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Heterogeneous and homogeneous dynamics in a simulated polymer melt: Analysis of multi-time correlation functions

Andreas Heuer、K. Okún1997-04-08The Journal of Chemical Physics

In general, nonexponential relaxation can result either from a heterogeneous (superposition of different exponential processes) or a homogeneous scenario (identical intrinsically nonexponential processes). In the present paper for the first time a strict definition of both scenarios is formulated. A procedure is prese…

Material Dynamics and PropertiesTheoretical and Computational PhysicsThermodynamic properties of mixtures

Ewald methods for polarizable surfaces with application to hydroxylation and hydrogen bonding on the (012) and (001) surfaces of alpha-Fe2O3

E. Wasserman、J. R. Rustad、A. R. Felmy 等 5 位作者1997-04-08arXiv

We present a clear and rigorous derivation of the Ewald-like method for calculation of the electrostatic energy of the systems infinitely periodic in two-dimensions and of finite size in the third dimension (slabs) which is significantly faster than existing methods. Molecular dynamics simulations using the transferab…

Materials Science

Dielectric properties of from to Hz in the temperature range 85 - 700 K

Zhi Yu、Chen Ang、Zhi Jing 等 5 位作者1997-04-07Journal of Physics Condensed Matter

ceramics with x = 0.1, 0.2, 0.3, 0.33, 0.4 and 0.5 have been synthesized by the mixed oxide method. Dielectric measurements were performed for ceramics from to Hz in the temperature range 85 - 700 K. The dielectric measurements confirmed that the solid solution range extends up to about x = 0.3. In the solid solutions…

Ferroelectric and Piezoelectric MaterialsAcoustic Wave Resonator TechnologiesMicrowave Dielectric Ceramics Synthesis

Crystal structure and electronic transport property of perovskite manganese oxides with a fixed tolerance factor

Jirong Sun、G. H. Rao、Jun Liang1997-04-07Applied Physics Letters

The structural and electronic transport properties of ABO3-type compounds La2/3−xRxCa1/3MnO3(R=Pr, Nd, Sm, Eu, Gd, Tb, Dy, Y, Er, and Tm) with a fixed tolerance factor of t=0.91137 is studied. Similar structure deformation, characterized by the nearly constant average Mn–O, A–O distances and Mn–O–Mn bond angles, is ob…

Magnetic and transport properties of perovskites and related materialsAdvanced Condensed Matter PhysicsThermal Expansion and Ionic Conductivity

Behavior of Ni in carbon nanotube nucleation

Masako Yudasaka、Rie Kikuchi、Yoshimasa Ohki 等 5 位作者1997-04-07Applied Physics Letters

A nucleation model was proposed for a carbon nanotube enclosing a Ni bar which was grown by chemical vapor deposition (CVD) at 700 °C using round Ni particles. At an early stage of CVD, each round Ni particle with a diameter of about 30 nm is covered with graphite layers. The graphite-covered Ni particle is considered…

Carbon Nanotubes in CompositesGraphene research and applicationsFiber-reinforced polymer composites

Finite element simulation of high-speed soft-body impacts

Frederick Stoll、Robert A. Brockman、Frederick Stoll 等 4 位作者1997-04-0738th Structures, Structural Dynamics, and Materials Conference

Military fighter aircraft occasionally suffer highspeed collisions with birds, posing a threat to pilot safety and to the structural integrity of the aircraft. An explicit three-dimensional finite element code for transient dynamic analysis, named X3D, has been developed at the University of Dayton Research Institute…

High-Velocity Impact and Material BehaviorElectromagnetic Launch and Propulsion TechnologyTransportation Safety and Impact Analysis

The influence of surface charge upon flash-over of particle-contaminated insulators in under impulse-voltage conditions

Jun Xie、I.D. Chalmers1997-04-07Journal of Physics D Applied Physics

This paper presents an experimental investigation of the effect of surface charge upon the impulse flash-over of metallic-particle-contaminated insulators, which were clamped between two parallel planar electrodes, in at 1.0 bar. The results show that the accumulated surface charge greatly affects the impulse flash-ov…

High voltage insulation and dielectric phenomenaLightning and Electromagnetic PhenomenaPower Line Communications and Noise

An Atom-Specific Look at the Surface Chemical Bond

Anders Nilsson、Martin Weinelt、T. Wiell 等 8 位作者1997-04-07Physical Review Letters

High resolution x-ray emission spectroscopy is shown to reveal unprecedented details of the chemical bond formed between a molecule and a transition metal surface. An atom and symmetry projected view of the bonding orbitals is obtained. We find that all outer and inner valence orbitals of the molecule change due to th…

Machine Learning in Materials ScienceElectron and X-Ray Spectroscopy TechniquesAdvanced Materials Characterization Techniques

Hysteresis, Avalanches, and Barkhausen Noise

James P. Sethna、Olga Perkovic、Karin A. Dahmen1997-04-07arXiv

Hysteresis, the lag between the force and the response, is often associated with noisy, jerky motion which have recently been called ``avalanches''. The interesting question is why the avalanches come in such a variety of sizes: naively one would expect either all small events or one large one. Power-law distributions…

Materials ScienceSoft Condensed Mattercond-mat.stat-mech

In situ monitoring during pulsed laser deposition of complex oxides using reflection high energy electron diffraction under high oxygen pressure

Guus Rijnders、Gertjan Koster、Dave H. A. Blank 等 4 位作者1997-04-07Applied Physics Letters

A suitable in situ monitoring technique for growth of thin films is reflection high energy electron diffraction (RHEED). Deposition techniques, like pulsed laser deposition (PLD) and sputter deposition, used for fabrication of complex oxide thin films use relatively high oxygen pressures (up to 100 Pa) and are, theref…

