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Current state and prospects of macromolecular crystallography

Zbigniew Dauter2005-12-14Acta Crystallographica Section D Biological Crystallography

The current situation and possible future development of macromolecular crystallography are reviewed. The rapid progress and maturation of this field in recent years have to a large extent been made possible by the inspiration and generous support of several active structural genomics initiatives. Two tendencies can b…

Protein Structure and DynamicsEnzyme Structure and FunctionPorphyrin Metabolism and Disorders

Real‐Time Observation of a Non‐Equilibrium Liquid Condensate Confined at Tensile Crack Tips in Oxide Glasses

Lothar Wondraczek、A. Dittmar、C. Oelgardt 等 6 位作者2005-12-14Journal of the American Ceramic Society

As crack propagation in oxide materials at low crack velocities is partly determined by chemical corrosion, proper knowledge of the crack tip chemistry is crucial for understanding fracture in these materials. Such knowledge can be obtained only from in situ studies because the processes that occur in the highly confi…

Nuclear Materials and PropertiesNuclear materials and radiation effectsElectronic and Structural Properties of Oxides

Surface functionalization of polymer nanofibers by silver sputter coating

Qufu Weı、Hai Ye、Dayin Hou 等 5 位作者2005-12-14Journal of Applied Polymer Science

Abstract The surface properties of polymer nanofibers are of importance in many applications. In this study, the electrospun polyamide nanofibers were used as substrates for creating functional coating on the nanofiber surfaces. A direct current (DC) sputter coating was used to deposit functional silver nanofilm onto…

Advanced Sensor and Energy Harvesting MaterialsElectrospun Nanofibers in Biomedical ApplicationsPolymer Nanocomposite Synthesis and Irradiation

Ground-State Interactions of Spermine-Substituted Naphthalimides with Mononucleotides

Sun McMasters、Lisa A. Kelly2005-12-14The Journal of Physical Chemistry B

Water soluble spermine, spermine-naphthalimide, and pyridinium-substituted 1,8-naphthalimide derivatives have been synthesized as nucleotide-specific binding agents. Both mono- and bifunctionalized spermine compounds were studied. The photophysical properties of each compound were studied by using time-resolved and st…

Advanced biosensing and bioanalysis techniquesDNA and Nucleic Acid ChemistryLuminescence and Fluorescent Materials

Investigation on the Tensile Properties of Knitted Fabric Reinforced Composites made from GF-PP Commingled Yarn Preforms with Different Loop Densities

Fan Zaixia、Zhangyu、Yanmo Chen 等 4 位作者2005-12-14Journal of Thermoplastic Composite Materials

The influence of the loop density of rib 1: 1 fabric preform made from GF-PP commingled yarn on the tensile properties of the composites is investigated. Six samples of rib 1: 1 fabric preform with different loop densities are studied. It has been found that the tensile strength of composites show an increase followed…

Mechanical Behavior of CompositesTextile materials and evaluationsStructural Analysis and Optimization

First-principles studies on the pressure dependences of the stress–strain relationship and elastic stability of semiconductors

Shaoqing Wang、H Q Ye、Sidney Yip2005-12-14Journal of Physics Condensed Matter

We investigate the stress–strain relationship and elastic stability of zinc-blende GaP, GaN, InP and BN lattices under hydrostatic pressure by first-principles calculation. A simple and direct ab initio implementation for studying the mechanical properties of cubic crystals is developed. The four phases' full-set stre…

High-pressure geophysics and materialsThermal properties of materialsBoron and Carbon Nanomaterials Research

Direct observation of alumina nanowire formation from porous anodic alumina membrane via the droplet etching method

J. Kim、Yong Chan Choi、K-S Chang 等 4 位作者2005-12-14Nanotechnology

We report the first direct observation of the formation process of an alumina nanowire (ANW) array from a porous anodic alumina (PAA) membrane employing a simple droplet etching method, not a general immersion etching method, using field emission scanning electron spectroscopy (FESEM). The PAA membrane is prepared by…

