Search results for "harmonic"

showing 10 items of 984 documents

Protein dynamics: conformational disorder, vibrational coupling and anharmonicity in deoxy-hemoglobin and myoglobin.

1993

In this work we study the temperature dependence of the Soret band lineshape of deoxymyoglobin and deoxyhemoglobin, in the range 300-20 K. To fit the measured spectra we use an approach originally proposed by Champion and coworkers (Srajer et al. 1986; Srajer and Champion 1991). The band profile is modelled as a Voigt function that accounts for the coupling with low frequency vibrational modes, whereas the coupling with high frequency modes is responsible for the vibronic structure of the spectra. Moreover, owing to the position of the iron atom out of the mean heme plane, inhomogeneous broadening brings about a non-Gaussian distribution of 0-0 electronic transition frequencies. The reporte…

Voigt profileChemical PhenomenaChemistry PhysicalMyoglobinProtein ConformationProtein dynamicsAnharmonicityBiophysicsTemperatureDynamic properties Heme proteins Optical spectroscopyGeneral MedicineMolecular physicsMolecular electronic transitionSpectral linechemistry.chemical_compoundHemoglobinsNuclear magnetic resonanceMyoglobinchemistrySpectrophotometryMolecular vibrationAnimalsThermodynamicsRotational–vibrational couplingEuropean biophysics journal : EBJ
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Dynamic properties of some β-chain mutant hemoglobins

1995

The thermal behavior of the Soret band relative to the carbonmonoxy derivatives of some beta-chain mutant hemoglobins is studied in the temperature range 300-10 K and compared to that of wild-type carbonmonoxy hemoglobin. The band profile at various temperatures is modeled as a Voigt function that accounts for homogeneous broadening and for the coupling with high- and low-frequency vibrational modes, while inhomogeneous broadening is taken into account with a gaussian distribution of purely electronic transition frequencies. The various contributions to the over-all bandwidth are singled out with this analysis and their temperature dependence, in turn, gives information on structural and dy…

Voigt profileCoupling constantBase SequenceChemistryProtein dynamicsMolecular Sequence DataAnharmonicityHemoglobin AHemeBiochemistryRecombinant ProteinsMolecular electronic transitionCold TemperatureCrystallographyCarboxyhemoglobinModels ChemicalSpectrophotometryStructural BiologyMolecular vibrationMutationMutagenesis Site-DirectedHomogeneous broadeningRotational–vibrational couplingMolecular BiologyProteins: Structure, Function, and Genetics
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<title>Second harmonic generation in selenium thin films</title>

2008

Results of second harmonic (SH) generation in amorphous and crystalline selenium films induced by titanium-sapphire femtosecond laser (wavelength λ - 800-1000 nm) are presented. It is found that the highest intensity of SH is provided by fundamental wave at wavelength 1000 nm and it reaches maximum in approximately 100 sec. The intensity of transmitted SH depends on film thickness while that of reflected does not.

WavelengthMaterials sciencelawFemtosecondAnalytical chemistryHarmonicSecond-harmonic generationNonlinear opticsThin filmLaserAmorphous solidlaw.inventionSPIE Proceedings
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<title>Second harmonic generation in selenium-metal structures</title>

2008

The article examines the processes of second harmonic generation (SHG) when selenium-metal (Cu) film structures are illuminated by femtosecond radiation (180 fs, 80 MHz) at wavelength 800 - 1000 nm. Selenium-copper structures were obtained by successive thermal evaporation of selenium and copper onto the glass substrate in vacuum. Microanalysis of the film composition was performed to determine amount of copper in thin films. The as-evaporated selenium-copper structures were crystallised by annealing in inert atmosphere at temperature 85°C. Just evaporated as well as annealed thin films were explored. The experiment was performed by confocal microscope [1] where the femtosecond radiation fr…

WavelengthMicroscopechemistryAnnealing (metallurgy)lawFemtosecondAnalytical chemistrychemistry.chemical_elementSecond-harmonic generationNonlinear opticsThin filmCopperlaw.inventionSPIE Proceedings
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Rotationally symmetric 1-harmonic flows from D2 TO S 2: Local well-posedness and finite time blowup

2010

The 1-harmonic flow from the disk to the sphere with constant Dirichlet boundary conditions is analyzed in the case of rotational symmetry. Sufficient conditions on the initial datum are given, such that a unique classical solution exists for short times. Also, a sharp criterion on the boundary condition is identified, such that any classical solution will blow up in finite time. Finally, nongeneric examples of finite time blowup are exhibited for any boundary condition.

