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Theoretical Study of Selectivity of Ethylene Hydroformylation on Rh(111) and Rh@Cu(111) Surfaces

Xiufang Ma、Yonghui Zhao、Hai‐Yan Su 等 4 位作者2012-10-01Dalian Institute of Chemical Physics, CAS Institutional Repository

Selectivity-determining steps for ethylene hydroformylation, i.e., ethyl hydrogenation versus CO insertion on Rh(111) and Rh@Cu(111) surfaces were investigated by density functional theory calculations. Compared with the Rh(111) surface, the Rh@Cu(111) surface decreases the hydrogenation barrier by 0.12 eV and more si…

Advanced Chemical Physics StudiesOrganometallic Complex Synthesis and CatalysisCatalytic Processes in Materials Science

Degradation mesomechanism of concrete deteriorated by soft water

Guo Hai-long2012-10-01Journal of Zhejiang University(Engineering Science)

The change mesomechanism of split tensile strength of concrete deteriorated by soft water was analyzed based on meso-fracture mechanics and experimental results.A special device was designed to simulate the leaching of concrete caused by soft water.Some experiments were conducted to test the porosity and the split ten…

Concrete and Cement Materials ResearchRock Mechanics and ModelingMagnesium Oxide Properties and Applications

Application of Graphene-chitosan Modified Electrode for the Detection of Pentachlorophenol in Environmental Water

Yongxin ZHAO、Li Li、K.P. Wang 等 6 位作者2012-10-01Chinese Journal of Applied Chemistry

摘要: 制备了石墨烯(CRG)-壳聚糖(CS)修饰玻碳(CRG-CS/GC)电极,用循环伏安法和示差脉冲伏安法研究了五氯酚(PCP)的电化学行为,发现其氧化电流信号与GC电极相比明显增强,表明修饰电极对PCP具有较强的吸附作用,并能够加速电子传递。 建立了一种灵敏简便、重现性好、稳定性好的测定PCP的新修饰电极方法,线性响应范围为1.00×10-7~1.00×10-5 mol/L(R=0.9975),检测限为2.3×10-8 mol/L(S/N=3)。 将该修饰电极应用于实际水样分析,回收率为97%~103%。

Electrochemical sensors and biosensorsConducting polymers and applicationsElectrochemical Analysis and Applications

Wavelet Transform and ANNs for Detection and Classification of Power Signal Disturbances

Aslam Pervez Memon、Mohammad Aslam Uqaili、Zubair Ahmed Memon2012-10-01DOAJ (DOAJ: Directory of Open Access Journals)

This article proposes WT (Wavelet Transform) and an ANN (Artificial Neural Network) based approach for detection and classification of EPQDs (Electrical Power Quality Disturbances). A modified WT known as ST (Stockwell Transform) is suggested for feature extraction and PNN (Probabilistic Neural Network) for pattern cl…

Machine Fault Diagnosis TechniquesPower Quality and HarmonicsMagnetic Properties and Applications

Effect of SiC Addition on Sintering Behavior and Properties of Indium Tin Oxide

Jung–A Lee、Hyung-Ryul Park、Joon‐Hyung Lee 等 7 位作者2012-10-01Journal of Nanoelectronics and Optoelectronics

The sintering behavior of ITO ceramics with the addition of fine and coarse SiC was studied. SiC addition promoted the densification of ITO during early stage sintering compared to pure ITO. On the other hand, the addition of SiC resulted in the development of numerous pores in the microstructures due to the oxidation…

ZnO doping and propertiesAdvanced ceramic materials synthesisAluminum Alloys Composites Properties

Synthesis and Characterisation of a Cd(II) Complex with a Chiral Framework Constructed from Achiral 1,1′-[bis-3-(3-pyridyl)pyrazol-5-yl]ferrocene via Spontaneous Resolution

Wei Liu、Xia Li、Jin’an Zhao 等 5 位作者2012-10-01Journal of Chemical Research

The chiral Cd(II) complex {[Cd(L)(CH 3 COO) 2 (H 2 O)]·H 2 O} n {L = 1,1′-[bis-3-(3-pyridyl)pyrazol-5-yl]ferrocene} has been synthesised. The Cd(II) ion is coordinated by two pyridyl nitrogen atoms, two chelating acetate anions and one water molecule, showing a distorted pentagonal-bipyramidal coordination environment…