Semiconductor materials and devicesAnodic Oxide Films and NanostructuresSmart Materials for Construction

Dendritic nano- and microhydrogels fabricated by triethoxysilyl focal dendrons

Daisuke Onoshima、Toyoko Imae2005-12-14Soft Matter

Nano- and microhydrogels were fabricated in water by first to third generation triethoxysilyl focal poly(amido amine) dendrons with hexyl spacer. The focal points of dendrimers were hydrolyzed and covalent-bonded through the simple sol-gel process at an acidic or basic catalytic condition. The growth of aggregates and…

Luminescence and Fluorescent MaterialsDendrimers and Hyperbranched PolymersPolydiacetylene-based materials and applications

A Novel Method to Evaluate the Influence of Hydrogen on Fatigue Properties of High Strength Steels

Y. Matsubara、Hideki Hamada2005-12-14Journal of ASTM International

Abstract In rolling contact fatigue, hydrogen is believed to contribute to early flaking failures under some conditions. Hydrogen diffuses quickly in steels, even at room temperature, thus resulting in its dissipation into the surrounding atmosphere. This condition presents a uniquely difficult challenge for evaluatin…

Fatigue and fracture mechanicsHydrogen embrittlement and corrosion behaviors in metalsNuclear Materials and Properties

Surprising conductive- and dielectric-system dispersion differences and similarities for two Kohlrausch-related relaxation-time distributions

J. Ross Macdonald2005-12-14Journal of Physics Condensed Matter

General distributions of relaxation times are discussed and then specialized to two types associated with Kohlrausch stretched-exponential temporal response, the K0 and K1 models. For the important choice of 1/3 for their beta shape parameters, their specific distributions and different temporal responses are first co…

Material Dynamics and PropertiesElectrochemical Analysis and ApplicationsSolid-state spectroscopy and crystallography

Magnetic anisotropy in the cubic Laves REFe2intermetallic compounds

K N Martin、P.A.J. de Groot、B.D. Rainford 等 7 位作者2005-12-14Journal of Physics Condensed Matter

In the past, the Callen–Callen (1965 Phys. Rev. 139 A455–71; 1966 J. Phys. Chem. Solids 27 1271–85) model has been highly successful in explaining the origin and temperature dependence of the magneto-crystalline anisotropy in many magnetic compounds. Yet, despite their high ordering temperatures of ∼650 K, the Callen–…

Magnetic properties of thin filmsMagnetism in coordination complexesMagnetic Properties of Alloys

New Soft Chemical Routes to Ferroelectric SrBi2Ta2O9

Keshwaree Babooram、Zuo‐Guang Ye2005-12-14Chemistry of Materials

Ferroelectric ceramics of strontium bismuth tantalate, SrBi 2 Ta 2 O 9 (SBT), have been synthesized in pure layer-structured perovskite phase by two new soft chemical techniques, namely, a sol−gel process and a coprecipitation method. The sol−gel process utilizes ethylene glycol as solvent while the coprecipitation te…

Ferroelectric and Piezoelectric MaterialsMultiferroics and related materialsMicrowave Dielectric Ceramics Synthesis

Deformation-promoted reactivity of single-walled carbon nanotubes

Kausala Mylvaganam、L C Zhang2005-12-14Nanotechnology

This paper investigates the effect of mechanical deformation of a single-walled carbon nanotube (SWNT) on its reactivity with hydrogen and alkyl radicals. The influence of individual loading modes was explored with the aid of molecular dynamics simulation for deformation and quantum mechanics analysis for reaction. Th…

Carbon Nanotubes in CompositesHydrogen Storage and MaterialsBoron and Carbon Nanomaterials Research

Low-temperature excitonic, electron–hole and interstitial-vacancy processes in LiF single crystals

S. Nakonechnyi、T. Kärner、A. Lushchik 等 10 位作者2005-12-14Journal of Physics Condensed Matter

Low-temperature excitonic, electron–hole and interstitial-vacancy processes in LiF single crystals, Nakonechnyi, S, Kärner, T, Lushchik, A, Lushchik, Ch, Babin, V, Feldbach, E, Kudryavtseva, I, Liblik, P, Pung, L, Vasil’chenko, E

