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Finite-size effects in dissipative particle dynamics simulations

María Eugenia Velázquez、A. Gama Goicochea、Minerva González-Melchor 等 5 位作者2006-02-17The Journal of Chemical Physics

We have performed dissipative particle dynamics (DPD) simulations to evaluate the effect that finite size of transversal area has on stress anisotropy and interfacial tension. The simulations were carried out in one phase and two phases in parallelepiped cells. In one-phase simulations there is no finite-size effect o…

Material Dynamics and PropertiesPolymer Surface Interaction StudiesBlock Copolymer Self-Assembly

Environmental durability of banana‐fiber‐reinforced phenol formaldehyde composites

Seena Joseph、Zachariah Oommen、Sabu Thomas2006-02-17Journal of Applied Polymer Science

Abstract We explored the environmental aging behavior of banana‐fiber‐reinforced phenol formaldehyde (PF) composites. The composites were subjected to water aging, thermal aging, soil burial, and outdoor weathering. The effects of chemical modification and hybridization with glass fibers on the degradability of the co…

Polymer Nanocomposites and PropertiesNatural Fiber Reinforced CompositesTextile materials and evaluations

Chemistry of thermal ageing in aerospace epoxy composites

S. Bondzic、J. H. Hodgkin、Julia Krstina 等 4 位作者2006-02-17Journal of Applied Polymer Science

Abstract The detailed chemical reactions involved in the thermal ageing (at 120°C) of a typical aerospace epoxy composite have been studied by the mid‐Fourier transform infrared spectroscopy (FTIR) spectral characterization of selected model compounds. The FTIR spectra indicate that at this particular temperature, the…

Polymer crystallization and propertiesEpoxy Resin Curing ProcessesThermal and Kinetic Analysis

Indirect absorption edge of TlGaSe2 crystals

V. Grivickas、V. Bikbajevas、Paulius Grivickas2006-02-17physica status solidi (b)

Abstract Absorption spectra of high‐quality layered TlGaSe 2 single crystals were measured in a wide temperature range. Results obtained at low temperatures show that the direct excitonic absorption initiating at E Gdir = 2.127 eV is perturbed by several series of step‐like features inherent for the indirect type tran…

Crystal Structures and PropertiesNonlinear Optical Materials ResearchSolid-state spectroscopy and crystallography

Substrate specificity of peptide adsorption: A model study

Michael Bachmann、Wolfhard Janke2006-02-17Physical Review E

Applying the contact density chain-growth algorithm to lattice heteropolymers, we identify the conformational transitions of a nongrafted hydrophobic-polar heteropolymer with 103 residues in the vicinity of a polar, a hydrophobic, and a uniformly attractive substrate. Introducing only two system parameters, the number…

Polymer Surface Interaction StudiesSupramolecular Self-Assembly in MaterialsDiatoms and Algae Research

Thermoplastic elastomeric nanocomposites from poly[styrene–(ethylene‐co‐butylene)–styrene] triblock copolymer and clay: Preparation and characterization

Anirban Ganguly、Mousumi De Sarkar、Anil K. Bhowmick2006-02-17Journal of Applied Polymer Science

Abstract Thermoplastic elastomer (TPE)–clay nanocomposites based on poly[styrene–(ethylene‐ co ‐butylene)–styrene] triblock copolymer (SEBS) were prepared. Natural sodium montmorillonite (MMT) clay was organically modified by octadecyl amine to produce an amine‐modified hydrophobic nanoclay (OC). Commercially availabl…

Polymer Nanocomposites and PropertiesPolymer composites and self-healingDielectric materials and actuators

Improving the physical and chemical functionality of starch‐derived films with biopolymers

Weiping Ban、Jianguo Song、Dimitris S. Argyropoulos 等 4 位作者2006-02-17Journal of Applied Polymer Science