Metal-Organic Frameworks: Synthesis and ApplicationsMetal complexes synthesis and propertiesMagnetism in coordination complexes

ENHANCED HOMING OF MESENCHYMAL STEM CELLS TO THE ISCHAEMIC MYOCARDIUM BY ULTRASOUND-TARGETED MICROBUBBLE DESTRUCTION

Shigen Zhong、Zhiyu Ling2012-10-01Heart

Objectives The transplantation of bone-marrow derived mesenchymal stem cells (MSCs) to ischaemic myocardium is considered to be a useful therapeutic approach to ischaemic heart disease, but the MSCs delivery efficacy still can't meet the needs for therapy. Recently, ultrasound-targeted microbubble destruction (UTMD) h…

Electrospun Nanofibers in Biomedical ApplicationsUltrasound and Hyperthermia Applications

Synthesis of One-Dimensional Fe3O4@C Composites from Catalytic Pyrolysis of Waste Polypropylene

Qinghong Kong、Junhao Zhang、Hong Liu 等 5 位作者2012-10-01Journal of Nanoscience and Nanotechnology

A simple catalytic pyrolysis route was developed to prepare one-dimensional Fe3O4@C composites using waste polypropylene as carbon resource, in which the Fe3O4 nanoparticles were self-assembled to necklace-shaped structures. The products were characterized by means of X-ray power diffraction (XRD), Raman spectra, fiel…

Electromagnetic wave absorption materialsFiber-reinforced polymer compositesGraphite, nuclear technology, radiation studies

The Effect of Ammonia on Carbon Nanotube Growth Using Simple Thermal Chemical Vapour Deposition

A. Awang Teh、Rehan Ahmad、M. H. Kara 等 5 位作者2012-10-01Journal of Nanoscience and Nanotechnology

We report the use of a new precursor as active agents to promote the growth of carbon nanotubes (CNT) in methane ambient using a simple thermal chemical vapour deposition method. The agents consist of ammonia and methanol mixed at different ratios and was found to enhance the growth of CNTs. The optimum methanol to am…

Carbon Nanotubes in CompositesGraphene research and applicationsMolecular Junctions and Nanostructures

Synthesis and characterization of new metallophthalocyanines bearing macrocyclic N 3 O 2 groups on peripheral positions

Elif Çelenk Kaya2012-10-01Heterocyclic Communications

Abstract The synthesis and characterization of new zinc(II) 3 , nickel(II) 4 and cobalt(II) 5 phthalocyanines complexes carrying macrocyclic N 3 O 2 groups on peripheral positions are described. The compounds were characterized by elemental analysis, IR, 1 H and 13 C NMR, UV-Vis and MS spectral data.

Porphyrin and Phthalocyanine ChemistryPhotodynamic Therapy Research StudiesMetal-Catalyzed Oxygenation Mechanisms

Synthesis and Photoluminescence Properties of SnO2Nanopowder

Takahiro Arai、Sadao Adachi2012-10-01Japanese Journal of Applied Physics

SnO 2 nanopowder was synthesized by calcining metastannic salt (SnO 2 ·H 2 O) prepared by chemically etching metallic Sn in aqueous HNO 3 solution. The calcined SnO 2 nanopowder was investigated by X-ray diffraction (XRD) measurement and photoluminescence (PL) spectroscopy. The XRD and PL intensities increased with in…

ZnO doping and propertiesGas Sensing Nanomaterials and SensorsTransition Metal Oxide Nanomaterials

Nano-Porous Structure of a Porous Ceramics from Rice Husk

R. Raut Dessai、J. A. Erwin Desa、Debasis Sen 等 4 位作者2012-10-01Transactions of the Indian Ceramic Society

A porous ceramics is obtained using rice husk as the source of silica. The modification of mesoscopic structure under different sintering conditions has been investigated using neutron scattering techniques and scanning electron microscopy. X-ray diffraction confirmed the purity of silica by comparing the diffraction…

Bone Tissue Engineering MaterialsClay minerals and soil interactionsAerogels and thermal insulation

