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Modification to Lees–Edwards periodic boundary condition for dissipative particle dynamics simulation with high dissipation rates

Abhirup Chatterjee2007-12-01Molecular Simulation

The Lees–Edwards periodic boundary condition has been a workhorse for simulating shear flows in molecular dynamics (MD). It has also been used in dissipative particle dynamics (DPD) to calculate the rheology of complex suspensions. However, owing to the dependence of inter-particle forces on the relative velocity of t…

Rheology and Fluid Dynamics StudiesBlock Copolymer Self-AssemblyNanopore and Nanochannel Transport Studies

Optical and electrical properties of highly nitrogen-doped ZnO thin films grown by plasma-assisted molecular beam epitaxy

Shujie Jiao、Youming Lu、Zhengzhong Zhang 等 9 位作者2007-12-01Journal of Applied Physics

Nitrogen-doped ZnO thin films with different nitrogen concentrations were fabricated by plasma-assisted molecular beam epitaxy. Hall effect measurements show p-type conduction for samples with low doping concentration. In highly doped ZnO, the p-type conduction converted to high resistance or unstable p-type behavior.…

ZnO doping and propertiesCopper-based nanomaterials and applicationsGa2O3 and related materials

Template Synthesis and Magnetic Behavior of FeNi Alloy Nanotube Arrays

Dong Zhou、Li‐Heng Cai、Fu-shen Wen 等 4 位作者2007-12-01Chinese Journal of Chemical Physics

FeNi nanotubes were successfully prepared in pores of anodic aluminium oxide templates by the wetting template method. By varying the deposition conditions and the parameters of the templates, the lengths and the outer as well as the inner diameters of the tubes can be tailored. The FeNi nanotubes and their arrays wer…

Anodic Oxide Films and NanostructuresSmart Materials for ConstructionNanoporous metals and alloys

Structure and Internal Stress of Tin-Doped Indium Oxide and Indium–Zinc Oxide Films Deposited by DC Magnetron Sputtering

Eriko Nishimura、T. Sasabayashi、Norihiro Ito 等 9 位作者2007-12-01Japanese Journal of Applied Physics

Structure and Internal Stress of Tin-Doped Indium Oxide and Indium–Zinc Oxide Films Deposited by DC Magnetron Sputtering, Nishimura, Eriko, Sasabayashi, Tomoko, Ito, Norihiro, Sato, Yasushi, Utsumi, Kentaro, Yano, Koki, Kaijo, Akira, Inoue, Kazuyoshi, Shigesato, Yuzo

ZnO doping and propertiesGas Sensing Nanomaterials and SensorsTransition Metal Oxide Nanomaterials

Effect of 1‐Hexene Comonomer on Polyethylene Particle Growth and Kinetic Profiles

R. Van Grieken、A. Carrero、Inmaculada Suárez 等 4 位作者2007-12-01Macromolecular Symposia

Abstract Summary: The polymer growth and the microstructure of the final polymer are greatly affected by mass transfer, especially in the early stages of polymerization. In the present work, the catalytic system ( n BuCp) 2 ZrCl 2 /MAO immobilized over SiO 2 ‐Al 2 O 3 has been tested in ethylene‐1‐hexene copolymerizat…

Organometallic Complex Synthesis and CatalysisPolymer crystallization and propertiesPolymer Nanocomposites and Properties

Electrical conductivity of the semiconducting phase in vanadium dioxide single crystals

В. Н. Андреев、V. A. Klimov2007-12-01Physics of the Solid State

The electrical conductivity of the semiconducting phase of vanadium dioxide single crystals is studied over a wide range of temperatures. It is shown that the electrical conductivity varies with temperature as log σ ∼ T in the range 340–170 K and as log σ ∼ 1/ T at temperatures below 120 K. The experimental results ar…

Transition Metal Oxide NanomaterialsCatalysis and Oxidation ReactionsElectronic and Structural Properties of Oxides

Mechanical Behaviors of Carbon Nanotubes with Randomly Located Vacancy Defects

Wenyi Hou、Shaoping Xiao2007-12-01Journal of Nanoscience and Nanotechnology

In this paper, (10, 0) zigzag nanotubes and (6, 6) armchair nanotubes are considered to investigate the effects of randomly distributed vacancy defects on mechanical behaviors of single-walled carbon nanotubes. A spatial Poisson point process is employed to randomly locate vacancy defects on nanotubes. Atomistic simul…

