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Nucleation in binary polymer blends: A self-consistent field study

Stephen M. Wood、Zhen‐Gang Wang2002-02-01The Journal of Chemical Physics

We study the structure and thermodynamics of the critical nuclei in metastable binary polymer blends using the self-consistent field method. At the mean-field level, our results are valid throughout the entire metastable region and provide a smooth crossover from the classical capillary-theory predictions near the coe…

Material Dynamics and PropertiesTheoretical and Computational PhysicsBlock Copolymer Self-Assembly

Chloride ion sites in silicate and aluminosilicate glasses: A preliminary study by 35 Cl solid-state NMR

Jonathan F. Stebbins、Lin‐Shu Du2002-02-01American Mineralogist

Despite the importance of the chloride ion in magmas and the fluids that separate from them, very little is known about atomic-scale structural environments for Cl- in silicate glasses. We present here the first solid-state 35 Cl NMR data for Cl in silicate and aluminosilicate glasses, made possible by the availabilit…

Glass properties and applicationsAdvanced NMR Techniques and ApplicationsSolid-state spectroscopy and crystallography

Colorful Azulene and Its Equally Colorful Derivatives

Robert S. H. Liu2002-02-01Journal of Chemical Education

A simple pictorial method using HOMO, LUMO, and LUMO+1 of azulene coupled with interaction between the electrons in the singly occupied orbitals is introduced to show how the S 2 -S 0 energy gap relative to the S 1 -S 0 gap can be changed by a choice of substituents. The result is changing the characteristic blue colo…

Photochromic and Fluorescence Chemistry

Morphology and Organization of Poly(propylene imine) Dendrimers in the Melt from Molecular Dynamics Simulation

N. Zacharopoulos、Ioannis G. Economou2002-02-01Macromolecules

Molecular dynamics simulations are performed on generations 2 ( G 2) through 5 ( G 5) of poly(propylene imine) dendrimers at 400 K in order to investigate characteristics of molecular structure and morphology in the melt. As the generation increases, the dendrimers assume a more spherical shape, and the degree of dend…

Advanced Polymer Synthesis and CharacterizationFuel Cells and Related MaterialsDendrimers and Hyperbranched Polymers

Chemical short range order obtained from the atomic pair distribution function

Thomas Proffen、Valeri Petkov、Simon J. L. Billinge 等 4 位作者2002-02-01Zeitschrift für Kristallographie - Crystalline Materials

Abstract Many crystalline materials show chemical short range order and relaxation of neighboring atoms. Local structural information can be obtained by analyzing the atomic pair distribution function (PDF) obtained from powder diffraction data. In this paper, we present the successful extraction of chemical short ran…

Crystallography and molecular interactionsCrystal Structures and PropertiesX-ray Diffraction in Crystallography

Dislocation approach to the plastic deformation of semicrystalline polymers: Kinetic aspects for polyethylene and polypropylene*

Roland Séguéla2002-02-01Journal of Polymer Science Part B Polymer Physics

Abstract The plasticity of semicrystalline polymers is analyzed in the framework of Young's dislocation model under the assumption of nucleation of screw dislocations from the lateral surface of the crystalline lamellae. It is proposed that the driving force for the nucleation and propagation across the crystal width…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesRheology and Fluid Dynamics Studies

Stable and efficient Bloch-mode computational method for one-dimensional grating waveguides

Qing Cao、Philippe Lalanne、Jean‐Paul Hugonin2002-02-01Journal of the Optical Society of America A

We present a stable and efficient method for the Bloch-mode computation of one-dimensional grating waveguides. The approach uses the Fourier modal method and the S-matrix algorithm to remove numerical instabilities. The use of perfectly matched layers provide a high accuracy. Numerical results obtained for different l…

Photonic and Optical DevicesPhotonic Crystals and ApplicationsOptical Coatings and Gratings

Novel Superstructure of Nondiscoid Mesogens: Uneven-Parallel Association of Half-Disk Molecules, 3,4,5-Trialkoxybenzoic Anhydrides, to a Columnar Structure and Its One-Directionally Geared Interdigitation

Keiki Kishikawa、Shigetaka Furusawa、T. Yamaki 等 6 位作者2002-02-01Journal of the American Chemical Society

