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Experimental determination ofBEDT−TTF+electron-molecular vibration constants through optical microreflectance

G. Visentini、Matteo Masino、Carlo Bellitto 等 4 位作者1998-10-01Physical review. B, Condensed matter

In the salt formed by bis(ethylenedithio)tetrathiafulvalene (BEDT-TTF) with the $[{\mathrm{Mo}}_{6}{\mathrm{O}}_{19}{]}^{2\mathrm{\ensuremath{-}}}$ anion, the ${\mathrm{B}\mathrm{E}\mathrm{D}\mathrm{T}\ensuremath{-}\mathrm{T}\mathrm{T}\mathrm{F}}^{+}$ cations form quasi-isolated dimers. For this reason $({\mathrm{B}\m…

2D Materials and ApplicationsMagnetism in coordination complexesOrganic and Molecular Conductors Research

New developments in the calculation of metalloporphyrin Raman spectra via density functional theory

Thomas G. Spiro、Pawel M. Kozlowski、Marek Z. Zgierski1998-10-01Journal of Raman Spectroscopy

The recent development of density functional theory (DFT) makes it possible to calculate accurately metalloporphyrin structures and potential surfaces. This is illustrated for nickel porphine, the vibrations of which are reliably assigned from extensive spectroscopic studies. With a minimal set of scaling factors, the…

Porphyrin and Phthalocyanine ChemistryHemoglobin structure and functionPorphyrin Metabolism and Disorders

Calculation of depth dose and dose per monitor unit for irregularly shaped electron fields

Faiz M. Khan、Patrick D. Higgins、Bruce J. Gerbi 等 6 位作者1998-10-01Physics in Medicine and Biology

A new dosimetric quantity, the lateral build-up ratio (LBR), has been introduced to calculate depth dose distribution for any shaped field. Factors to account for change in incident fluence with collimation are applied separately. The LBR data for a small circular field are used to extract radial spread of the pencil…

Electron and X-Ray Spectroscopy TechniquesPhotocathodes and Microchannel PlatesIntegrated Circuits and Semiconductor Failure Analysis

Transformation Mechanisms and Interstratification in Conversion of Smectite to Kaolinite: An HRTEM Study

M. Amouric、Juan Olives1998-10-01Clays and Clay Minerals

Abstract The transformation of smectite into kaolinite and kaolinite-smectite interstratification were studied in samples belonging to the Argiles Plastiques formation of the Paris basin, by high-resolution transmission electron microscopy (HRTEM). Two original smectite phases, 1) beidellite with 1-nm-thick layers, an…

Soil and Unsaturated FlowClay minerals and soil interactionsIron oxide chemistry and applications

Influence of shock wave pressure amplitude and pulse repetition frequency on the lifespan, size and number of transient cavities in the field of an electromagnetic lithotripter

Peter E. Huber、K Jöchle、Jürgen Debus1998-10-01Physics in Medicine and Biology

Monitoring the generation of cavitation is of great interest for diagnostic and therapeutic use of ultrasound in medicine, since cavitation is considered to play a major role in nonthermal ultrasound interactions with tissue. Important parameters are the number of cavitation events and the energy released during the b…

Fluid Dynamics and MixingUltrasound and Hyperthermia ApplicationsUltrasound and Cavitation Phenomena

A Wide-Bandpass Multilayer Monochromator for Biological Small-Angle Scattering and Fiber Diffraction Studies

Hiro Tsuruta、S. Brennan、Z. U. Rek 等 6 位作者1998-10-01Journal of Applied Crystallography

Many biological applications of small-angle X-ray scattering, in particular time-resolved studies, are often limited by the flux incident on the sample due to the smaller scattering cross section of biological specimens. The wider-energy bandpass of a monochromator that consists of a pair of synthetic multilayer micro…

Protein Structure and DynamicsEnzyme Structure and FunctionX-ray Spectroscopy and Fluorescence Analysis

The synthesis of functional polyphosphazenes and their surfaces

Harry R. Allcock1998-10-01Applied Organometallic Chemistry

The macromolecular substitution approach for the synthesis of polyphosphazenes provides access to many different polymers. However, it precludes the use of reagents that contain two or more functional groups because such compounds would cause extensive crosslinking of the chains. This presents a problem because many o…

Synthesis and characterization of novel inorganic/organometallic compoundsFlame retardant materials and propertiesSynthesis and properties of polymers