Abstract The physical and chemical properties of composite starch‐based films containing cellulosic fiber, chitosan, and gelatin were investigated. Films containing both cellulosic fibers and chitosan demonstrated tremendous enhancements in film strength and gas permeation. The water absorbency of composite films coul…

Nanocomposite Films for Food PackagingNatural Fiber Reinforced CompositesElectrospun Nanofibers in Biomedical Applications

Growth and characterization of single crystalline Ga-doped ZnO films using rf magnetron sputtering

Byung‐Teak Lee、Taehwan Kim、Sang‐Hun Jeong2006-02-17Journal of Physics D Applied Physics

In this article it is shown that high quality single crystalline Ga-doped ZnO (GZO) films could be achieved on ac-plane sapphire using conventional rf magnetron sputtering. High-resolution x-ray diffractometry, transmission electron microscopy (TEM), and scanning electron microscopy investigations clearly confirmed th…

ZnO doping and propertiesGas Sensing Nanomaterials and SensorsCopper-based nanomaterials and applications

Highly Acidic Mesostructured Aluminosilicates Assembled from Surfactant-Mediated Zeolite Hydrolysis Products

Hui Wang、Yu Liu、Thomas J. Pinnavaia2006-02-17The Journal of Physical Chemistry B

The surfactant-mediated hydrolysis of ZSM-5 zeolite affords five-membered ring subunits that can be readily incorporated into the framework walls of a hexagonal mesostructured aluminosilicate, denoted MSU-Z. The five-membered ring subunits, which are identifiable by infrared spectroscopy, impart unprecedented acidity…

Zeolite Catalysis and SynthesisMesoporous Materials and CatalysisChemical Synthesis and Characterization

Novel Molecular and Mechanical Properties of Egg Case Silk from Wasp Spider, Argiope bruennichi

Aichun Zhao、Tianfu Zhao、Koichi Nakagaki 等 11 位作者2006-02-17Biochemistry

Araneoid spiders use specialized abdominal glands to produce up to seven different protein-based silks/glues that have various mechanical properties. To date, the fibroin sequences encoding egg case fibers have not been fully determined. To gain further understanding of a recently reported spider silk protein gene fam…

Silk-based biomaterials and applicationsSpider Taxonomy and Behavior StudiesSilkworms and Sericulture Research

The structural properties of a two-Yukawa fluid: Simulation and analytical results

Matteo Broccio、Dino Costa、Yun Liu 等 4 位作者2006-02-17The Journal of Chemical Physics

Standard Monte Carlo simulations are carried out to assess the accuracy of theoretical predictions for the structural properties of a model fluid interacting through a hard-core two-Yukawa potential composed of a short-range attractive well next to a hard repulsive core, followed by a smooth, long-range repulsive tail…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesSpectroscopy and Quantum Chemical Studies

One-Step Template-Directed Synthesis of a Macrocyclic Tetraarylporphyrin Hexamer Based on Supramolecular Interactions with a C3-Symmetric Tetraarylporphyrin Trimer

Simona Rucareanu、Anne Schuwey、Albert Gossauer2006-02-17Journal of the American Chemical Society

Taking into consideration the model geometry of the macrocyclic hexaporphyrin 1 as a host molecule, the structure of a benzene-centered porphyrin trimer bearing pyridine rings at the apical positions has been designed with the aim to use the latter as a template for the synthesis of its own host. Indeed, in the presen…

Porphyrin and Phthalocyanine ChemistryOxidative Organic Chemistry ReactionsSynthesis and Characterization of Pyrroles

Surface Forces between Telechelic Brushes Revisited: The Origin of a Weak Attraction

Dapeng Cao、Jianzhong Wu2006-02-17Langmuir

Telechelic polymers are useful for surface protection and stabilization of colloidal dispersions by the formation of polymer brushes. A number of theoretical investigations have been reported on a weak attraction between two telechelic brushes when they are at the classical contact, i.e., when the surface separation i…

Material Dynamics and PropertiesPolymer Surface Interaction StudiesForce Microscopy Techniques and Applications

