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Pressure‐induced metallization and structural evolution of Cu3N

J. G. Zhao、Lixin Yang、Yi Yu 等 6 位作者2006-01-31physica status solidi (b)

Abstract In situ resistance evolution with pressure of anti‐perovskite nitride Cu 3 N was measured using the diamond anvil cell (DAC) technique up to 20.0 GPa at room temperature. A sharp drop of resistance from 10 5 Ω at ambient pressure to several Ω was observed in the range 3.0–10.0 GPa. This is an indication of th…

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

Microscopic model for photoinduced magnetism in the molecular complex[Mo(IV)(CN)2(CN−CuL)6]8+perchlorate

Rajamani Raghunathan、S. Ramasesha、Corine Mathonière 等 4 位作者2006-01-31Physical Review B

A theoretical model for understanding photomagnetism in the heptanuclear complex ${[\mathrm{Mo}(\mathrm{IV}){(\mathrm{CN})}_{2}{(\mathrm{CN}\text{\ensuremath{-}}\mathrm{Cu}L)}_{6}]}^{8+}$ perchlorate is developed. It is a many-body model involving the active orbitals on the transition metal ions. The model is exactly…

Magnetism in coordination complexesLanthanide and Transition Metal ComplexesOrganic and Molecular Conductors Research

Saturation effect in the optical response of Ag-nanoparticle fractal aggregates

Andrei Buin、P.F. de Châtel、H. Nakotte 等 5 位作者2006-01-31Physical Review B

The enhancement and extinction spectra for fractal aggregates consisting of monodisperse nanosized silver particles are studied theoretically. We find the iterative solution to the coupled-dipole equations in the quasistatic approximation, taking into account a contribution of the nonlinear susceptibility ${\ensuremat…

Gold and Silver Nanoparticles Synthesis and ApplicationsPlasmonic and Surface Plasmon ResearchNonlinear Optical Materials Studies

Quantum chemical modeling of electrochromism of tungsten oxide films

Ewa Brocławik、Artur Góra、Piotr Liguzinski 等 5 位作者2006-01-31The Journal of Chemical Physics

A cluster model is proposed to describe the excitations in solid tungsten oxide. The density-functional theory approach is used to calculate the ground-state electronic structure of the model cluster and its optimum geometry; subsequently, time-dependent density-functional theory calculations are performed to obtain t…

Transition Metal Oxide NanomaterialsElectrochemical Analysis and ApplicationsCatalysis and Oxidation Reactions

Correlation between molecular chirality and helical twisting power: a computer simulation study

Hiqmet Kamberaj、Robert J. Low、Maureen P. Neal2006-01-31Molecular Physics

The helical structure of the chiral nematic phases induced by chiral dopants in nematic solvents provides a macroscopic information of the molecular chirality of the dopant. Chiral dopant molecules considered in this paper are challenging systems because their twisting ability has a relatively strong dependence on the…

Liquid Crystal Research AdvancementsSpectroscopy and Quantum Chemical StudiesMolecular spectroscopy and chirality

Phase transformation in magnesium hydride induced by ball milling

Jacques Huot、I. P. Swainson、Robert Schulz2006-01-31European Journal of Control

Changement de phase induit par broyage m�canique dans l'hydrure de magn�sium. La synth�se de l'hydrure de magn�sium par broyage r�actif m�ne � la formation d'une phase orthorhombique m�tastable (?-MgH2) en plus de la phase quadratique ?-MgH2. Les structures des phases ?-MgD2 et ?-MgD2 du MgD2 nanocristallin broy� ont…

Hydrogen Storage and MaterialsNuclear Materials and PropertiesSpacecraft and Cryogenic Technologies

Magnetic properties of bismuth(III) oxy compounds

Eleonora A. Kravchenko、V. G. Orlov、M. P. Shlykov2006-01-31Russian Chemical Reviews

