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Fluctuations and clinicity in tilted smectic liquid crystals

Matthew A. Glaser、Noel A. Clark2002-08-23Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics

The overwhelming majority of tilted smectic liquid crystals exhibit synclinic (Sm-C) ordering (a uniform tilt direction in all smectic layers) rather than anticlinic (Sm-C(A)) ordering (a tilt direction that alternates from layer to layer). We propose that polar molecular-scale fluctuations of the interface between sm…

Liquid Crystal Research AdvancementsTheoretical and Computational PhysicsMolecular spectroscopy and chirality

Photochromic Behavior of a Spiro-indolino-oxazine in Reverse-Mode Polymer-Dispersed Liquid Crystal Films

A. Romani、G. Chidichimo、Patrizia Formoso 等 6 位作者2002-08-23The Journal of Physical Chemistry B

Based on the technology of polymer-dispersed liquid crystals (PDLC), this work deals with the preparation of bifunctional films sensitive to electric fields (changing transparency) and to light (changing color). Contrary to our recently proposed films working in the opaque → transparent way on applying an electric fie…

Liquid Crystal Research AdvancementsPhotonic Crystals and ApplicationsPhotochromic and Fluorescence Chemistry

Spontaneous Decay of Excited Atomic States near a Carbon Nanotube

Igor V. Bondarev、G. Ya. Slepyan、С. А. Максименко2002-08-23Physical Review Letters

The spontaneous decay process of an excited atom placed inside or outside a carbon nanotube is analyzed. Calculations have been performed for various achiral nanotubes. The effect of the nanotube surface is shown to increase the atomic spontaneous decay rate by up to 6 orders of magnitude compared with that of the sam…

Carbon Nanotubes in CompositesGraphene research and applicationsMechanical and Optical Resonators

Atomic resolution structure of squash trypsin inhibitor: unexpected metal coordination

Ram Thaimattam、Ewa Tykarska、Andrzej Bierzyński 等 5 位作者2002-08-23Acta Crystallographica Section D Biological Crystallography

CMTI-I, a small-protein trypsin inhibitor, has been crystallized as a 4:1 protein-zinc complex. The metal is coordinated in a symmetric tetrahedral fashion by glutamate/glutamic acid side chains. The structure was solved by direct methods in the absence of prior knowledge of the special position metal centre and refin…

Protein Structure and DynamicsEnzyme Structure and FunctionBiochemical and Structural Characterization

Negative index of refraction and distributed Bragg reflectors

Jaline Gerardin、Akhlesh Lakhtakia2002-08-23Microwave and Optical Technology Letters

Abstract The Bragg regime shifts when conventional materials in a multilayer distributed Bragg reflector (DBR) are replaced by artificial materials with the so‐called negative index of refraction. This provides an avenue for characterizing the latter class of materials. © 2002 Wiley Periodicals, Inc. Microwave Opt Tec…

Metamaterials and Metasurfaces ApplicationsAdvanced Antenna and Metasurface TechnologiesOptical and Acousto-Optic Technologies

Purification, crystallization and initial crystallographic analysis of RNA polymerase holoenzyme fromThermus thermophilus

Marina N. Vassylyeva、Jookyung Lee、Shun‐ichi Sekine 等 10 位作者2002-08-23Acta Crystallographica Section D Biological Crystallography

RNA polymerase holoenzyme from Thermus thermophilus, consisting of six protein subunits (alpha(2), beta, beta', omega and sigma(70)) and having a total molecular mass of about 450 kDa, was purified and crystallized by the hanging-drop vapour-diffusion technique under mild near-physiological conditions. The crystals di…

Protein Structure and DynamicsRNA and protein synthesis mechanismsEnzyme Structure and Function

Chemical Modification of Chlorinated Microbial Polyesters

Ali Hakan Arkın、Bakı Hazer2002-08-23Biomacromolecules

Chlorination of microbial polyesters poly(3-hydroxybutyrate) (PHB) and poly(3-hydroxyoctanoate) (PHO) was carried out by passing chlorine gas through their solutions. The chlorine contents in chlorinated PHB (PHB-Cl) and chlorinated PHO (PHO-Cl) were between 5.45 and 23.81 wt % and 28.09 and 39.09 wt %, respectively.…

biodegradable polymer synthesis and propertiesMicroplastics and Plastic PollutionCarbon dioxide utilization in catalysis