Very Strong Ferromagnetic Interaction in a New Binuclear μ-Methoxo-Bridged Mn(III) Complex: Synthesis, Crystal Structure, Magnetic Properties, and DFT Calculations

Chahrazed Beghidja、Guillaume Rogez、Jens Kortus 等 5 位作者2006-02-17Journal of the American Chemical Society

New mononuclear [Mn(HL)3].2CHCl3 (H2L = 2-salicyloylhydrazono-1,3-dithiolane) and binuclear Mn2(mu-OCH3)2(HL)4 manganese (III) complexes have been synthesized and structurally characterized. The binuclear complex, described in this communication, displays very strong intramolecular ferromagnetic coupling (J = + 19.7 c…

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesMetal-Catalyzed Oxygenation Mechanisms

Synthesis of Icosahedral Gold Nanocrystals: A Thermal Process Strategy

Min Zhou、Shenhao Chen、Shiyong Zhao2006-02-17The Journal of Physical Chemistry B

We demonstrate a one-step thermal process route to the synthesis of icosahedral gold nanocrystals. By regulating the concentrations of poly(vinyl pyrrolidone) (PVP) and HAuCl4 or changing the temperature, we can readily access the shapes of icosahedral nanocrystals with good uniformity. These gold nanostructures, with…

Gold and Silver Nanoparticles Synthesis and ApplicationsNanocluster Synthesis and ApplicationsLaser-Ablation Synthesis of Nanoparticles

Preparation and properties of biodegradable thermoplastic starch/poly(hydroxy butyrate) blends

Sun‐Mou Lai、Trong‐Ming Don、Yu‐Chen Huang2006-02-17Journal of Applied Polymer Science

Abstract The vital differences using three types of thermoplastic starches (TPS), including potato starch, corn starch, and soluble potato starch, with two different gelatinization degrees to blend with poly(hydroxy butyrate) (PHB) are thoroughly discussed in this study. For blends containing a certain amount of PHB,…

Nanocomposite Films for Food Packagingbiodegradable polymer synthesis and propertiesElectrospun Nanofibers in Biomedical Applications

Properties of starch‐based blend films using citric acid as additive. II

Soon‐Do Yoon、Sung‐Hyo Chough、HyeRyoung Park2006-02-17Journal of Applied Polymer Science

Abstract Starch/polyvinyl alcohol (PVA) blend films were prepared by using corn starch, polyvinyl alcohol (PVA), glycerol (GL), and citric acid (CA) as additives and glutaraldehyde (GLU) as crosslinking agent for the mixing process. The additives, drying temperature, and the influence of crosslinker of films on the pr…

Nanocomposite Films for Food Packagingbiodegradable polymer synthesis and propertiesElectrospun Nanofibers in Biomedical Applications

Thermal stability of polyhydroxyalkanoates

F. Carrasco、Davide Dionisi、Andrea Martinelli 等 4 位作者2006-02-17Journal of Applied Polymer Science

Abstract In this study, we examined the thermal decomposition of polyhydroxyalkanoates (PHAs) such as the homopolymer poly(3‐hydroxybutyrate) and the copolymer poly(3‐hydroxybutyrate‐ co ‐3‐hydroxyvalerate). They are biodegradable polymers that can replace plastics produced from nonrenewable resources, such as polypro…

biodegradable polymer synthesis and propertiesMicroplastics and Plastic PollutionRecycling and Waste Management Techniques

Electrical instabilities in organic semiconductors caused by trapped supercooled water

Henrique L. Gomes、Peter Stallinga、Michael Cölle 等 5 位作者2006-02-17Applied Physics Letters

It is reported that the electrical instability known as bias stress is caused by the presence of trapped water in the organic layer. Experimental evidence as provided by the observation of an anomaly occurring systematically at around 200K. This anomaly is observed in a variety of materials, independent of the deposit…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesIonic liquids properties and applications