Nuclear quadrupole resonance and SQUID-magnetometric studies on magnetic properties of bismuth(III) oxy compounds comprising neither d- nor f-elements are surveyed and systematised. The magnetic properties, not conventionally expected in the Main Group element substances, were found to exist in most of the compounds d…

High-pressure geophysics and materialsAdvanced Condensed Matter PhysicsSolid-state spectroscopy and crystallography

Excitation Spectra of Dibenzoborole Containing π-Electron Systems: Controlling the Electronic Spectra by Changing the pπ−π* Conjugation

K. Sahan Thanthiriwatte、Steven R. Gwaltney2006-01-31The Journal of Physical Chemistry A

We report time-dependent density functional theory calculations of the vertical excitation energies for the singlet states of three-coordinate 5H-dibenzoborole (DBB) derivatives and four-coordinate 5-fluoro-5H-dibenzoborole ion (FDBB) derivatives. These molecules show remarkable hypsochromic (blue) shifts in their flu…

Molecular Sensors and Ion DetectionRadical Photochemical ReactionsLuminescence and Fluorescent Materials

Crystal structure and properties of phosphatePbCu2(PO4)2with spin-singlet ground state

Alexei А. Belik、Masaki Azuma、Akira Matsuo 等 8 位作者2006-01-31Physical Review B

Phosphate ${\mathrm{PbCu}}_{2}({\mathrm{PO}}_{4}{)}_{2}$ was found in the $\mathrm{Pb}\text{\ensuremath{-}}\mathrm{Cu}\text{\ensuremath{-}}\mathrm{P}\text{\ensuremath{-}}\mathrm{O}$ system. Its structure parameters were refined by the Rietveld method using synchrotron x-ray diffraction data [space group Pccn (No. 56);…

Crystal Structures and PropertiesAdvanced Condensed Matter PhysicsIron-based superconductors research

Domain Instability during Magnetization Precession

А. Кашуба2006-01-31Physical Review Letters

Spin wave equations describing the nonequilibrium precessional state of a ferromagnetic system are given. The equations reveal a new type of spin wave instability (SWI) towards growing domains of uniform magnetization. In the developed stages of SWI a nonstationary picture of domain chaos is revealed by numerical simu…

Magnetic properties of thin filmsTheoretical and Computational PhysicsMagnetic Properties and Applications

NMR Chemical Shift Powder Pattern Recoupling at High Spinning Speed and Theoretical Tensor Evaluation Applied to Silk Fibroin

Raiker Witter、Ulrich Sternberg、Anne S. Ulrich2006-01-31Journal of the American Chemical Society

The NMR pulse sequence RAI (recoupling of anisotropy information) has been improved to obtain powder patterns at high MAS spinning speeds. The 2D iso-aniso experiment displays the static chemical shift spectra on the indirect dimension and the MAS spectra on the direct dimension; hence overlapping chemical shift tenso…

Liquid Crystal Research AdvancementsAdvanced NMR Techniques and ApplicationsSilk-based biomaterials and applications

New Method to Characterize Magnetic Hysteresis in Soft Ferrites Up to High Frequencies

Bernardo Tellini、R. Giannetti、Guillermo Robles 等 4 位作者2006-01-31IEEE Transactions on Instrumentation and Measurement

Characterization of magnetic cores is an indispensable task in order to securely accomplish the requirements of a power electronic design and prevent failures. The hysteresis cycle of the material is one of the more complex features to characterize due to the well-known nonlinear and memory effects; moreover, there is…

Magnetic properties of thin filmsMagnetic Properties and ApplicationsNon-Destructive Testing Techniques

Measurement of the difference in flexoelectric coefficients of nematic liquid crystals using a twisted nematic geometry

R. A. Ewings、C. Kischka、L. A. Parry‐Jones 等 4 位作者2006-01-31Physical Review E

A technique for measuring the difference between the splay and bend flexoelectric coefficients in a nematic liquid crystal is demonstrated. The method uses the flexoelectric-optic effect, but instead of a uniform lying helix structure, a TN cell geometry with an in-plane electric field is used. This has the advantage…