Compact and simple nondiscoid mesogens, trialkoxybenzoic anhydrides 2-11 ((RO)(3)C(6)H(2)-CO-O-CO-C(6)H(2)(OR)(3), R = C(2)H(5), n-C(3)H(7), n-C(4)H(9), n-C(6)H(13), n-C(8)H(17), n-C(10)H(21), n-C(12)H(25), n-C(14)H(29), n-C(16)H(33), and (S)- and (R)-3,7-dimethyloctyl) were designed and synthesized, and their superst…

Liquid Crystal Research AdvancementsSurfactants and Colloidal SystemsMolecular spectroscopy and chirality

Liposomal doxorubicin in conjunction with reirradiation and local hyperthermia treatment in recurrent breast cancer: a phase I/II trial.

Vassilis Kouloulias、Costas E. Dardoufas、John Kouvaris 等 10 位作者2002-02-01PubMed

PURPOSE: This is the first study to evaluate the tolerability and activity of liposomal doxorubicin (Caelyx; Schering-Plough Pharmaceuticals) < or =60 mg/km(2) in patients with locally recurrent breast cancer, when administered in conjunction with reirradiation and local hyperthermia treatment. EXPERIMENTAL DESIGN: Fi…

Nanoparticle-Based Drug DeliveryNanoplatforms for cancer theranosticsUltrasound and Hyperthermia Applications

Refinement of the crystal structures of Cu3PS4and Cu3SbS4and a comment on normal tetrahedral structures

Arno Pfitzner、Sara Reiser2002-02-01Zeitschrift für Kristallographie - Crystalline Materials

Abstract The crystal structures of yellow Cu 3 PS 4 and of black Cu 3 SbS 4 were refined from single crystal X-ray diffraction data. Cu 3 PS 4 crystallizes orthorhombic in an ordered wurtzite superstructure type with the space group Pmn 2 1 (no. 31), a = 7.282(1) Å, b = 6.339(1) Å, c = 6.075(1) Å, V = 280.38(8) Å 3 ,…

Crystal Structures and PropertiesAdvanced Condensed Matter PhysicsIron-based superconductors research

Continuum Limits of Discrete Systems without Convexity Hypotheses

Andrea Braides、Maria Stella Gelli2002-02-01Mathematics and Mechanics of Solids

We describe the variational limit of one-dimensional nearest-neighbour systems of interactions, under no structure hypotheses on the discrete energy densities. We show that the continuum limit is characterized by a bulk and a interfacial energy density, which can be explicitly computed from the discrete energies throu…

Numerical methods in engineeringComposite Material MechanicsNonlocal and gradient elasticity in micro/nano structures

Hybrid Polyamide/Silica Nanocomposites: Synthesis and Mechanical Testing

Werner E. van Zyl、Monserrat Garcı́a、Bernard A. G. Schrauwen 等 6 位作者2002-02-01Macromolecular Materials and Engineering

A hybrid inorganic-polymer composite was formed through nanosize silica filler particles (< 30 nm) that were incorporated inside a nylon-6 matrix. The composite was microtomed and examined with TEM which revealed that the silica particles were well dispersed and non-aggregated. Optimization of the synthesis conditions…

Polymer Nanocomposites and PropertiesSynthesis and properties of polymersSilicone and Siloxane Chemistry

Appearance of n-Type Semiconducting Properties of cBN Single Crystals Grown at High Pressure

Takashi Taniguchi、Tokuyuki Teraji、Satoshi Koizumi 等 5 位作者2002-02-01Japanese Journal of Applied Physics

Semiconducting properties of two types of cubic boron nitride (cBN) single crystals prepared at high pressure and high temperature were evaluated by Hall measurement. Sulfur was intentionally doped in one type as a donor and the other type contained no intentional dopants. Both crystals exhibit n-type conduction. Sulf…

Graphene research and applicationsDiamond and Carbon-based Materials ResearchBoron and Carbon Nanomaterials Research

Sandia Octahedral Molecular Sieves (SOMS): Structural and Property Effects of Charge-Balancing the MIV-Substituted (M = Ti, Zr) Niobate Framework

May Nyman、Akhilesh Tripathi、John B. Parise 等 5 位作者2002-02-01Journal of the American Chemical Society