Aryl phosphinate anhydride curing for flame retardant epoxy networks

Ching-Sheng Cho、Shih-Chi Fu、Leo‐Wang Chen 等 4 位作者1998-10-01Polymer International

An aryl phosphinate anhydride (9,10-dihydro-9-oxa-10-phosphaphenanthrene-10-oxide)-methyl succinic anhydride (DMSA), with a pendent phosphorus group was synthesized and used as a reactive type flame retardant. The structure of DMSA was confirmed by FTIR, mass, elemental analysis, 1H and 31P NMR spectroscopies. The ary…

Flame retardant materials and propertiesOrganophosphorus compounds synthesisSynthesis and properties of polymers

Structure of the capsid of pf3 filamentous phage determined from X-ray fibre diffraction data at 3.1 Å resolution

Liam Welsh、Martyn F. Symmons、Julian M. Sturtevant 等 5 位作者1998-10-01Journal of Molecular Biology

We have recorded X-ray diffraction patterns at 3.1 A resolution from magnetically aligned fibres of the Pf3 strain of filamentous bacteriophage (Inovirus). The patterns are similar to patterns from the higher-temperature form of the Pf1 strain, indicating that the Pf3 and Pf1 virions have the same helix symmetry and s…

Protein Structure and DynamicsBacteriophages and microbial interactionsEnzyme Structure and Function

Kinetic Analysis and X-ray Structure of Haloalkane Dehalogenase with a Modified Halide-Binding Site

Geja H. Krooshof、I.S. Ridder、Armand W.J.W. Tepper 等 8 位作者1998-10-01Biochemistry

Haloalkane dehalogenase (DhlA) catalyzes the hydrolysis of haloalkanes via an alkyl-enzyme intermediate. Trp175 forms a halogen/halide-binding site in the active-site cavity together with Trp125. To get more insight in the role of Trp175 in DhlA, we mutated residue 175 and explored the kinetics and X-ray structure of…

Protein Structure and DynamicsMicrobial bioremediation and biosurfactantsEnzyme Structure and Function

Electron Transfer through the Hydrogen-Bonded Interface of a β-Turn-Forming Depsipeptide

David A. Williamson、Bruce E. Bowler1998-10-01Journal of the American Chemical Society

Hydrogen-bonding networks are believed to play an important role in electron-transfer pathways in a protein medium. A porphyrin−quinone donor−acceptor compound with a depsipeptide bridge which forms a β-turn has been synthesized to study hydrogen bond-mediated electron transfer. The placement of the donor and acceptor…

Photosynthetic Processes and MechanismsPorphyrin and Phthalocyanine ChemistryPhotochemistry and Electron Transfer Studies

Lattice-Dynamical Estimation of Atomic Displacement Parameters in Carbonates: Calcite and Aragonite CaCO3, Dolomite CaMg(CO3)2 and Magnesite MgCO3

Tullio Pilati、Francesco Demartin、C. M. Gramaccioli1998-10-01Acta Crystallographica Section B Structural Science

Using crystallographic information and empirical potentials derived from fitting the vibrational frequencies of all the substances under study, together with those of a group of silicates and oxides, a Born–von Karman rigid-ion lattice-dynamical model has been applied to the whole Brillouin zone in calcite, aragonite…

High-pressure geophysics and materialsCrystallography and molecular interactionsSolid-state spectroscopy and crystallography

Susceptibility scaling behavior of quantum paraelectricSrTiO3:Ca

W. Kleemann、J. Dec、B. Westwański1998-10-01Physical review. B, Condensed matter

Static scaling analysis of the paraelectric susceptibility ${\ensuremath{\chi}}^{\ensuremath{'}}$ of ${\mathrm{SrTiO}}_{3}:\mathrm{C}\mathrm{a}$ as a function of temperature T and an external electric field E yields a very good scaling behavior with consistent values of the effective exponents \ensuremath{\gamma}, \en…

Ferroelectric and Piezoelectric MaterialsSemiconductor materials and devicesElectronic and Structural Properties of Oxides

Environmental Effects on Anion Polarizability: Variation with Lattice Parameter and Coordination Number

Patrick J̈emmer、Patrick W. Fowler、Mark Wilson 等 4 位作者1998-10-01The Journal of Physical Chemistry A

The results of ab initio calculations of in-crystal ionic polarizabilities, α, over a wide range of lattice parameters, R, are presented for LiF, NaF, KF, LiCl, NaCl, KCl, LiBr, NaBr, KCl, and MgO. The derivatives of the mean polarizability with respect to lattice parameters are compared with experimental values obtai…

