纤维素在离子液体[AMMor]Cl/[AMIm]Cl混合溶剂中的均相乙酰化反应研究

利用混配离子液体N-烯丙基-N-甲基吗啉氯盐(N-allyl-N-methylmorpholinium chloride,[AMMor]Cl)和1-烯丙基-3-甲基咪唑氯盐(1-allyl-3-methylimidazolium chloride,[AMIm]Cl)作为溶剂,乙酰氯为乙酰化试剂,研究了在没有催化剂条件下的纤维素的均相乙酰化反应.生成的醋酸纤维素(CA)的取代度由2.58到3.00.用FT-IR,1HNMR和13CNMR进行表征.结果表明,[AMMor]Cl/[AMIm]Cl混配的离子液体是一种良好的均相乙酰化介质,纤维素C-6,C-3和C-2三个位置上的羟基均发生了乙酰化反应,且得到纯的纤维素醋酸酯.此反应方便可控,简单高效,不仅降低了成本,离子液体比较容易回收,可以再次利用.     

基于深度学习的红外目标成像液位检测方法

容器液位检测是工业生产及化工原料储存、运输过程中的重要环节,针对现有液位检测技术中传感器布置容易受空间限制,在高温高压、灰尘、潮湿等特殊环境下传感器寿命短等问题,提出了一种基于深度学习的红外目标成像液位检测方法.通过对容器红外图像标注数据集进行优化训练,得到可以准确识别容器内液体百分比含量的模型.首先,构建储罐液位标准数据集,并搭建基于Pytorch的深度学习目标检测框架.然后,在输入端对图像进行数据增强,调整模型的宽度和深度,优化训练检测模型.最后,采用特征金字塔网络和路径聚合网络结构融合不同尺寸特征图的特征信息,用联合交并比计算边界框的回归损失,并在后处理过程中引入加权非极大值抑制.实验结果表明,该模型具有较好的鲁棒性和识别效果,在交并比为0.5时的平均精度均值可达到0.804.     

Oxidation pattern of small silicon oxide clusters: structures and stability of Si6On (n = 1-12)

We have performed systematic ab initio calculations to study the structures and stability of Si(6)O(n)() clusters (n = 1-12) in order to understand the oxidation process in silicon systems. Our calculation results show that oxidation pattern of the small silicon cluster, with continuous addition of O atoms, extends from one side to the entire Si cluster. Si atoms are found to be separated from the pure Si cluster one-by-one by insertion of oxygen into the Si-O bonds. From fragmentation energy analyses, it is found that the Si-rich clusters usually dissociate into a smaller pure Si clusters (Si(5), Si(4), Si(3), or Si(2)), plus oxide fragments such as SiO, Si(2)O(2), Si(3)O(3), Si(3)O(4), and Si(4)O(5). We have also studied the structures of the ionic Si(6)O(n)(+/-) (n = 1-12) clusters and found that most of ionic clusters have different lowest-energy structures in comparison with the neutral clusters. Our calculation results suggest that transformation Si(6)O(n)+(a) + O --> Si(6)O(n+1)+(a) should be easier.     

Linearly polarized emission of an organic semiconductor nanobelt

Linearly polarized emission has been observed for the nanobelts fabricated from a perylene diimide molecule through both solution-based and surface-supported self-assembling. The measurement of polarized emission was performed over single nanobelts with use of a near-field scanning optical microscope (NSOM) adapted with emission polarization (by putting a planar polarizer before the detector). Rotating the emission polarizer (from 0 degrees to 180 degrees) changed the emission intensity in a way depending on the relative angle between the long axis of the belt and the polarizer with a minimum of intensity detected at ca. 78 degrees, which is indicative of the tilted stacking of molecules along the belt direction.     