Water and Ice

Alan K. Soper2002-08-23Science

The water phase diagram is extraordinarily complex. In addition to numerous solid phases of ice, studies have pointed to the existence of distinct amorphous phases. It has even been proposed that there may be a liquid-liquid critical point, where two different liquid phases coexist. In his Perspective, Soper highlight…

Phase Equilibria and ThermodynamicsMaterial Dynamics and Propertiesnanoparticles nucleation surface interactions

Displacement cascades in Gd2Ti2O7 and Gd2Zr2O7: a molecular dynamics study

John A. Purton、Neil L. Allan2002-08-23Journal of Materials Chemistry

We report molecular dynamics simulations of the production of radiation cascades in two pyrochlore compounds that have been proposed as possible materials for high level radioactive waste storage. There are clear differences between the two systems that support the results of recent high energy ion bombardment experim…

Geological and Geochemical AnalysisAdvanced Condensed Matter PhysicsNuclear materials and radiation effects

Silver(III) Carbaporphyrins: The First Organometallic Complexes of True Carbaporphyrins

Melanie A. Muckey、Lisa F. Szczepura、Gregory M. Ferrence 等 4 位作者2002-08-23Inorganic Chemistry

Reaction of carbaporphyrins 1 with silver(I) acetate in methanol-CH(2)Cl(2) gave excellent yields of the related silver(III) complexes 6. These nonpolar organometallic compounds retain fully aromatic properties as judged by UV-vis and NMR spectroscopy and were further characterized by X-ray crystallography and cyclic…

Magnetism in coordination complexesPorphyrin and Phthalocyanine ChemistryMetal-Catalyzed Oxygenation Mechanisms

A Negative Temperature Dependence of the Electron Self-Exchange Rates of Zinc Porphyrin π Radical Cations

Shunichi Fukuzumi、Yoshito Endo、Hiroshi Imahori2002-08-23Journal of the American Chemical Society

The one-electron oxidation of ZnT(t-Bu)PP (T(t-Bu)PP2- = 5,10,15,20-tetrakis(3,5-di-tert-butylphenyl)porphyrin dianion) by one equivalent of Ru(bpy)33+ (bpy = 2,2'-bipyridine) results in quantitative formation of ZnT(t-Bu)PP*+ which is detected by ESR. In the presence of excess ZnT(t-Bu)PP, the ESR line width becomes…

Porphyrin and Phthalocyanine ChemistryPhotochemistry and Electron Transfer StudiesLuminescence and Fluorescent Materials

Shear-Induced Morphologies of Cubic Ordered Block Copolymer Micellar Networks Studied by in Situ Small-Angle Neutron Scattering and Rheology

Kell Mortensen、Elisabeth Theunissen、Ralf Kleppinger 等 5 位作者2002-08-23Macromolecules

Triblock copolymers in a solvent selective for their middle blocks provide the basis for the formation of novel physical networks in which cross-links are formed by self-assembled domains of the end blocks. Triblock copolymers of poly(styrene)−poly(ethylene butylene)−poly(styrene) (SEBS) dissolved in oil constitute su…

Material Dynamics and PropertiesSurfactants and Colloidal SystemsBlock Copolymer Self-Assembly

Hydrodynamics of pair-annihilating disclination lines in nematic liquid crystals

Daniel Svenšek、S. Žumer2002-08-23Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics

The pair annihilation of straight line defects with strength +/-1/2 in bulk nematic systems is studied numerically, considering a full coupling of orientational degrees of freedom and hydrodynamics. This work is based on the generalization of the Ericksen-Leslie theory to the tensor order parameter as proposed by Qian…

Liquid Crystal Research AdvancementsMaterial Dynamics and PropertiesTheoretical and Computational Physics

Aspherical-atom scattering factors from molecular wave functions. 1. Transferability and conformation dependence of atomic electron densities of peptides within the multipole formalism

