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Computer Modeling of Chemical Reactions in Enzymes and Solutions

Arieh Warshel1991-01-01OpenAlex

Basic Principles of Chemical Bonding. Chemical Reactions in the Gas Phase and in Simple Solvent Models. Chemical Reaction in All--Atom Solvent Models. Potential Surfaces and Simulations of Macromolecules. Modeling Reactions in Enzymes: An Introduction. General Acid Catalysis and Electrostatic Stabilization in the Cata…

Protein Structure and DynamicsEnzyme Structure and FunctionEnzyme Catalysis and Immobilization

New Design Concept of Structural Ceramics

Koichi Niihara1991-01-01OpenAlex

Ceramic nanocomposites can be divided into three categories: intergranular nanocomposite, intergranular nanocomposite and nano/nano composite. The intra- and intergranular nanocomposites were found to show the two to five times higher toughness and strength at room temperature than those of monolithic materials. The h…

Advanced ceramic materials synthesisAluminum Alloys Composites PropertiesTribology and Wear Analysis

Ultraviolet–visible absorption spectra of the colloidal metallic elements

J. A. Creighton、D. G. Eadon1991-01-01OpenAlex

The ultraviolet–visible absorption spectra are given for 10 nm diameter colloidal particles of 52 of the metallic elements, calculated from the optical constants of the metals by means of Mie theory. For most of the elements the spectra cover the range 200–900 nm. Well resolved absorption bands are observed for colloi…

Iron oxide chemistry and applicationsGold and Silver Nanoparticles Synthesis and ApplicationsLaser-Ablation Synthesis of Nanoparticles

Nanometer-sized semiconductor clusters: materials synthesis, quantum size effects, and photophysical properties

Ying Wang、N. Herron1991-01-01OpenAlex

ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTNanometer-sized semiconductor clusters: materials synthesis, quantum size effects, and photophysical propertiesYing Wang and N. HerronCite this: J. Phys. Chem. 1991, 95, 2, 525–532Publication Date (Print):January 1, 1991Publication History Published online1 May 2002Published…

Electronic and Structural Properties of OxidesQuantum Dots Synthesis And PropertiesCopper-based nanomaterials and applications

Polyoxometalate Chemistry: An Old Field with New Dimensions in Several Disciplines

Michael T. Pope、Achim Müller1991-01-01OpenAlex

Abstract Inorganic metal–oxygen cluster anions form a class of compounds that is unique in its topological and electronic versatility and is important in several disciplines. Names such as Berzelius , Werner , and Pauling appear in the early literature of the field. These clusters (so‐called isopoly‐ and heteropolyani…

Vanadium and Halogenation ChemistryPolyoxometalates: Synthesis and ApplicationsMetal-Organic Frameworks: Synthesis and Applications

Mathematical Crystallography

M. B. Boisen、G. V. Gibbs1990-12-31OpenAlex

Volume 15 of Reviews in Mineralogy is written with two goals in mind. The first is to derive the 32 crystallographic point groups, the 14 Bravais lattice types and the 230 crystallographic space group types. The second is to develop the mathematical tools necessary for these derivations in such a manner as to lay the…

Crystallization and Solubility Studies

The Al2SiO5 Polymorphs

Derrill M. Kerrick1990-12-31OpenAlex

Volume 22 of Reviews in Mineralogy is a book exclusively devoted to three minerals: the Al2SiO5 polymorphs - andalusite, sillimanite, and kyanite. It covers a wide variety of topics that must be considered in the analysis of metamorphic systems and illustrates the fact that modern metamorphic petrology demands an awar…

Advanced ceramic materials synthesisGlass properties and applicationsX-ray Diffraction in Crystallography

Vibrational dynamics and the structure of glasses

E. Duval、A. Boukenter、T. Achibat1990-12-31OpenAlex

A model assuming a non-continuous structure of glasses is established to interpret the inelastic neutron scattering and Raman scattering. The 'boson' peak in Raman scattering is related to the vibrational density of states 'excess'. These two related features are a result of vibrations localized in the blobs that comp…

Material Dynamics and PropertiesGlass properties and applicationsTheoretical and Computational Physics

Dynamic distortion effects in electron-atom scattering

R P McEachran、A D Stauffer1990-12-28Journal of Physics B Atomic Molecular and Optical Physics

The authors have formulated a polarized-orbital treatment of electron-atom scattering which includes dynamic distortion effects. Detailed formulae are given in terms of their previous formulation of the polarized-orbital method. Results for electron-helium scattering are presented and compared with various experimenta…

Electron and X-Ray Spectroscopy TechniquesAtomic and Molecular PhysicsAdvanced Chemical Physics Studies

High coercivity in Sm2Fe17Nx magnets

K. Schnitzke、L. Schultz、J. Wecker 等 4 位作者1990-12-24Applied Physics Letters

Using mechanical alloying and a subsequent two-step heat treatment we produced magnetically isotropic microcrystalline Sm2Fe17Nx samples with room-temperature coercivities up to 24 kA/cm (30 kOe). The remanence and the energy product are equivalent to similarly prepared Nd-Fe-B samples, but the properties at elevated…

Magnetic properties of thin filmsMagnetic and transport properties of perovskites and related materialsMagnetic Properties of Alloys

