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Mechanical properties of thermoelectric lanthanum telluride from quantum mechanics

Guodong Li、Umut Aydemir、Max Wood 等 7 位作者2017-05-31Journal of Physics D Applied Physics

Abstract Lanthanum telluride (La 3 Te 4 ) is an n-type high-performance thermoelectric material in the high temperature range, but its mechanical properties remain unknown. Since we want robust mechanical properties for their integration into industrial applications, we report here quantum mechanics (QM) simulations t…

Advanced Thermoelectric Materials and DevicesThermal properties of materialsMachine Learning in Materials Science

Introduction of Anionic Surfactants to Copolymer Micelles: A Key to Improving Utilization Efficiency of P123 in Synthesis of Mesoporous Aluminosilicates

Xiaotong Mi、Jiongliang Yuan、Yueming Han 等 10 位作者2017-05-31Industrial & Engineering Chemistry Research

High Resolution Image Download MS PowerPoint Slide Mesoporous aluminosilicates (MAs) with high hydrothermal stability by assembly of zeolite Y precursors have been emerging as the most promising materials for cracking heavy oil molecules. A means to improve utilization efficiency of organic surfactants is of vital imp…

Zeolite Catalysis and SynthesisMesoporous Materials and CatalysisCatalysis and Hydrodesulfurization Studies

THz Beam Shaper Realizing Fan-Out Patterns

K. Liebert、M. Rachoń、Agnieszka Siemion 等 7 位作者2017-05-31Journal of Infrared Millimeter and Terahertz Waves

Fan-out elements create an array of beams radiating at particular angles along the propagation axis. Therefore, they are able to form a matrix of equidistant spots in the far-field diffraction region. In this work, we report on the first fan-out structures designed for the THz range of radiation. Two types of light-di…

Metamaterials and Metasurfaces ApplicationsMicrowave Engineering and WaveguidesOptical Coatings and Gratings

Thermal Reduction of NOx with Recycled Plastics

Ibukun Oluwoye、Bogdan Z. Dlugogorski、Jeff Gore 等 6 位作者2017-05-31Environmental Science & Technology

This study develops technology for mitigation of NO x formed in thermal processes using recycled plastics such as polyethylene (PE). Experiments involve sample characterization, and thermogravimetric decomposition of PE under controlled atmospheres, with NO x concentration relevant to industrial applications. TGA–Four…

Catalytic Processes in Materials ScienceThermal and Kinetic AnalysisRocket and propulsion systems research

Study of Pd/Y based multilayers using high energy photoemission spectroscopy combined with x-ray standing waves

Meiyi Wu、Vesna Ilakovac、Jean‐Marc André 等 9 位作者2017-05-31Proceedings of SPIE, the International Society for Optical Engineering/Proceedings of SPIE

We use hard x-ray photoemission spectroscopy combined with x-ray standing waves to characterize a series of Pd/Y multilayers designed to work in the 7.5-11 nm wavelength range. The samples, prepared by magnetron sputtering, are deposited either with or without nitrogen introduced in the sputtering gas. The aimed perio…

X-ray Spectroscopy and Fluorescence AnalysisElectron and X-Ray Spectroscopy TechniquesAdvanced Materials Characterization Techniques

Dramatically Enhanced Phenol Degradation on Alkali Cation‐Anchored TiO2/SiO2 Hybrids: Effect of Cation‐π Interaction as a Diffusion‐Controlling Tool in Heterogeneous Catalysis

Yasuhiro Magatani、Yasutaka Kuwahara、Kazuto Nishizawa 等 4 位作者2017-05-31ChemistrySelect

Abstract Cation‐π interaction is an intermolecular interaction between the face of a π system and an adjacent cation, which brings about a change in molecular dynamics of organic reactants in catalysis. In this study, a series of alkali metal cations‐anchored TiO 2 /SiO 2 hybrid catalysts were prepared based on organo…

Zeolite Catalysis and SynthesisMesoporous Materials and CatalysisCovalent Organic Framework Applications

First‐Principles Calculation of Phase/Size Characteristic in Yb 3+ /Tm 3+ /ZnO Upconversion Nanoparticles through Metal Ga 3+ Doping

Yuemei Li、Yongmei Li、Rui Wang 等 6 位作者2017-05-31ChemistrySelect

Abstract The crystal size of upconversion nanoparticles (UCNPs) can be effectively controlled by doping metal ions, which remarkably enhances upconversion luminescence (UCL) intensity and pure color turning. This study investigates phase and size properties of Yb 3+ /Tm 3+ /ZnO with various concentrations of Ga 3+ . I…