T. Koritsánszky、Anatoliy Volkov、Philip Coppens2002-08-23Acta Crystallographica Section A Foundations of Crystallography

In this study, the feasibility of building a database of theoretical atomic deformation density parameters applicable to the construction of the densities of biomacromolecules and to the interpretation of their X-ray diffraction data is discussed. The procedure described involves generation of valence-only structure f…

Advanced Chemical Physics StudiesMass Spectrometry Techniques and ApplicationsEnzyme Structure and Function

[Ge9Ge9Ge9]6-: A Linear Trimer of 27 Germanium Atoms

Angel Ugrinov、Slavi C. Sevov2002-08-23Journal of the American Chemical Society

The title anion was synthesized by oxidation of nido-Ge94- with Ph3P or Ph3As in ethylenediamine solution. It was structurally characterized in the compound (Rb-2,2,2-crypt)6[Ge9=Ge9=Ge9].3en (2,2,2-crypt = 4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane) crystallized from the solution. The anion is a linea…

Synthesis and characterization of novel inorganic/organometallic compoundsCrystal Structures and PropertiesInorganic Chemistry and Materials

Competition and coexistence of bond and charge orders in(TMTTF)2AsF6

F. Zámborszky、Weiqiang Yu、W. Raas 等 7 位作者2002-08-23Physical review. B, Condensed matter

$(\mathrm{TMTTF}{)}_{2}{\mathrm{AsF}}_{6}$ undergoes two phase transitions upon cooling from 300 K. At ${T}_{\mathrm{CO}}=103 \mathrm{K}$ a charge ordering (CO) occurs, and at ${T}_{\mathrm{SP}}(B=9 \mathrm{T})=11 \mathrm{K}$ the material undergoes a spin-Peierls transition. Within the intermediate, CO phase, the char…

Magnetism in coordination complexesOrganic and Molecular Conductors ResearchInorganic Fluorides and Related Compounds

New Molecular Perovskites: Cubic C4N2H12·NH4Cl3·H2O and 2-H Hexagonal C6N2H14·NH4Cl3

C.A. Bremner、Michael Simpson、William T. A. Harrison2002-08-23Journal of the American Chemical Society

The room-temperature syntheses and single-crystal structures of C(4)N(2)H(12).NH(4)Cl(3).H(2)O and C(6)N(2)H(14).NH(4)Cl(3) are reported. These novel molecular perovskites contain vertex-sharing octahedral (NH(4))Cl(6) arrays which replicate the octahedral packing in the cubic (SrTiO(3)) and 2-H hexagonal (BaNiO(3)) p…

Luminescence Properties of Advanced MaterialsCatalytic Processes in Materials ScienceInorganic Fluorides and Related Compounds

Even-odd effects in magnetoresistance of ferromagnetic domain walls

M. Dzero、L. P. Gor'kov、A. K. Zvezdin 等 4 位作者2002-08-23arXiv

Difference in density of states for the spin's majority and minority bands in a ferromagnet changes the electrostatic potential along the domains, introducing the discontinuities of the potential at domain boundaries. The value of discontinuity oscillates with number of domains. Discontinuity depends on the positions…

Materials Science

Reversible melting and equilibrium phase formation of (Bi,Pb)2Sr2Ca2Cu3O10+d

E. Giannini、I. Savysyuk、V. Garnier 等 6 位作者2002-08-23arXiv

The decomposition and the reformation of the (Bi,Pb)2Sr2Ca2Cu3O10+d (?Bi,Pb(2223)?) phase have been investigated in-situ by means of High-Temperature Neutron Diffraction, both in sintered bulk samples and in Ag-sheathed monofilamentary tapes. Several decomposition experiments were performed at various temperatures and…

Materials ScienceSuperconductivity

Superconductivity in molecular solids with Jahn-Teller phonons

J. E. Han、O. Gunnarsson、V. H. Crespi2002-08-23arXiv

We analyze fulleride superconductivity at experimental doping levels, treating the electron-electron and electron-phonon interactions on an equal footing, and establish the existence of novel physics which helps explain the unusually high superconducting transition temperatures in these systems. The Jahn-Teller phonon…

Materials ScienceStrongly Correlated Electrons