Carbon Nanotubes in CompositesGraphene research and applicationsBoron and Carbon Nanomaterials Research

Pionics: the Emerging Science and Technology of Graphene-based Nanoelectronics

Walt A. de Heer、Claire Berger、E. H. Conrad 等 6 位作者2007-12-01OpenAlex

Extremely thin extend layers of graphene are readily grown epitaxially on single crystal silicon carbide surfaces. This material can be patterned using microelectronics lithography methods to produce all-graphene interconnected device structures. The current status of this new field of electronics is presented includi…

Carbon Nanotubes in CompositesGraphene research and applicationsQuantum and electron transport phenomena

Flashover Performance of HVDC Iced Insulator Strings

Peng Li、Jianbin Fan、Wufeng Li 等 5 位作者2007-12-01IEEE Transactions on Dielectrics and Electrical Insulation

Based on artificial icing test results, it was found that the DC flashover voltage of iced insulator strings was non-linear with different string lengths. An experimental formula of flashover voltage on iced insulators of different string lengths is introduced in this paper. Icing tests were carried out on different k…

High voltage insulation and dielectric phenomenaAerosol Filtration and Electrostatic PrecipitationIcing and De-icing Technologies

Analysis of the strain-rate sensitivity of flow stresses in nanocrystalline FCC and BCC metals

G. A. Malygin2007-12-01Physics of the Solid State

The dependence of the strain-rate sensitivity coefficient of flow stresses S = dlnσ/dln $$\dot \varepsilon $$ on temperature, strain rate, and grain size in nanocrystalline (NC) metals is analyzed quantitatively in terms of the dislocation-kinetics approach taking into account the properties of grain boundaries as sou…

Microstructure and mechanical propertiesMetallurgy and Material FormingAdvanced materials and composites

Synthesis and properties of SrFe1 − x M x O3 − z (M = Mo, W) perovskites

O. A. Savinskaya、A. P. Nemudry、N. Z. Lyakhov2007-12-01Inorganic Materials

We have synthesized SrFe1 − x M x O3 − z (M = Mo, W; 0 < x ≤ 0.5) solid solutions. Our results indicate that the introduction of stable MO6 octahedra narrows the range of oxygen stoichiometries of the material and suppresses the perovskite-brownmillerite structural phase transition at low temperatures and oxygen parti…

Magnetic and transport properties of perovskites and related materialsAdvanced Condensed Matter PhysicsElectronic and Structural Properties of Oxides

Green Composites from Sugar Beet Pulp and Poly(lactic acid): Structural and Mechanical Characterization

LinShu Liu、Victoria L. Finkenstadt、C.‐K. Liu 等 7 位作者2007-12-01Journal of Biobased Materials and Bioenergy

The impulse heat-sealing properties of wheat gluten films were investigated. Films containing 30 wt% glycerol were compression molded at 100-130 degrees C and then sealed in a lap-shear or peel-tes ...

Wood Treatment and PropertiesNanocomposite Films for Food PackagingNatural Fiber Reinforced Composites

The Vogel−Fulcher−Tamman Equation Investigated by Atomistic Simulation with Regard to the Adam−Gibbs Model

Noureddine Metatla、Armand Soldera2007-12-01Macromolecules

Many efforts in experimental and theory are dedicated to study the puzzling problem of glass transition. With the involvement of molecular modeling, a fresh look at this intricate phenomenon was taken. Nevertheless, the difficulty to accurately probe all the domains of times necessary to describe this process still re…

Polymer crystallization and propertiesMaterial Dynamics and PropertiesTheoretical and Computational Physics

Doped In-Ge-Te Phase Change Memory Featuring Stable Operation and Good Data Retention

Takahiro Morikawa、Hirokazu Moriya、Tomio Iwasaki 等 16 位作者2007-12-01OpenAlex

We have fabricated a phase change memory using doped In-Ge-Te to improve the data retention required for industrial and automotive use. This chalcogenide features higher thermal stability as well as denser texture and improved adhesion. The memory cell using doped In-Ge-Te provided a larger read margin and better data…