Luminescence Properties of Advanced MaterialsGa2O3 and related materialsInorganic Fluorides and Related Compounds

Controlled placement of highly aligned carbon nanotubes for the manufacture of arrays of nanoscale torsional actuators

Thomas D. Yuzvinsky、Adam Fennimore、András Kis 等 4 位作者2005-12-14Nanotechnology

We have fabricated ordered arrays of nanoscale torsional actuators consisting of metal mirrors bonded to precisely oriented multiwall carbon nanotubes. The fabrication is facilitated by a new nanotube positioning method which employs localized electron beam activation of polymer residue on a silicon oxide surface.

Carbon Nanotubes in CompositesAdvanced MEMS and NEMS TechnologiesMechanical and Optical Resonators

Engineering of an iron–terpyridine complex with supramolecular gels and mesomorphic properties

F. Camerel、R. Ziessel、Bertrand Donnio 等 4 位作者2005-12-14New Journal of Chemistry

A new iron–terpyridine complex based on a 3,5-diacylaminotoluene platform bearing two phenyl rings appended with aliphatic chains provides robust and transparent organo-gels and liquid-crystalline materials. The LC mesophase was characterized by small-angle X-ray diffraction, and is described as a columnar phase with…

Supramolecular Chemistry and ComplexesLuminescence and Fluorescent MaterialsSupramolecular Self-Assembly in Materials

Heisenberg-like critical properties in ferromagnetic Nd1−xPbxMnO3single crystals

Nilotpal Ghosh、Sahana Rößler、U. Rößler 等 8 位作者2005-12-14Journal of Physics Condensed Matter

Static magnetization for single crystals of insulating Nd0.85Pb0.15MnO3 and marginally conducting Nd0.70Pb0.30MnO3 has been studied around the ferromagnetic to paramagnetic transition temperature T-C. Results of measurements carried out in the critical range vertical bar(T - T-C)/T-C vertical bar <= 0.1 are reported.…

Theoretical and Computational PhysicsMagnetic and transport properties of perovskites and related materialsAdvanced Thermodynamics and Statistical Mechanics

Tin doped indium oxide transparent conducting thin films containing silver nanoparticles by sol-gel technique

Boen Houng2005-12-14Applied Physics Letters

Tin doped indium oxide films (ITO) with embedded silver nanoparticles were prepared by a sol-gel spin coating method. Delafossite structure of tin doped AgInO2 was found at lower annealing temperatures in all compositions and decomposed into ITO and Ag as annealing temperatures were increased. The interconnected netwo…

ZnO doping and propertiesQuantum Dots Synthesis And PropertiesCopper-based nanomaterials and applications

Understanding the Crystallization of Nanosized Cobalt Aluminate Spinel from Ion-Exchanged Zeolites Using Combined in Situ QEXAFS/XRD

Andrew M. Beale、Gopinathan Sankar2005-12-14Chemistry of Materials

By using combined QEXAFS/XRD (supported by measurements obtained using DSC, XRD, and IR spectroscopy), we have studied, in situ, the evolution of nanosized cobalt aluminate spinel (CoAl 2 O 4 ) particles from cobalt-ion-exchanged zeolite precursors. All of the cobalt-ion-exchanged zeolites were observed to first under…

Luminescence Properties of Advanced MaterialsGlass properties and applicationsNuclear materials and radiation effects

Microwave irradiation method for the synthesis of water-soluble CdSe nanoparticles with narrow photoluminescent emission in aqueous solution

Maoquan Chu、Xiaoyan Shen、Guojie Liu2005-12-14Nanotechnology

Water-soluble CdSe nanoparticles with cubic phase and narrow photoluminescent emission have been synthesized in aqueous solution with the assistance of citric acid (CA) molecules by a microwave irradiation method. This synthesis process was so rapid that the CdSe nanoparticles were obtained within just a few minutes.…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNanocluster Synthesis and Applications