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Surface induced disorder in body-centered cubic alloys

F. F. Haas、F. Schmid、K. Binder2000-02-10arXiv

We present Monte Carlo simulations of surface induced disordering in a model of a binary alloy on a bcc lattice which undergoes a first order bulk transition from the ordered DO3 phase to the disordered A2 phase. The data are analyzed in terms of an effective interface Hamiltonian for a system with several order param…

Materials Sciencecond-mat.stat-mech

Order and Disorder Phenomena at Surfaces of Binary Alloys

F. F. Haas、F. Schmid、K. Binder2000-02-10arXiv

We present recent Monte Carlo results on surfaces of bcc-structured binary alloys which undergo an order-disorder phase transformation in the bulk. In particular, we discuss surface order and surface induced disorder at the bulk transition between the ordered (DO3) phase and the disordered (A2) phase. An intricate int…

Materials Science

Metamictization of zircon: Raman spectroscopic study

Ming Zhang、Ekhard K. H. Salje、Ian Farnan 等 8 位作者2000-02-10Journal of Physics Condensed Matter

Raman spectroscopy of radiation-damaged natural zircon samples shows increased line broadening and shifts of phonon frequencies with increasing radiation dose. Stretching and bending frequencies of SiO 4 tetrahedra soften dramatically with increasing radiation damage. The frequency shifts can be used to determine the…

Geological and Geochemical AnalysisFacial Trauma and Fracture ManagementNuclear materials and radiation effects

The magnetization distributions in some Heusler alloys proposed as half-metallic ferromagnets

P. J. Brown、K.-U. Neumann、P. J. Webster 等 4 位作者2000-02-10OpenAlex

The magnetization distributions in a series of ternary intermetallic compounds based on the composition Co 2 YZ where Y is Ti, Mn or Fe and Z a subgroup-B element have been determined from polarized neutron diffraction measurements. Comparison of the magnetic structure factors with model calculations shows that the ma…

Magnetic and transport properties of perovskites and related materialsMXene and MAX Phase MaterialsHeusler alloys: electronic and magnetic properties

Helium diffusion from apatite: General behavior as illustrated by Durango fluorapatite

Kenneth A. Farley2000-02-10OpenAlex

High‐precision stepped‐heating experiments were performed to better characterize helium diffusion from apatite using Durango fluorapatite as a model system. At temperatures below 265°C, helium diffusion from this apatite is a simple, thermally activated process that is independent of the cumulative fraction of helium…

Geological and Geochemical AnalysisHigh-pressure geophysics and materialsNuclear materials and radiation effects

Liquid−Liquid Equilibria for Aqueous Solutions of Lithium Sulfate or Lithium Formate and Triethylamine or Diisopropylamine

Ángel Cartón、Silvia Bolado、M. B. Pérez Marcos2000-02-09Journal of Chemical & Engineering Data

Measurements of liquid−liquid equilibria were performed in order to study the suitability of triethylamine and diisopropylamine for the extractive crystallization of lithium sulfate or lithium formate from its aqueous solutions. In the temperature range studied, two liquid phases exist in all ternary-salt-saturated sy…

Crystallization and Solubility Studies

Transient Kinetic Modeling of the Ethylene and Carbon Monoxide Oxidation over a Commercial Automotive Exhaust Gas Catalyst

J.M.A. Harmsen、J.H.B.J. Hoebink、J.C. Schouten2000-02-09Industrial & Engineering Chemistry Research

The transient kinetics of ethylene oxidation by oxygen over a commercial Pt/Rh/CeO 2 /γ-Al 2 O 3 three-way catalyst were modeled. Experiments were carried out in a fixed-bed microreactor with two separate inlets, enabling alternate feeding of ethylene and oxygen with frequencies up to 1 / 4 Hz. The experimental condit…

Catalytic Processes in Materials ScienceCatalysis and Hydrodesulfurization StudiesCatalysis and Oxidation Reactions