Sandia octahedral molecular sieves (SOMS) is an isostructural, variable composition class of ion exchangers with the general formula Na(2)Nb(2-x)M(IV)(x)O (6-x)(OH)(x).H(2)O (M(IV) = Ti, Zr; x = 0.04-0.40) where up to 20% of the framework Nb(V) can be substituted with Ti(IV) or Zr(IV). This class of molecular sieves i…

Ferroelectric and Piezoelectric MaterialsCrystal Structures and PropertiesElectronic and Structural Properties of Oxides

Size effect on the thermal conductivity of nanowires

Xiang Lü、Wei Shen、Junhao Chu2002-02-01Journal of Applied Physics

The size effect on thermal conductivity of a free-standing wire with rectangular cross-section is investigated. The electronic thermal conductivity is calculated within a Boltzmann transport equation approach. A simple expression for the reduction in conductivity due to the increase of boundary scattering is presented…

Nanowire Synthesis and ApplicationsThermal properties of materialsAdhesion, Friction, and Surface Interactions

Analyzing Structural and Physical Properties of Ring, Rotor, and Friction Spun Yarns

You Huh、Young Ryul Kim、William Oxenham2002-02-01Textile Research Journal

This research is a comparative study of the structural and physical properties of ring, rotor, and friction spun yams and an attempt to explain the differences in their physical properties on the basis of yam structure. Results show that the ring spun yam exhibits the highest fiber migration, followed by rotor spun ya…

Natural Fiber Reinforced CompositesTextile materials and evaluationsStructural Analysis and Optimization

Polymer−Silica Hybrid Monolayers as Precursors for Ultrathin Free-Standing Porous Membranes

Hui Xu、Werner A. Goedel2002-02-01Langmuir

Forty-nanometer-thin free-standing membranes with 55-nm-wide pores have been prepared via Langmuir−Blodgett transfer. Hydrophobized silica colloids and polyisoprenes with quaternary ammonium headgroups were jointly spread onto a water surface to form a hybrid monolayer in which two-dimensional ordered domains of parti…

Photonic Crystals and ApplicationsMesoporous Materials and CatalysisPolymer Surface Interaction Studies

Significance of the Formation of Calcium Carbonate Minerals in the Pedogenesis and Management of Cracking Clay Soils (Vertisols) of India

Pankaj Srivastava、T. Bhattacharyya、Dilip Kumar Pal2002-02-01Clays and Clay Minerals

Abstract Micromorphological studies were performed in order to understand the factors and processes involved in the formation of calcium carbonate (CaCO 3 ) in twenty three soil series of Vertisols representing sub-humid, semi-arid and arid climatic regions of Peninsular India. The study indicates that Vertisols conta…

Geology and Paleoclimatology ResearchSoil and Unsaturated FlowClay minerals and soil interactions

Synthesis and spectroscopic characterization of Ni, Zn, Pd and Pt tetra(pentafluorophenyl)porpholactone with comparisons to Mg, Zn, Y, Pd and Pt metal complexes of tetra(pentafluorophenyl)porphine

Gamal Khalil、Martin Gouterman、Stephen Ching 等 11 位作者2002-02-01Journal of Porphyrins and Phthalocyanines

Ni , Zn , Pd and Pt tetra(pentafluorophenyl)porpholactone (TFPL) were synthesized and identified by their optical and mass spectra. The lactone ring was produced from the parent free-base porphyrin using silver nitrate and oxalic acid with a yield of 73%, and the metals were inserted by standard procedures from metal…

Porphyrin and Phthalocyanine ChemistryPhotodynamic Therapy Research StudiesPhotochemistry and Electron Transfer Studies

Optical absorption and photoluminescence studies on CdS quantum dots in Nafion

P. Nandakumar、C. Vijayan、Y. V. G. S. Murti2002-02-01Journal of Applied Physics

Excitonic effects are observed in the optical absorption and photoluminescence of strongly confined CdS quantum dots embedded in the polymer Nafion. The three bands identified in the optical absorption spectra could be attributed to 1se-1sh, 1pe-1ph, and 2se-2sh transitions of the noninteracting particle model. Photol…

Perovskite Materials and ApplicationsQuantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin Films