Extended Jones matrix representation for the twisted nematic liquid-crystal display at oblique incidence

Alan Lien1990-12-24OpenAlex

A simple and accurate extended Jones matrix representation for the twisted nematic liquid-crystal display at the oblique incidence was obtained for the first time. The results obtained by this extended Jones matrix representation are quite close to those obtained by the faster 4×4 matrix method with spectrum averaging…

Photonic Crystals and ApplicationsLiquid Crystal Research AdvancementsAdvanced Optical Imaging Technologies

Algebraic approximants: a new method of series analysis

R Brak、A J Guttmann1990-12-21Journal of Physics A Mathematical and General

The authors propose a new method of series analysis in which the available series coefficients are fitted to an algebraic equation. Such a proposal restricts solutions to have algebraic singularities with rational critical exponents. The advantage of the method over the method of differential approximants is that in t…

Material Dynamics and PropertiesTheoretical and Computational PhysicsQuantum chaos and dynamical systems

Occurrence and Functions of Native Cellulose

Candace H. Haigler1990-12-20OpenAlex

Cellulose is synthesized by all higher plants as well as by a wide variety of other organisms. The amount of synthesis is enormous, making cellulose the most abundant biopolymer on earth (1 ) . Most native cellulose is found in cell walls in the form of structural micro - fib rils . Although considerable effort has go…

Advanced Cellulose Research Studies

Synchrotron X-ray Rietveld study of perlialite, the natural counterpart of synthetic zeolite-L

Gilberto Artioli、Å. Kvick1990-12-19European Journal of Mineralogy

The crystal structure of perlialite from the Murun Massif, U.S.S.R. was determined and refined using synchrotron X-ray powder data. The framework type of this natural zeolite is the same as synthetic zeolite Linde-L. Extraframework cation and water oxygen position were located, and the locations and occupancies show l…

Clay minerals and soil interactionsIron oxide chemistry and applicationsX-ray Diffraction in Crystallography

Polytype structures of lithium at low temperatures

W. Schwarz、O. Blaschko1990-12-17Physical Review Letters

After cooling below 80 K a considerable amount of diffuse scattering is observed in Li, in addition to 9R and fcc Bragg reflections. The diffuse scattering localized on the [101] line of the 9R reciprocal lattice is modulated along this line indicating a short-range order in the stacking sequence of the close-packed p…

Semiconductor materials and interfacesMuon and positron interactions and applicationsQuasicrystal Structures and Properties

Raman scattering from quantum dots of Ge embedded in SiO2 thin films

Minoru Fujii、Shinji Hayashi、Keiichi Yamamoto1990-12-17Applied Physics Letters

Raman measurements were carried out on Ge quantum dots from 6.1 to 15 nm in size embedded in SiO2 thin films. The samples were prepared by rf co-sputtering and post- annealing. In contrast to the amorphous-like broad spectra previously obtained for gas- evaporated Ge microcrystals of comparable sizes, relatively sharp…

Silicon Nanostructures and PhotoluminescenceThin-Film Transistor TechnologiesPhotonic and Optical Devices

Early formation of chemical vapor deposition diamond films

Sumio Iijima、Yumi Aikawa、Kazuhiro Baba1990-12-17Applied Physics Letters

Nanometer-size diamond particles formed on a silicon substrate by the hot-filament chemical vapor deposition method were examined by a high-resolution electron microscope. The particles developed well-faceted cuboctahedral habits. Examination of their morphologies and microstructures provides a wealth of information o…

Force Microscopy Techniques and ApplicationsElectronic and Structural Properties of OxidesDiamond and Carbon-based Materials Research

Morphotropic Phase Boundary in the Pb(ZrxTi1−x)O3 System

Mikio Fukuhara、A. S. Bhalla、Robert E. Newnham1990-12-16physica status solidi (a)

The ionic polarizabilities in Pb(ZrxTi1−x)O3 compositions are calculated by the Clausius-Mossotti-Lorentz-Lorentz equation. The resultant gap of the polarizability appearing at the morphotropic phase boundary (MPB) composition suggests the phase transition boundary to be due to the electrostatic long-range dipole mome…

Microwave Dielectric Ceramics SynthesisFerroelectric and Piezoelectric MaterialsGlass properties and applications

Fluorescence study of trivalent americium in fluorozirconate glass

R. Valenzuela、R. T. Brundage1990-12-15The Journal of Chemical Physics

The fluorescence spectrum of tripositive americium in a fluorozirconate glass at low temperature has been measured. Six fluorescence lines were observed between 515 to 880 nm and identified as Am3+ transitions. Fluorescence decay measurements at 15 K are reported for transitions that originate from states 5D1′ (∼1.0 m…

Luminescence Properties of Advanced MaterialsGlass properties and applicationsSolid-state spectroscopy and crystallography

Structural studies of amorphous Se under pressure

Keiji Tanaka1990-12-15Physical review. B, Condensed matter

X-ray-diffraction patterns, macroscopic compressibility, and crystallization in amorphous Se subject to pressure have been investigated. The material exhibits pressure-induced structural modifications in the glassy state and a phase transformation to the hexagonal phase at 120\ifmmode\pm\else\textpm\fi{}20 kbar. The o…

Glass properties and applicationsCrystal Structures and PropertiesPhase-change materials and chalcogenides