Luminescence Properties of Advanced MaterialsPerovskite Materials and ApplicationsLuminescence and Fluorescent Materials

Peroxide/Silane Crosslinked Poly(lactic acid) Hybrid Biocomposite Reinforced with Empty Fruit Bunch and Cotton Fibers for Hot-Fill Food Packaging

Utai Meekum、Pantip Kingchang2017-05-31BioResources

A biocomposite manufactured from peroxide/silane crosslinked poly(lactic acid) reinforced with hybridized empty fruit bunch (EFB) oil palm and cotton fibers was investigated. Optimization of dicumyl peroxide (DCP) and the vinyltrimethoxysilane (VTMS) crosslink system by using the 2k factorial design of experiment (DOE…

Nanocomposite Films for Food PackagingNatural Fiber Reinforced Compositesbiodegradable polymer synthesis and properties

Silver(III)⋅⋅⋅Silver(III) Interactions that Stabilize the syn Form in a Porphyrin Dimer Upon Oxidation

Akhil K. Singh、Firoz Shah Tuglak Khan、Sankar Prasad Rath2017-05-31Angewandte Chemie

Abstract The interaction between two Ag II porphyrins, connected covalently through a highly flexible ethane bridge, in a metalloporphyrin dimer has been investigated upon stepwise oxidation. X‐ray structure determination of one and two‐electron oxidized complexes has clearly revealed only metal‐centered oxidation tha…

Magnetism in coordination complexesPorphyrin and Phthalocyanine ChemistryMetal-Catalyzed Oxygenation Mechanisms

Structural characterization of magnesium-substituted nickel ferrite nanoparticles

Manojit De、Soumen Bera、H. S. Tewari2017-05-31Emerging Materials Research

The present paper reports the synthesis of magnesium-substituted nickel ferrite (NiFe (2−x) Mg x O 4 ) (x = 0·15, 0·30, 0·45 and 0·60) using the autocombustion technique with particle size in the nanometer range. As-prepared samples were sintered at two different temperatures (600, 900°C). In the present investigation…

Multiferroics and related materialsMagnetic Properties and Synthesis of FerritesElectromagnetic wave absorption materials

Prediction of Extremely Strong Antiferromagnetic Superexchange in Silver(II) Fluorides: Challenging the Oxocuprates(II)

Dominik Kurzydłowski、Wojciech Grochala2017-05-31Angewandte Chemie

Abstract Strong magnetic coupling between the spins of unpaired electrons is an essential ingredient of many fascinating physical phenomena. Here we report calculations using the hybrid HSE06 functional of magnetic superexchange constants, J , for a series of low‐dimensional Cu II and Ag II binary and ternary systems…

Physics of Superconductivity and MagnetismMagnetism in coordination complexesAdvanced Condensed Matter Physics

Catalytic Oxyfunctionalization of Methyl 10-undecenoate for the Synthesis of Step-Growth Polymers

Marc von Czapiewski、Michaël A. R. Meier2017-05-31Macromolecular Chemistry and Physics

An efficient synthesis strategy for the preparation of two renewable polyesters and one renewable polyamide via catalytic oxyfunctionalization of methyl 10-undecenoate, a castor oil derived platform chemical, is described. The keto-fatty acid methyl ester (keto-FAME) is synthesized applying a cocatalyst-free Wacker ox…

Polymer composites and self-healingSynthetic Organic Chemistry MethodsOxidative Organic Chemistry Reactions

High-Resolution Studies on Nanoscaled Ni/YSZ Anodes

Julian Szász、Sascha Seils、Dino Klotz 等 8 位作者2017-05-31Chemistry of Materials

The performance of Ni/YSZ anodes has been shown to substantially benefit by a reverse current treatment of a solid oxide fuel cell. Within seconds, a solid state reaction builds a nanoscaled layer at the anode/electrolyte interface, thereby increasing the triple-phase boundary density considerably. The reaction mechan…

Electrocatalysts for Energy ConversionAdvancements in Solid Oxide Fuel CellsElectronic and Structural Properties of Oxides

Low‐Temperature Fabrication of Cold Cathode WO2 Nanowire Arrays on Glass Substrate and Improvement of their Working Performance

