯的轻质夹层结构的行为,本文放弃了不合理的假设,将夹芯梁视为一般层状弹性体,严格按弹性理论导出了既满足控制方程又同时满足全部边界条件、层间的应力及位移的连续条件的封闭解.它可确切地反映夹芯梁的位移形态和应力分布,并从不同角度,包括多种实验和FEM数值解,验证了它的正确性.     

生物矿化法制备HgS/聚氨酯复合薄膜及其对Ba2+的传感性能

通过生物矿化法制备出HgS/聚氨酯纳米复合材料并用FTIR、SEM等对材料进行了表征. 研究发现聚氨酯分子可以控制HgS的成核和晶体生长. 聚氨酯的量子限域效应已通过紫外-可见光谱证实,在约291 nm处有明显的特征吸收峰. 荧光性能研究结果表明HgS/聚氨酯纳米粒子复合薄膜对Ba²⁺的存在十分敏感,少量的Ba²⁺会使荧光强度明显上升,水中常见离子几乎对此没有影响.     

氟化氙(C-A蓝绿激光技术研究进展

 综述了XeF(C-A)激光的产生原理，表面放电光泵浦源的结构，激光器装置， XeF(C-A)激光实验研究以及XeF(C-A)激光理论模拟；介绍了XeF₂浓度的监测，以及表面放电光泵浦源技术研究的最新进展。     

分子高激发振动态的动力学特性研究

运用经典哈密顿代数方法,结合单摆的运动特点表示两个化学键之间的振动耦合.对水分子高激发态下两个氧氢键(O—H)伸缩振动动力学的研究结果表明,靠近分界线的中间能级的相空间中较易出现混沌轨道,而较高或较低能级的相空间中则具有比较规则的周期运动 关键词： 高激发振动 共振 混沌     

KNSBN晶体猫式互抽动相位共轭光特性

在KNSBN：Ce晶体中，利用二波耦合作用，在单一光束无法获得相位共轭光的条件下，实现了“猫”式互抽运相位共轭光输出，获得较高的共轭光发射率，实验结果表明，晶体的二波耦合作用可以使晶体的自抽运相位共轭光的阈值光强降低。入射光的入射角范围增大，响应时间缩短。