One-Dimensional Antiferromagnetic Chain in [Ni(dmit)2]- Salts of [K+ or Rb+(4,13-diaza-18-crown-6)] Supramolecular Cation

Nobuhiro Takamatsu、Tomoyuki Akutagawa、Tatsuo Hasegawa 等 7 位作者2000-02-09Inorganic Chemistry

Mixed-stack structures of monovalent [Ni(dmit)2]- and planar M+(4,13-diaza-18-crown-6) (M+ = K+ or Rb+) supramolecular cation were obtained in the isostructural M+(4,13-diaza-18-crown-6)[Ni(dmit)2] salts. The mixed-stack structure decreases the effective π−π overlap of [Ni(dmit)2]- molecules, which results in the one-…

Metal-Organic Frameworks: Synthesis and ApplicationsMagnetism in coordination complexesOrganic and Molecular Conductors Research

Nanoscale uniformity of pore architecture in diatomaceous silica: a combined small and wide angle x‐ray scattering study

Engel G. Vrieling、Theo P. M. Beelen、Rutger A. van Santen 等 4 位作者2000-02-09Journal of Phycology

Combined small and wide angle X‐ray scattering (SAXS and WAXS) analysis was applied to purified biogenic silica of cultured diatom frustules and of natural populations sampled on marine tidal flats. The overall WAXS patterns did not reveal crystalline phases (WAXS domain between 0.07 to 0.5 nm) in this biogenic silica…

Paleontology and Stratigraphy of FossilsGeochemistry and Elemental AnalysisDiatoms and Algae Research

Role of the Loop Containing Residue 115 in the Induced-Fit Mechanism of the Bacterial Cell Wall Biosynthetic Enzyme MurA

E. Schönbrunn、Susanne Eschenburg、Florian Krekel 等 5 位作者2000-02-09Biochemistry

The induced-fit mechanism in Enterobacter cloacae MurA has been investigated by kinetic studies and X-ray crystallography. The antibiotic fosfomycin, an irreversible inhibitor of MurA, induced a structural change in UDP-N-acetylglucosamine (UDPGlcNAc)-liganded enzyme with a time dependence similar to that observed for…

Bacterial Genetics and BiotechnologyCarbohydrate Chemistry and SynthesisEnzyme Structure and Function

Remarks on the Substrate−Temperature Dependence of Surface-Enhanced Raman Scattering

Hai‐Pang Chiang、P. T. Leung、W. S. Tse2000-02-09The Journal of Physical Chemistry B

It is pointed out that the variation of the plasmon frequency of metal with temperatures, though generally extending to a very limited amount, could however have significant effects on the recently observed dependence of surface-enhanced Raman scattering (SERS) on substrate temperatures.

Gold and Silver Nanoparticles Synthesis and ApplicationsPlasmonic and Surface Plasmon ResearchSpectroscopy Techniques in Biomedical and Chemical Research

A step-wise method for measuring thermophysical parameters of materials

Ľ. Kubičár、Vlastimil Boháč2000-02-09Measurement Science and Technology

A version of a transient method for measuring specific heat, thermal diffusivity and thermal conductivity is presented. The dynamic temperature field is generated by the passage of the electrical current through a planar electrical resistance made of thin metallic foil. The heat is produced in the form of a step-wise…

Heat Transfer and OptimizationThermal properties of materialsThermography and Photoacoustic Techniques

ChemInform Abstract: Magnetic Properties of Transition Metal Containing Liquid Crystals

Klaus Griesar、W. Haase2000-02-08ChemInform

Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 100 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a “Full Text” option. The original article is trackable via the “References” opt…

Liquid Crystal Research AdvancementsMagnetism in coordination complexesCharacterization and Applications of Magnetic Nanoparticles

Heavily Cu+-doped amorphous PbCl2films and aggregation of Cu+ions due to crystallization observed by UV spectroscopy