HEMATOPORPHYRIN MONOMETHYL ETHER-MEDIATED PHOTODYNAMIC EFFECTS ON MACROPHAGES

Jiali Cheng、Qingsong Li、Chenghai Peng 等 5 位作者2012-10-01Heart

Objectives Photodynamic therapy (PDT) has been shown to attenuate atherosclerotic plaque progression and decrease macrophage-infiltration. The effectiveness of PDT depends strongly on the type of photosensitizers. Hematoporphyrin monomethyl ether (HMME) is a promising second-generation porphyrin-related photosensitize…

Nanoplatforms for cancer theranosticsPorphyrin and Phthalocyanine ChemistryPhotodynamic Therapy Research Studies

A First-Principles Calculation on the Electronic Structures and Optical Properties of Ti/N-Codoped Quartz SiO2

Wei Dai、Peng Hu2012-10-01Nanoscience and Nanotechnology Letters

The electronic structures and optical properties of N-doped, Ti-doped and TI/N-codoped SiO2 have been investigated by the means of first-principles calculations. Our results indicate the introduction of doped ions can significantly reduce the band gap compared to the SiO2 system, nearly by 1.4 eV on average, which may…

Semiconductor materials and devicesSemiconductor materials and interfacesGa2O3 and related materials

Quantum dots-templated growth of strain-relaxed GaN on a c -plane sapphire by radio-frequency molecular beam epitaxy

Haomin Guo、Long Wen、Zhifei Zhao 等 6 位作者2012-10-01Chinese Physics B

We investigated the quantum dots-templated growth of a (0001) GaN film on a c-plane sapphire substrate. The growth was carried out in a radio-frequency molecular beam epitaxy system. The enlargement and coalescence of grains on the GaN quantum dots template was observed in the atom force microscopy images, as well as…

ZnO doping and propertiesGaN-based semiconductor devices and materialsGa2O3 and related materials

Theoretical study on the interaction of p-type impurities with hydrogen in ZnO

Junfeng Hu、HaiYan HE、Bicai Pan2012-10-01Zhongguo kexue. Wulixue Lixue Tianwenxue

In this work we systematically review our theoretical results about the interaction of important p-type impurities with hydrogen in ZnO. Our investigations indicated that a H atom in ZnO might migrate through different pathways to reach the sites nearby acceptor impurities (N, Li and Ag), forming stable complexes of N…

ZnO doping and propertiesGas Sensing Nanomaterials and Sensorsnanoparticles nucleation surface interactions

3,3’’-Bis(saccharin-6-ylmethyl)-1,1’:3’,1’’-terphenyl – Precursor of A New Tetradendate Bis-bridging Ligand

Stefan Buck、Gerhard Maas2012-10-01Zeitschrift für Naturforschung B

The title compound (H2tpsac) was synthesized from 6-bromosaccharin and 3,3’’-bis(bromomethyl)- m-terphenyl. The ability of tpsac to serve as a tetradentate bis-bridging ligand was demonstrated by the formation of the dinuclear ruthenium(I,I) complexes [Ru2(CO)5(μ,μ-tpsac)]2, [Ru2(CO)4(μ,μ-tpsac)]n, [Ru2(CO)4(PPh3)2(μ,…

Metal complexes synthesis and propertiesMagnetism in coordination complexesAsymmetric Hydrogenation and Catalysis

Radiological Safety Concerns for the Accelerator Production of Diagnostic and Therapeutic Radionuclides in a University Setting

Thomas M. Martin、Gamal Akabani2012-10-01Health Physics

Accelerator production of radionuclides for diagnostic and therapeutic research at a university has many advantages. Radionuclides not commonly available through commercial suppliers may be readily produced for innovative research applications. Loss of material due to decay in transit is minimized, and product lead ti…

Radioactive contamination and transferGraphite, nuclear technology, radiation studiesNuclear and radioactivity studies

Expanded Solubility and Densification Behavior of Li-Ga Co-Doped ZnO

Dae Yoon Kim、Joon‐Hyung Lee、Young‐Woo Heo 等 6 位作者2012-10-01Journal of Nanoelectronics and Optoelectronics

The effects of Ga 3+ and Li + co-doping on the solubility limits and densification behavior of ZnO were examined. When Ga and Li were co-doped at a 1:1 ratio, the overall solubility of Ga and Li increased to approximately 40 at% (20 at% of Ga + 20 at% of Li). The lattice parameter decreased with increasing Ga and Li c…

Advancements in Battery MaterialsZnO doping and propertiesGas Sensing Nanomaterials and Sensors