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81.
Brena B Zhuang GV Augustsson A Liu G Nordgren J Guo JH Ross PN Luo Y 《The journal of physical chemistry. B》2005,109(16):7907-7914
The electronic structure of pure poly(ethylene oxide) (PEO) for four different polymeric chain conformations has been studied by Hartree-Fock (HF) and density functional theory (DFT) through the analysis of their valence band photoelectron spectroscopy (VB-PES), X-ray emission spectroscopy (XES), and resonant inelastic X-ray scattering (RIXS). It is shown that the valence band of PEO presents specific conformation dependence, which can be used as a fingerprint of the polymeric structures. The calculated spectra have been compared with experimental results for PEO powder. 相似文献
82.
Metal organic frameworks (MOFs) derived carbonaceous materials have a wide range of applications in the fields of energy storage, catalysis, adsorption and separation, etc. Especially, zeolitic imidazolate framework-8 (ZIF-8) is an excellent candidate to synthesize porous carbon due to the large surface area and high nitrogen content. However, the dominated microporous structure of ZIF-8-derived carbon significantly hinders ionic mass transfer, limiting the improvement of performance. Herein, MOF-derived mesoporous carbon was prepared using ZIF-8 as carbon precursor and cheap sodium silicate (Na2SiO3) as activator. The introduction of Na2SiO3 created rich mesoporous structure and increased specific surface area, as well as the effects of pyrolysis temperature and Na2SiO3 dosage on performance was also investigated. The obtained ZIF-derived porous carbon exhibits good electrochemical performance with specific capacitance of 263 F/g at 1 A/g and excellent cycle life (96.07% after 10,000 GCD cycles) in supercapacitor. The use of cheap Na2SiO3 activator provides a new orientation for the preparation of MOF-derived carbons with rich pores, high surface area, and facilitates the large-scale application of MOF-derived carbons. 相似文献
83.
Zhenguang Lin Huayang Chen Junning Zhuang Yang Wu Yujuan Lin 《Journal of inclusion phenomena and macrocyclic chemistry》1998,30(1):13-19
A new clathrate inclusion compound of 2,3:11,12:20,21:29,30-tetrabenzo-1,13,16,19,31,34-hexaoxa-5,6,8,9,23,24,26,27- octaaza-7,25-dithioketone-2,3:4,5:9,10:11,12:22,23:27,28:29,30-cyclo-[36]ene([ 36]eneO6N8), which contains THF, has been prepared and crystallizes in the monoclinic space group P21/n with a = 9.829(5)Å, b = 24.23(1)Å, c = 10.181(9)Å, = 92.93(5)-. Each unit cell contains two [36]ene-O6N8 molecules and four THF molecules. The [36]ene-O6N8 molecule lies on the crystallographic centre of symmetry and a pair of the THF molecules with half-chair conformation are located within rectangular channels formed by the macrocycle molecules. 相似文献
84.
测定核黄素的化学发光新方法 总被引:4,自引:0,他引:4
研究了核黄素的化学发光性质,建立了一种测定核黄素的化学发光新方法,并应用于实际样品中核黄素的测定,与文献相比,本方法无需避光,而且分析体系和样品处理简单;干扰小,牛血清白蛋白、抗坏血酸、天冬氨酸等8种生物有机物质和 Cu(Ⅱ)、Zn(Ⅱ)、Fe(Ⅲ)等15种常见金属离子的允许量较大;核黄素溶液浓度在0. 10~50 mg/L范围内,与化学发光强度成正比,方法线性范围宽;测定1.0mg/L核黄素溶液12次,求得相对标准偏差为2.9%,方法精密度高;方法的检测限为0.075 mg/L,灵敏度高。 相似文献
85.
86.
Li Jiang Fushen Lu Qing Chang Yang Liu Huibiao Liu Yuliang Li Wei Xu Guanglei Cui Junpeng Zhuang Xiaofang Li Shu Wang Yinglin Song Daoben Zhu 《Chemphyschem》2005,6(3):481-486
An ultrathin composite film containing anionic Ag-His complexes (His: L-Histidine) and oppositely charged BH-PPV was fabricated by means of the electrostatic layer-by-layer self-assembly technique. UV/Vis spectra showed a continuous deposition process of Ag-His complexes and BH-PPV. The film structure was characterized by using small-angle X-ray diffraction, AFM, and SEM. The nonlinear optical properties of the ultrathin film were studied by using the Z-scan technique with a laser duration of 8 ns at a wavelength of 532 nm. The film sample exhibited a strong nonlinear saturated absorption, with an alpha2 value of -3.9 x 10(-5) mW(-1) and a self-defocusing effect with an n2 value of -4.78 x 10 (-12) m2W(-1). 相似文献
87.
