煤中吡啶型氮热解机理的量子化学研究

用密度泛函 ( DFT)方法 ,在 UB3LYP/6- 31 G( d)水平上研究了煤中吡啶型氮的热解机理 ,对热解过程中由于官能团周围环境的不同而形成的三类吡啶自由基进行了量子化学计算 ,通过对键的 Mulliken布居数等计算结果的分析 ,分别得到了这三类自由基的热解途径 .并优化得到了反应物、中间体和产物的几何构型 .计算结果表明 ,吡啶型氮主要是以 HCN的形式释放出来的 .NH3 是 HCN二次反应的产物 .     

4-(6′甲基苯并噻唑-2′-偶氮)-3,5-二氨基吡唑与钯显色反应的研究和应用

对6种苯并噻唑偶氮吡唑化合物的分析特性进行了探讨,着重研究了4—(6′—甲基苯并噻唑-2′-偶氮)-3,5-二氨基吡唑(MBTAP)与钯离子显色反应的光度性质。在非离子表面活性剂 Brij35存在下与钯离子形成橙红色的配合物。适宜的 pH 值范围为9.0～10.5.配合物的最大吸收波长为510nm,表观摩尔吸光系数为3.01×10~4L·mol~(-1)·cm~(-1)。钯在0～14μg/25mL,范围内服从比尔定律.显色体系可稳定11h。在柠檬酸存在下可消除 Fe~(3+)、Co~(2+)、Cu~(2+)、Ni~(2+)等离子的干扰。     

Formation Mechanisms of Platelet Sr3Ti2O7 Crystals Synthesized by the Molten Salt Synthesis Method

The molten salt synthesis (MSS) method is utilized to synthesize the anisotropic platelet Sr₃Ti₂O₇ (S3T2) single-crystal particles. The aim of this study is to identify the essence of platelet Sr₃Ti₂O₇ crystal growth and guide the synthesis of anisotropic platelet SrTiO₃ crystals as well as various technologically important materials. Based on the results of X-ray diffraction, scanning electron microscopy, and high-resolution transmission electron microscopy, the formation mechanism of platelet Sr₃Ti₂O₇ crystals conforms to a nucleation–structure rearrangement–dissolution–diffusion in situ epitaxial growth mechanism model. First, SrCO₃ reacts with TiO₂ to form submicrometer SrTiO₃ nuclei. Then, most of the nuclei surrounded by salt ions aggregate and rearrange to form a large SrTiO₃ matrix. The structural rearrangement and the subsequent in situ epitaxial growth processes control the morphology, composition, and size of the final Sr₃Ti₂O₇ crystals. In the synthesis process, the conversion between SrTiO₃ and Sr₃Ti₂O₇ is as follows: and the crystallographic orientation relationship between Sr₃Ti₂O₇ and SrTiO₃ in the interface is (100)_S3T2//{100}_ST, (010)_S3T2//{010}_ST, and (001)_S3T2//{001}_ST.     

Electrocatalytic properties of NDGA and NDGA/FAD hybrid film modified electrodes for NADH/NAD redox reaction

The fabrication of monolayers composed of nordihydroguaiaretic acid (NDGA), and hybrid films composed of NDGA-flavin adenine dinucleotide (FAD) adsorbed films was performed in neutral aqueous solutions to produce electrochemically active thin films exhibiting one and two redox couples, respectively. An electrochemical quartz crystal microbalance and cyclic voltammetry were used to study the in situ growth of the NDGA and hybrid NDGA/FAD film monolayers. The NDGA modified film electrocatalytically oxidized NADH, ascorbic acid, dopamine, and N₂H₄ in neutral aqueous solutions. Well-separated voltammetric peaks were observed for dopamine and uric acid mixtures, and also for ascorbic acid and uric acid mixtures using the NDGA/GC modified electrode. When transferred to various aqueous buffered solutions, the two redox couples of the NDGA/FAD hybrid film and their formal potentials were observed to be pH-dependent. The electrocatalytic oxidation and reduction of NADH and NAD⁺ by a NDGA/FAD hybrid film in neutral aqueous solutions was carried out, and the electrocatalytic oxidation of NADH was performed using a NDGA/FAD hybrid film.     

PPS的共混改性

简要介绍了聚苯硫醚(PPS)与其他聚合物进行共混改性的研究进展。着重讨论了PPS PA66、PPS PC、PPS PPO等的共混及其性能。此外,展望了PPS合金的发展前景。     

溴虫腈土壤和甘蓝微量残留量的气相色谱法测定

采用气相色谱法定量分析溴虫腈土壤和甘蓝微量残留量。样品经丙酮提取 ,液 液分配及氧化铝柱层析法净化后 ,以GC ECD测定 ,DB 170 1毛细管柱 ,氮气为载气 ,柱温 2 6 0℃ ,汽化室温度 2 5 0℃ ,检测器温度 2 80℃ ,外标法定量。该方法快速、准确 ,在 0 0 1～ 2 0 0mg/L范围内线性相关系数r2 =0 9999,平均回收率 90 0 %～ 10 3 6 7% ,变异系数 4 4 8%～ 5 89% ,最小检测量 2× 10 12 g ,最低检出浓度 3 3× 10 4mg/kg。     

腐植酸类液体肥料生产技术和产品质量中的几个问题

本文通过胶体化学基本原理和实验数据，对水剂型腐植酸类液体肥料的组分、性质、浓度、流动性、稳定性、抗絮凝性等若干技术和质量问题进行了探讨，并提出一些改进建议。     

钴钼系耐硫变换催化剂硫化与水解问题探讨

钴钼系耐硫变换催化剂硫化与水解问题一直受到人们的关注。许多研究人员对硫化水解做了大量的报道，但都以热力学平衡为基础，计算出的结果存在理论和实际相背离。因此，作者想从化学平衡和动力学双重角度对硫化与水解问题做一探讨。     

煤的荧光特性与其工艺性能的关系研究

简述了煤中镜质组荧光产生的机理及荧光参数的测量方法,通过测定一系列煤的粘结性和10kg小焦炉结焦性试验,探讨了煤的荧光特性与其工艺性能的关系。煤的荧光参数与其反射率呈正的线性相关关系,与其挥发分含量呈负的线性相关关系;煤的粘结性、结焦性均与其荧光参数有关;当煤化程度相同、煤岩组成基本相同时,煤的荧光强度愈强,其结焦性能愈好。     

基于灰色模糊层次分析法的企业云服务安全评价模型

从企业实施云服务项目角度,总结得出影响云服务安全的四大因素,即平台设施、运行安全、运营管理以及法律法规因素。在此基础上构建企业云服务安全评价模型,并利用灰色模糊层次分析法（ GFAHP）对模型进行综合评价。最后通过一个实例进行具体阐明与评价。