Visible photooxidation of dibenzothiophenes sensitized by 2-(4-methoxyphenyl)-4, 6-diphenylpyrylium: an electron transfer mechanism without involvement of superoxide

We report here on a new electron-transfer mechanism for visible-light photooxidation of sulfides in which no superoxide ion is involved. Visible-light irradiation of 2-(4-methoxyphenyl)-4, 6-diphenylpyrylium tetrafluoroborate (MOPDPP(+)BF(4)(-)) in an O(2)-saturated acetonitrile solution containing dibenzothiophene (DBT) results in nearly 100% conversion to oxygenated products, DBT sulfoxide and sulfone. The photooxidation of DBT is initiated by a photoinduced electron-transfer process, where the excited MOPDPP(+) traps an electron from the ground-state DBT to form MOPDPP(*) and DBT radical cation. Such a mechanism is consistent with the studies of laser flash photolysis, electron spin resonance, and fluorescence quenching of the irradiated system. The photogenerated DBT radical cation undergoes a coupling reaction with O(2) to produce the intermediate responsible for the formation of the oxygenated products. The presence of O(2) has no effect on the decay kinetics of the transient absorption of MOPDPP(*), indicating that no redox reaction occurs between MOPDPP(*) and O(2), and thus no superoxide ion (O(2)(*-)) is formed. Moreover, the ESR signal of MOPDPP(*) was significantly enhanced in the presence of O(2), consistent with the assumption that the photogenerated DBT radical cation couples with O(2) to form the oxygen-adduct, which is subject to further reactions (Scheme 3) leading to the final oxygenated products. Similar results have been obtained when using 10-methylacridine hexafluorophosphate (AcrH(+)PF(6)(-), which has similar reduction potential in the ground state as MOPDPP(+)) as the sensitizer. This finding provides a possibility for the photooxidation of sulfides with dioxygen utilizing visible light (solar energy) and is also of significance in clarification of the reaction mechanism.     

Study on Z-scan characteristics of multilayer nonlinear media using coordinate transformation method

We present a method that combines coordinate transformation and Crank-Nicholson finite difference scheme to simulate numerically Z-scan measurements of a multilayer nonlinear medium or a complicated multilayer structure. The method would be useful to design and optimize optical limiters and to determine the nonlinearities of cascading medium layers. The method has given a guideline for determining the characteristics of multilayer medium.     

Generation of picoseconds stimulated Raman scattering in a BaWO4 crystal and frequency up-conversion by difference-frequency generation in BBO

The characters of stimulated Raman scattering of BaWO₄ crystal excited by a picoseconds laser at 1064 nm are studied based on optical parametric amplification (OPA). Up to six-order Stokes components and five-order anti-Stokes components are observed. The SRS components are amplified by an OPA and the wavelength tunable range from 411 to 2594 nm is achieved with a maximum conversion efficiency of 38% using the OPA stage.     

Optical properties of the Au–Ag alloy nanowire coated with an anisotropic shell

The optical properties of the Au–Ag alloy nanowire coated with a cylindrical shell with radial dielectric anisotropy are investigated based on quasistatic theory. Numerical results show that the surface plasmon resonance (SPR) peak is redshifted with increasing the component ratio of Au in the alloy, while the intensity of extinction section at the SPR increases with increasing the component ratio of Ag in the alloy. In addition, as the extent of anisotropy of the shell increases, the extinction section at SPR wavelength decreases and the SPR wavelength is redshifted, but compared with the isotropic shell consisting of comparable dielectric constant materials, the SPR has a distinct blueshift for anisotropic shell. We also find that the field enhancement can be completely concentrated inside the anisotropic shell and the electromagnetic transparency can be exhibited.     

六味地黄丸指纹图谱的近红外光谱分析方法的建立

建立了一种近红外光谱测定六味地黄丸指纹图谱的方法。应用毛细管电泳法建立六味地黄丸指纹图谱,计算其相似度,同时测定其近红外光谱,建立六味地黄丸指纹图谱相似度与近红外光谱之间的数学模型。通过对模型的优化,建模集样品的相关系数(r)、校正标准差和平均相对误差分别为0.9046,0.058和6.12%,表明六味地黄丸指纹图谱相似度实测值与预测值之间有较好的线性关系。研究结果表明以基于指纹图谱的近红外光谱法用于六味地黄丸的质量控制具有可行性。     

离子注入ZnO薄膜的拉曼光谱研究

室温下,用80 keV N⁺和400 keV Xe⁺离子注入ZnO薄膜,注入剂量分别为5.0×10¹⁴—1.0×10¹⁷/cm²和2.0×10¹⁴—5.0×10¹⁵/cm².利用拉曼散射技术对注入前后的ZnO薄膜进行光谱测量和分析,研究了样品的拉曼光谱随离子注入剂量的变化规律.实验结果发现,未进行离子注入的样品在99,435 cm<