Huanhuan Cheng,Abudukadi Tudi,Peng Wang,Kewang Zhang,Zhihua Yang,Shilie Pan
A new ternary Ba-based selenide, Ba3SiSe5, was synthesized by a high-temperature solid-state method. It crystallizes in the centrosymmetric space group Pnma (no. 62) of the orthorhombic system. The structure of the title compound consists of unique Se(4)Ba layers and discrete SiSe4 tetrahedra. The structure and computational properties of Ba3SiSe5 are systematically studied together with those of the Ba–MIV–Q (MIV = Si, Ge; Q = S, Se) system, and show an interesting difference in dimensions formed by one of the crystallographic Ba atoms and MIVQ4 tetrahedra, as well as optical property transformations modulated by MIV atoms. First principles methods were employed to obtain a better understanding of the relationship between structures and properties. Ba3SiSe5 maintains a moderate birefringence of 0.044@1064 nm and the real space atom cutting method indicates that the SiSe4 tetrahedra make the major contribution to its birefringence.
Despite of increased interest in the application of miniature microplasma atomic spectrometry for environmental analytical chemistry , the amenable element detection range is limited to some metal elements and carbon due to it low power consumption. In this work, the generation of silicon atomic emission (251.6 nm and 288.2 nm) from the organosiloxanes was found possible in a low-temperature, low-power, and compact point discharge. Consequence, a tiny point discharge silicon optical emission spectrometer (μPD-OES) was exploited, and used as a novel GC detector for the determination of various cyclic volatile methyl siloxanes (cVMSs). Under the optimized conditions, the developed system provided limits of detection (LODs) of 0.2 mg L −1 , 0.04 mg L −1 , 0.03 mg L −1 and 0.02 mg L −1 of Si for hexamethylcyclotrisiloxane, octamethylcyclotetrasiloxane , decamethylcyclopentasiloxane and dodecamethylcyclohexasiloxane, respectively. Meanwhile, relative standard deviations (RSDs) of better than 2.3% were obtained. In contrast to gas chromatography mass spectrometer , GC-μPD-OES significantly simplifies the experimental setup with low power consumption and a miniature configuration. As far as we know, this work reports for the first time that silicon atomic emission can be generated in such low temperature microplasma. The accuracy of this system was validated by determining cVMSs in five daily-used shampoo samples collected from retail store, providing satisfactory recoveries (84%–114%) and excellent agreement with values determined by GC-MS at the 95% confidence level.
危险品化学品经营许可证（带存储）