Perovskite Materials and ApplicationsChalcogenide Semiconductor Thin FilmsPhase-change materials and chalcogenides

Liquid Crystal Trimers Composed of Banana-Shaped and Rodlike Anisometric Segments: Synthesis and Characterization

C. V. Yelamaggad、Indudhara Swamy Shashikala、Quan Li2007-12-01Chemistry of Materials

In this article, we report the first examples of mesomorphic linear trimers consisting of bent-core and rodlike anisotropic segments, primarily conceived to explore the possibility of stabilizing optically biaxial mesophase(s), and we briefly review the work carried out in the area of dimers composed of bent-core meso…

Liquid Crystal Research AdvancementsPhotochromic and Fluorescence ChemistryAdvanced Materials and Mechanics

Piezoelectricity of ZnO Films Prepared by Sol-Gel Method

Keming Zhang、Ya-Pu Zhao、Fa-Quan He 等 4 位作者2007-12-01Chinese Journal of Chemical Physics

ZnO piezoelectric thin films were prepared on crystal substrate Si(111) by sol-gel technology, then characterized by scanning electron microscopy, X-ray diffraction and atomic force microscopy (AFM). The ZnO films characterized by X-ray diffraction are highly oriented in (002) direction with the growing of the film th…

ZnO doping and propertiesAdvanced Sensor and Energy Harvesting MaterialsAcoustic Wave Resonator Technologies

The effect of Eu substitution on thermoelectric properties of SrTi0.8Nb0.2O3

Keisuke Kato、Masahiro Yamamoto、Shingo Ohta 等 9 位作者2007-12-01Journal of Applied Physics

Herein we demonstrate that Eu2+ substitution of SrTi0.8Nb0.2O3 is effective in reducing the thermal conductivity, with no reduction in the thermoelectric power factor (S2σ; S, Seebeck coefficient; σ, electrical conductivity). We prepared cubic (Sr,Eu)Ti0.8Nb0.2O3 crystals having the same lattice parameter (a=0.395 nm)…

Advanced Thermoelectric Materials and DevicesMagnetic and transport properties of perovskites and related materialsThermal Expansion and Ionic Conductivity

Photochromic Wool Fabrics from a Hybrid Silica Coating

Tong Cheng、Tong Lin、Jian Fang 等 4 位作者2007-12-01Textile Research Journal

In this work, a photochromic wool fabric has been prepared by applying a photochromic-dye hybrid silica sol-gel onto the surface of fabric. The photochromic fabric was found to have a very quick optical response. Two types of silica were used as the matrix material, and the type of silica had a small effect only on th…

Porphyrin and Phthalocyanine ChemistryPhotochromic and Fluorescence ChemistryPolydiacetylene-based materials and applications

Tribology on the Small Scale

C. Mathew Mate2007-12-01Oxford University Press eBooks

Friction, lubrication, adhesion, and wear are prevalent physical phenomena in everyday life and in many key technologies. This book incorporates a bottom-up approach to friction, lubrication, and wear. This is done by focusing on how these tribological phenomena occur on the small scale — the atomic to the micrometer…

Diamond and Carbon-based Materials ResearchForce Microscopy Techniques and ApplicationsLubricants and Their Additives

Octacyanotungstate(V)-Based Magnetic Complex Consisting of Dimeric Mn2 and Tetrameric Mn2W2

Zhao‐Xi Wang、Li、Tian‐Wei Wang 等 8 位作者2007-12-01Inorganic Chemistry

A novel zero-dimensional (0D) octacyanotungstate(V)-manganese(II) bimetallic assembly, {[MnII(bipy)2]2(ox)}.{[MnII(bipy)2W(CN)8]2}.4H2O (1) (bipy = 2,2'-bipyridine, ox = C2O42-), was synthesized in methanol solution containing oxalic acid. X-ray analysis shows 1 is crystallized in monoclinic crystal system with C2/c s…

Metal-Organic Frameworks: Synthesis and ApplicationsMagnetism in coordination complexesPolyoxometalates: Synthesis and Applications