Shinichi Kondo、N Tanaka、T. Saito2000-02-08Journal of Physics D Applied Physics

Heavily Cu + -doped amorphous PbCl 2 has been obtained by quench deposition of the mixture of PbCl 2 and CuCl. Upon crystallization, the large majority of Cu + ions aggregate to form CuCl precipitates embedded in the crystalline PbCl 2 matrix. The present experiment opens up the possibility of producing densely disper…

Material Dynamics and PropertiesPhase-change materials and chalcogenidesNonlinear Optical Materials Studies

Fluorescence Properties of Benz[f]indole, a Wavelength and Quenching Selective Tryptophan Analog

Бо Лю、Mary D. Barkley、Guillermo A. Morales 等 5 位作者2000-02-08The Journal of Physical Chemistry B

Tryptophan analogues with unique spectral and photophysical properties offer intrinsic fluorescent probes for studying peptide−protein and protein−protein interactions. Two benzannulated indole derivatives, benz[ f ]indole and 3-methylbenz[ f ]indole, were synthesized and their fluorescence was characterized. The abso…

Photochemistry and Electron Transfer StudiesLuminescence and Fluorescent MaterialsSynthesis of Indole Derivatives

Effects of additional elements on the structure and magnetic properties of Nd2Fe14B/alpha-Fe-type nanocomposite magnets

Bai Cui、Xia Sun、W Liu 等 6 位作者2000-02-08Journal of Physics D Applied Physics

The effects of a partial substitution of Mo, Ga, Si or Al, respectively, for Fe on the structure and magnetic properties of Nd 8.4 Fe 87.1 B 4.5 alloy prepared by mechanical alloying have been studied in detail. The addition of 1.1 at% Mo, Si or Ga results in the improvement of the intrinsic coercivity of the nanocomp…

Magnetic properties of thin filmsMagnetic Properties and ApplicationsMagnetic Properties of Alloys

Human N-benzoyl-l-tyrosyl-p-aminobenzoic acid hydrolase (human meprin): genomic structure of the α and β subunits

Dagmar Hahn、Rainer ILLISSON、Andres Metspalu 等 4 位作者2000-02-08Biochemical Journal

N-Benzoyl-L-tyrosyl-p-aminobenzoic acid hydrolase (PPH, human meprin), a zinc-metalloendopeptidase of the astacin family, consists of two similar subunits. As well as in small-intestinal epithelial cells, the enzyme is found in lamina propria leucocytes, human cancer cells and colorectal cancer tissue, making it a pot…

Enzyme Structure and FunctionPeptidase Inhibition and AnalysisBiochemical and Molecular Research

Infrared Spectra and Density Functional Calculations of MO2, MO3, (O2)MO2, MO4, MO2- (M = Re, Ru, Os) and ReO3-, ReO4- in Solid Neon and Argon

Mingfei Zhou、Angelo Citra、Binyong Liang 等 4 位作者2000-02-08The Journal of Physical Chemistry A

Laser-ablated rhenium, ruthenium, and osmium atoms react with O 2 in excess neon and argon during condensation to form the MO 2 dioxide molecules as major products. The MO 3 trioxides with D 3 h symmetry, the (O 2 )MO 2 dioxide complexes with C 2 v symmetry, and the tetrahedral MO 4 (M = Ru, Os) molecules are formed o…

Advanced Chemical Physics StudiesCatalytic Processes in Materials ScienceGas Sensing Nanomaterials and Sensors

Lennard-Jones binary mixture: A thermodynamical approach to glass transition

Barbara Coluzzi、Giorgio Parisi、P. Verrocchio2000-02-08The Journal of Chemical Physics

We study the liquid-glass transition of the Lennard-Jones binary mixture introduced by Kob and Andersen from a thermodynamic point of view. By means of the replica approach, translating the problem in the study of a molecular liquid, we study the phase transition due to the entropy crisis and we find that the Kauzmann…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesThermodynamic properties of mixtures