Advanced Chemical Physics StudiesSolid-state spectroscopy and crystallographyX-ray Diffraction in Crystallography

Surfactant−Semiconductor Interfaces: Perturbation of the Photoluminescence of Bulk Cadmium Selenide by Adsorption of Tri-n-octylphosphine Oxide as a Probe of Solution Aggregation with Relevance to Nanocrystal Stabilization

Julie K. Lorenz、Arthur B. Ellis1998-10-01Journal of the American Chemical Society

The band edge photoluminescence (PL) of bulk single-crystal n -CdSe is perturbed by adsorption of tri- n -octylphosphine oxide (TOPO) from toluene solution onto the crystal's 0001, 0001̄, and 112̄0 faces. These are three of the crystal faces observed in studies of CdSe nanocrystals, which are commonly capped with TOPO…

Perovskite Materials and ApplicationsQuantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin Films

In Vitro Displacement by Rat Serum of Adsorbed Radiolabeled Poloxamer and Poloxamine Copolymers from Model and Biodegradable Nanospheres

Jonathan C. Neal、Snow Stolnik、Etienne Schacht 等 7 位作者1998-10-01Journal of Pharmaceutical Sciences

Poloxamer 407 and poloxamine 908 have been used by many research groups to modify the surface of both model latex and biodegradable nanospheres, thereby producing nanospheres that have shown reduced protein adsorption in vitro and extended circulation times in vivo. A potential limitation of such systems is the desorp…

Nanoparticle-Based Drug DeliveryRNA Interference and Gene DeliveryPolymer Surface Interaction Studies

RELEASE OF POTASSIUM FROM THE SILT AND SAND FRACTION OF LOESS-DERIVED SOILS

K. Mengel、Rahmatullah Rahmatullah、Hua-Shu Dou1998-10-01Soil Science

The objective of this investigation was to examine whether the silt in loess-derived soils represents a major K+ source for plants. The experiment was carried out with 14 arable loess-derived soils (Alfisols) from which, in one series, the clay was removed and in which, in another series, complete soils were used. In…

Soil and Unsaturated FlowPlant nutrient uptake and metabolismClay minerals and soil interactions

Colloidal glasses under shear strain

Mark Haw、Wilson C. K. Poon、P. N. Pusey 等 5 位作者1998-10-01Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics

We have studied the effects of oscillatory shear strain on the structure of a colloidal hard-sphere glass. By light scattering, we measure the kinetic development of ordered structures induced by shearing between parallel plates. Diffusing wave spectroscopy ``echo'' experiments show that for peak to peak oscillatory s…

Material Dynamics and PropertiesGlass properties and applicationsTheoretical and Computational Physics

Kinetic Study of the Intercalation of Cobaltocene by Layered Metal Dichalcogenides with Time-Resolved in Situ X-ray Powder Diffraction

John S. O. Evans、Stephen J. Price、Heng‐Vee Wong 等 4 位作者1998-10-01Journal of the American Chemical Society

Energy-dispersive X-ray diffraction (EDXRD) has been used to perform in situ kinetic studies on the intercalation of cobaltocene, Co(η-C 5 H 5 ) 2, into the layered dichalcogenides ZrS 2, 2H-SnS 2, 2H-SnSe 2, 2H-TaS 2, 2H-NbS 2, 1T-TaS 2, and TiS 2 . Integrated intensities of the Bragg reflections have been used to de…

Advanced Chemical Physics StudiesMachine Learning in Materials ScienceInorganic Fluorides and Related Compounds

Homogeneous and heterogeneous metallocene/MAO-catalyzed polymerization of trialkylsilyl-protected alcohols

Ralf Goretzki、Gerhard Fink1998-10-01Macromolecular Rapid Communications

We investigated the ethylene copolymerization by utilizing Me2Si(Ind)2ZrCl2/MAO and Me2Si(Ind)2ZrCl2/MAO/SiO2 with 10-undecene-1-oxytrimethylsilane and 10-undecene-1-oxytriisopropylsilane and the ethylene copolymerization by using iPr(CpInd)ZrCl2/MAO and iPr(CpInd)ZrCl2/MAO/SiO2 with 5-norbornene-2-methyleneoxytrimeth…

Organometallic Complex Synthesis and CatalysisSynthetic Organic Chemistry MethodsSilicone and Siloxane Chemistry