Yan Tian、Xun Yang、Tongyi Guo 等 10 位作者2017-05-31Advanced Materials Technologies

WO 2 nanowires have great potential as cold cathode materials because they exhibit excellent field‐emission properties in terms of their low work function and high conductivity. Considering the requirements of the practical applications in large‐area cold‐cathode devices, such as X‐ray source and panel display, these…

ZnO doping and propertiesAdvanced Memory and Neural ComputingTransition Metal Oxide Nanomaterials

Superhydrophobic behavior of lauryl methacrylate copolymers on the cotton fabric surface

Evgeniy V Bryuzgin、В. В. Климов、Manh D. Le 等 6 位作者2017-05-31Surface Innovations

The authors propose to use glycidyl methacrylate and lauryl methacrylate copolymers to provide the cotton fabric surface with superhydrophobic properties. The modification was carried out by immersion of cotton fabric in solutions of copolymers in methylethylketone and following heat treatment at 140°C. Stability of t…

Surface Modification and SuperhydrophobicityAdvanced Polymer Synthesis and CharacterizationPhotopolymerization techniques and applications

Physical properties and morphology of crosslinked polyurethane synthesized from para‐phenylene diisocyanate and polyether polyol

Yan Huan、Jia Liu、Jie Wang 等 5 位作者2017-05-31Journal of Applied Polymer Science

ABSTRACT A series of crosslinked polyurethanes (PUs) were synthesized from para ‐phenylene diisocyanate, 2‐(hydroxymethyl)‐2‐ethyl propane‐1,3‐diol (TMP), and butane‐1,4‐diol as the hard segments and poly(oxytetramethylene glycol) as the soft segments. The effects of TMP on the physical properties and microphase struc…

Polymer composites and self-healingEpoxy Resin Curing ProcessesSynthetic Organic Chemistry Methods

Charging energy spectrum of black phosphorus quantum dots

M A Lino、J. S. de Sousa、D R da Costa 等 6 位作者2017-05-31Journal of Physics D Applied Physics

Abstract We present a theoretical study of the charging effects in single and double layer black phosphorus quantum dots (BPQDs) with lateral sizes of 2 nm and 3 nm. We demonstrate that the charging of BPQDs are able to store up to an N max electron (that depends on the lateral size and number of layers in the QD), af…

Semiconductor Quantum Structures and Devices2D Materials and ApplicationsQuantum Dots Synthesis And Properties

STUDY OF HEAT TREATMENT EFFECT ON STRUCTURE AND SOLUBILITY OF CHITOSAN FILMS

Tetyana Solodovnik、Hennadiy Stolyarenko、Andrii Slis 等 4 位作者2017-05-31Chemistry & Chemical Technology

Chitosan films were obtained in the salt form and in the hydroxide form. Films were prepared by dry method of forming. For the production of films chitosan from mycelium biomass waste of fungus Aspergillus Niger was used. The effect of heat treatment on the structure and solubility of chitosan films was studied. It wa…

Nanocomposite Films for Food Packagingbiodegradable polymer synthesis and properties

Truffle mediated (Terfezia claveryi) synthesis of silver nanoparticles and its potential cytotoxicity in human breast cancer cells (MCF-7)

Habeeb Khadri、Yousef Homood Aldebasi、Khateef Riazunnisa2017-05-31AFRICAN JOURNAL OF BIOTECHNOLOGY

Terfezia claveryi is a species that belongs to the genera of Terfeziaceae or desert truffles, which is a family of truffles. In the present study, silver nanoparticles were synthesized from aqueous extract of T. claveryi which are in the range of 25 to 60 nm. The synthesized nanoparticles were characterized by ultravi…

Nanoparticles: synthesis and applicationsPharmacology and Nanomedicine Research

Relaxation of vibrationally excited states in solid “nitrate–nitrite” binary systems

A. �. Aliev、I. R. Akhmedov、M. G. Kakagasanov 等 7 位作者2017-05-31Optics and Spectroscopy

The processes of molecular relaxation in the solid NaNO3–NaNO2 and KNO3–KNO2 “nitrate–nitrite” binary systems have been investigated by Raman spectroscopy. The relaxation time of the vibration ν1(A) of an NO- 3 anion in the binary system is found to be shorter than that in individual nitrate. The increase in the relax…

Luminescence Properties of Advanced MaterialsPhotorefractive and Nonlinear OpticsSolid-state spectroscopy and crystallography