The most recognized and employed model of the solvation equilibration in the ionic solutions was proposed by Eigen and Tamm, in which there are four major states for an ion pair in the solution: the completely solvated state, 2SIP (double solvent separate ion pair), SIP (single solvent separate ion pair), and CIP (contact ion pair). Eigen and Tamm suggested that the transition from SIP to CIP is always the slowest step during the whole pairing process, due to a high free energy barrier between these two states. We carried out a series of potential of mean force calculations to study the pairing free energy profiles of two sets of model mono- atomic 1:1 ion pairs 2.0:x and x:2.0. For 2.0:x pairs the free energy barrier between the SIP and CIP states is largely reduced due to the salvation shell water structure. For these pairs the SIP to CIP transition is thus not the slowest step in the ion pair formation course. This is a deviation from the Eigen-Tamm model. 相似文献
88.
Li Xiaokun Zhang Chunmei Du Cheng Zhuang Zhihua Zheng Fuqin Li Ping Zhang Ziwei Chen Wei 《中国科学:化学(英文版)》2019,62(3):378-384
To design efficient and low-cost core-shell electrocatalysts with an ultrathin platinum shell, the balance between platinum dosage and durability in acid solution is of great importance. In the present work, trimetallic Au@PdPt core-shell nanoparticles(NPs)with Pd/Pt molar ratios ranging from 0.31:1 to 4.20:1 were synthesized based on the Au catalytic reduction strategy and the subsequent metallic replacement reaction. When the Pd/Pt molar ratio is 1.19:1(designated as Au@Pd_(1.19) Pt_1 NPs), the superior electrochemical activity and stability were achieved for oxygen reduction reaction(ORR) in acid solution. Especially, the specific and mass activities of Au@Pd_(1.19) Pt_1 NPs are 1.31 and 6.09 times higher than those of commercial Pt/C catalyst. In addition, the Au@Pd_(1.19) Pt_1 NPs presented a good durability in acid solution. After 3000 potential cycles between 0.1 and 0.7 V(vs. Ag/AgCl), the oxygen reduction activity is almost unchanged. This study provides a simple strategy to synthesize highperformance trimetallic ORR electrocatalyst for fuel cells. 相似文献
89.
Benzofuran has antifungal activity as the inhibitor of N‐myristoyltransferase. Twenty‐nine novel benzofuran‐semicarbazide hybrids were designed and synthesized by principle of drug combinationatory. On this basis, the benzofuran ring was simplified to a resorcinol structure, and sixteen novel 1,3‐dialkoxybenzene‐semicarbazide hybrids were designed and synthesized. All structures of the target compounds were characterized by HRMS and NMR. The in vitro antifungal activity of target compounds was evaluated using the microdilution broth method against eight strains of pathogenic fungi with fluconazole as positive control. According to the results of the target compounds, structure‐activity relationship (SAR) is summarized. The inhibitory activity against the tested strains of simplified compounds ( K01 — K16 ) has different levels improvement compared with compounds Z01 — Z29 . K01 — K16 showed significant antifungal activities against A. fumigatus, C. kruseii, and sensitive C. albicans 5314. Notably, compounds Z20 , Z22 , K10 , K11 and K16 also displayed different activities against two fluconazole‐resistance strains that were isolated from AIDS patients. The minimal inhibitory concentration (MIC) values against fluconazole‐resistant strains were in the range of 2—8 μg/mL and 4—32μg/mL, respectively. Furthermore, molecular docking was performed to investigate the binding affinities and interaction modes between the target compound and N‐myristoyltransferase. 相似文献
90.
Qi‐jing Lin Shu‐ming Yang Chen‐ying Wang Jian‐jun Ding Zhuang‐de Jiang 《Surface and interface analysis : SIA》2013,45(8):1223-1227
Two bilayer thin films with different stacking sequences, Cu/Ti/Si and Ti/Cu/Si, were deposited by DC magnetron sputtering technique. X‐ray diffraction technique was used to measure the crystallization structures, and scanning electron microscopy and atomic force microscopy were used to measured surface morphology. The multifractal spectra f(α)‐α was used to characterize the surface morphology. The result of |q|max ≤ 53 is obtained by multifractal analysis. The shape of the multifractal spectra f(α) ? α is hook‐like for Cu/Ti/Si and bell jar‐like for Ti/Cu/Si. The spectrum width Δα = αmax ? αmin and Δf(=f(αmin) ? f(αmax)) of the multifractal spectra is able to quantitatively analyze the growth and surface roughness of the Cu/Ti bilayer thin films. The surface of Ti/Cu/Si thin film is more uniform and smoother than the film of Cu/Ti/Si. Copyright © 2013 John Wiley & Sons, Ltd. 相似文献