Semiconductor materials and devicesMagnetic and transport properties of perovskites and related materialsElectronic and Structural Properties of Oxides

Electronic Structure and Localized States at Carbon Nanotube Tips

D. L. Carroll、Philipp Redlich、P. M. Ajayan 等 7 位作者1997-04-07OpenAlex

Topology related changes in the local density of states near the ends of closed carbon nanotubes are investigated using spatially resolved scanning tunneling spectroscopy and tight binding calculations. Sharp resonant valence band states are observed in the experiment at the tube ends, dominating the valence band edge…

Carbon Nanotubes in CompositesGraphene research and applicationsFullerene Chemistry and Applications

Structure and metastability of superheated Al(111)

G. Bilalbegovic1997-04-05arXiv

The high-temperature properties of the Al(111) surface are studied by molecular-dynamics simulation. This surface does not melt below the bulk melting point, but can be superheated. Superheating of metal surfaces has been recently observed in several experiments. A molecular-dynamics study of the structural properties…

Materials Sciencecond-mat.stat-mech

Amorphous phenolphthalein-based poly(arylene ether)- modified cyanate ester networks: Effect of thermal cure cycle on morphology and toughenability

S. Srinivasan、J. E. McGrath1997-04-04Journal of Applied Polymer Science

Reactive functional thermoplastic poly(arylene ether) toughness modifiers were demonstrated to enhance toughness of brittle thermosetting cyanate ester networks and also allowed retention of a highly desirable stability to solvent stress cracking and a moderately high modulus. Careful control of the heterophase morpho…

Polymer crystallization and propertiesEpoxy Resin Curing ProcessesSynthesis and properties of polymers

Cooperative relaxation processes in polymers

Shiro Matsuoka、A. Hale1997-04-04Journal of Applied Polymer Science

The basic mode of relaxation in polymer molecules involves the rotation of a conformer, with a time scale of the order of picoseconds. This fast relaxation process, however, cannot take place easily in the condensed state crowded by densely packed conformers, necessitating the intermolecular cooperativity among them.…

Polymer crystallization and propertiesMaterial Dynamics and PropertiesThermal and Kinetic Analysis

Polymer networks derived from the anhydride curing of tetraepoxides

María Ángeles Corcuera、Iñaki Mondragòn、Carmen C. Riccardi 等 4 位作者1997-04-04Journal of Applied Polymer Science

The cure of a technical-grade TGDDM (N,N,N′N′-tetraglycidyl-4,4′-diaminodiphenylmethane) with two different anhydride hardeners (hexahydrophthalic anhydride [HHPA] and tetrahydrophthalic anhydride [THPA]) is reported. The reaction was followed by differential scanning calorimetry (DSC), in situ infrared spectroscopy (…

Epoxy Resin Curing ProcessesSynthesis and properties of polymersPhotopolymerization techniques and applications

Modeling of unsaturated polyester prepolymer structures. I. Chain branches and overall chain end numbers

Yeong-Show Yang、Jean Pierre Pascault1997-04-04Journal of Applied Polymer Science

A review on the synthesis of unsaturated polyester (UP) prepolymers showed that Ordelt saturation (reaction of hydroxyl groups with double bonds) is the major effect that may cause formation of chain branches and then result in an uncertainty of chain end number or functionality. A model has been derived in this work…

Polymer crystallization and propertiesbiodegradable polymer synthesis and propertiesPolymer Science and PVC

Chemoselective Polyalkylations of Phosphorus‐Containing Dendrimers

Christophe Larré、Anne‐Marie Caminade、Jean‐Pierre Majoral1997-04-04Angewandte Chemie International Edition in English

At the core, at the core and at the surface, within the cascade structure, or within the cascade structure and at the surface are different ways in which the dendrimers described here can be selectively alkylated. These phosphorus-containing dendrimers have generations of different constitution (example depicted on th…

Chemical Synthesis and AnalysisDendrimers and Hyperbranched PolymersFerrocene Chemistry and Applications

Hydrolysis and blistering of cyanate ester networks

Leo J. Kasehagen、Idelette Haury、Christopher W. Macosko 等 4 位作者1997-04-04Journal of Applied Polymer Science

The hydrolysis of a cyanate ester network made from the monomer 2,2′-bis(4-cyanatophenyl) isopropylidene (bisphenol A dicyanate homopolymer) was studied. Hydrolysis reactions were performed isothermally at temperatures from 150 to 180°C under conditions of excess water. The kinetics of the reaction were characterized…

Polymer crystallization and propertiesEpoxy Resin Curing ProcessesSynthesis and properties of polymers

Comparison of thermal techniques for glass transition assignment. II. Commercial polymers

Rosalie G. Ferrillo、Peter J. Achorn1997-04-04Journal of Applied Polymer Science

The differential scanning calorimetry glass transition (DSC Tg), measured by ASTM test method E-1356, and the dynamic mechanical analysis glass transition (DMA Tg), measured using a new definition of the DMA Tg, generally agree within ±4°C for a wide variety of commercially available polymers. The DMA Tg is defined as…

Polymer crystallization and propertiesMaterial Dynamics and PropertiesPolymer Nanocomposites and Properties

Millimeter wave and optical dielectric integrated guides and circuits

Shiban K. Koul1997-04-04OpenAlex

Introduction to Dielectric Guides Analysis of Dielectric Integrated Guides: Approximate Methods Analysis of Dielectric Integrated Guides: Rigorous Methods Image-, Insular Image-, Trapped Image- and other Variant Guides Semiconductor and Planar Optical Guides Non-Radiative Dielectric Guide Non-Planar Dielectric Guides…

Optical Coatings and Gratings