Liquid Crystal Research AdvancementsAdvanced Materials and MechanicsPlant Reproductive Biology

Isothermal desorption measurements of self-diffusion in supercooled o-terphenyl

Marie K. Mapes、Stephen F. Swallen、Kenneth L. Kearns 等 4 位作者2006-01-31The Journal of Chemical Physics

Isothermal desorption of o-terphenyl thin-film bilayers was used to measure self-diffusion coefficients of supercooled o-terphenyl near the glass transition temperature (Tg=243 K). Diffusion coefficients from 10(-15.5) to 10(-12) cm2 s(-1) were obtained between 246 and 265 K. Protio and deuterio o-terphenyl were seque…

Phase Equilibria and ThermodynamicsMaterial Dynamics and PropertiesThermodynamic properties of mixtures

Luminescence Polarization Spectroscopy Study of Functionalized Carbon Nanotubes in a Polymeric Matrix

Bing Zhou、Yi Lin、L. Monica Veca 等 6 位作者2006-01-31The Journal of Physical Chemistry B

Single-walled carbon nanotubes (SWNTs) were well-functionalized for a study of their defect-derived luminescence properties. The soluble nanotube sample was homogeneously dispersed in poly(vinyl alcohol) (PVA) films via solution-phase mixing and then wet-casting. The PVA films embedded with the functionalized SWNTs we…

Carbon Nanotubes in CompositesConducting polymers and applicationsNanotechnology research and applications

Polymer – Supported Cobalt (II) Catalysts for the Oxidation of Alkenes

E. Błaż、Jan Pielichowski2006-01-31Molecules

Polymer-supported heterogeneous catalysts in a form of complexes of 8-hydroxy- quinoline with cobalt acetate were synthesized. Conjugated polymers - polyaniline (PANI), poly-o-toluidine (POT), poly-o-anisidine (POA) - were used as supports. Oxidation reactions of aliphatic and aromatic hydrocarbons were carried out in…

Electrochemical sensors and biosensorsConducting polymers and applicationsPolyoxometalates: Synthesis and Applications

The New Method of Determining Characteristics of Elements for Overvoltage Protection of Low-Voltage System

P. Osmokrović、B. Lončar、S. Stanković2006-01-31IEEE Transactions on Instrumentation and Measurement

This paper presents an innovative method for an efficient characterization of relevant characteristics of nonlinear overvoltage protection elements in low-voltage applications. Standard measuring equipment was modified to enable an efficient and repeatable experimental procedure in order to investigate characteristics…

High voltage insulation and dielectric phenomenaLightning and Electromagnetic PhenomenaElectrical Fault Detection and Protection

Annotating Enzymes of Unknown Function: N-Formimino-l-glutamate Deiminase Is a Member of the Amidohydrolase Superfamily

Ricardo Martí-Arbona、Chengfu Xu、Sondra Steele 等 7 位作者2006-01-31Biochemistry

The functional assignment of enzymes that catalyze unknown chemical transformations is a difficult problem. The protein Pa5106 from Pseudomonas aeruginosa has been identified as a member of the amidohydrolase superfamily by a comprehensive amino acid sequence comparison with structurally authenticated members of this…

Bacterial Genetics and BiotechnologyEnzyme Structure and FunctionAmino Acid Enzymes and Metabolism

Stimulated emission from ZnO nanorods

Robert Hauschild、Holger Lange、H. Priller 等 9 位作者2006-01-31physica status solidi (b)

Abstract By means of time resolved spectroscopy we compare two samples of ZnO nanorods with respect to their suitability as stimulated emitters. In the case of narrow nanorods their wave guiding quality causes a suppression of exciton–exciton scattering whereas no laser emission is detectable. Unlike their narrow coun…

ZnO doping and propertiesQuantum Dots Synthesis And PropertiesCopper-based nanomaterials and applications