Well-posed problemDirichlet problemApplied MathematicsMathematical analysisMathematics::Analysis of PDEsRotational symmetryMixed boundary conditionrotational symmetryferromagnetism; blowup; 1-harmonic flow; image processing; local existence; dirichlet problem; partial differential equations; rotational symmetryferromagnetism1-harmonic flowblowupimage processingComputational Mathematicssymbols.namesakeFlow (mathematics)Dirichlet boundary conditionsymbolspartial differential equationsInitial value problemBoundary value problemdirichlet problemAnalysislocal existenceMathematics
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Exact 3D solution for static and damped harmonic response of simply supported general laminates

2014

International audience; The state-space method is adapted to obtain three dimensional exact solutions for the static and damped dynamic behaviors of simply supported general laminates. The state-space method is written in a general form that permits to handle both cross-ply and antisymmetric angle-ply laminates. This general form also permits to obtain exact solutions for general laminates, albeit with some constraints. For the general case and for the static behavior, either an additive term is added to the load to simulate simply supported boundary conditions, or the plate bends in a particular way. For the dynamic behavior, the general case leads to pairs of natural frequencies for each …

Work (thermodynamics)DampedFOS: Physical sciences[ SPI.MECA.STRU ] Engineering Sciences [physics]/Mechanics [physics.med-ph]/Mechanics of the structures [physics.class-ph]Physics - Classical Physics[ PHYS.MECA.STRU ] Physics [physics]/Mechanics [physics]/Mechanics of the structures [physics.class-ph]Normal modeBoundary value problemLaminateStaticCivil and Structural EngineeringMathematicsState-space methodAntisymmetric relationbusiness.industryIsotropyMathematical analysisClassical Physics (physics.class-ph)HarmonicFundamental frequencyStructural engineeringFinite element methodCeramics and CompositesHarmonicbusinessExact 3D solution
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DISORDERING MECHANISMS OF THE Cu(110) SURFACE

1994

We review recent theoretical work on the various disordering mechanisms of the Cu(110) surface. In these studies the properties of the surface, from the onset of enhanced anharmonicity in surface vibrations up to bulk melting point T M , have been studied using molecular dynamics and lattice-gas Monte Carlo methods with many-body interactions derived from the effective medium theory. Well after the onset of enhanced out-of-plane surface vibrations, clustering of surface defects is found to induce a roughening transition at T≈0.81T M , and surface premelting is found to occur at T≈0.97T M . These results suggest, that these transitions can both appear at Cu(110). The general picture of diso…

Work (thermodynamics)Materials scienceCondensed matter physicsAnharmonicitychemistry.chemical_elementStatistical and Nonlinear Physics02 engineering and technologyCrystal structure021001 nanoscience & nanotechnologyCondensed Matter Physics01 natural sciencesCopperCrystallographic defectPremeltingMolecular dynamicschemistry0103 physical sciencesMelting point010306 general physics0210 nano-technologyInternational Journal of Modern Physics B
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Potentialities of microfibers for non linear optics

2010

Micro- and nanofibers present attractive optical properties and may be used in a variety of structures and devices. We report in this work the first global study on the non linear properties of these microfibers: an adequate source is built and its characteristics are described, our first results with a silica loop resonator are presented. Third harmonic generation is obtained in these conditions, however, the low intrinsic non linear index prevents the generation of large non linear effects. The use of highly non linear materials, such as soft glasses, is therefore discussed, with their potentialities and the challenges their integration with standard microfibers represent.

Work (thermodynamics)business.product_categoryMaterials sciencebusiness.industryNonlinear opticsNon-linear effectsResonatorNonlinear systemOpticsNanofiberMicrofiberOptoelectronicsThird harmonicbusiness2010 Photonics Global Conference
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Local structure studies of SrTi16O3and SrTi18O3

2014

In this work we report on the local structure of Ti in SrTi 16 O3 (STO16) and SrTi 18 O3 (STO18) investigated in the low temperature range (6‐300K) by extended x-ray absorption fine structure and x-ray absorption near edge structure (XANES) spectroscopy at Ti K-edge and by optical second harmonic generation (SHG). By comparing XANES of STO16 and STO18 we have identified the isotopic effect which produces at T < 100K a noticeable difference in the measured mean square relative displacements (MSRD) of Ti‐O1 bonds: while STO16 follow the expected Einstein-like behavior, for STO18 we have measured an increase of MSRD values with decreasing temperature. This is an indication of an increasing off…

X-ray spectroscopyMaterials scienceAbsorption spectroscopyOctahedronAnalytical chemistrySecond-harmonic generationAtmospheric temperature rangeCondensed Matter PhysicsSpectroscopyAbsorption (electromagnetic radiation)Mathematical PhysicsAtomic and Molecular Physics and OpticsXANESPhysica Scripta
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Three-dimensional splitting dynamics of giant vortices in Bose-Einstein condensates

2018

We study the splitting dynamics of giant vortices in dilute Bose-Einstein condensates by numerically integrating the three-dimensional Gross-Pitaevskii equation in time. By taking advantage of tetrahedral tiling in the spatial discretization, we decrease the error and increase the reliability of the numerical method. An extensive survey of vortex splitting symmetries is presented for different aspect ratios of the harmonic trapping potential. The symmetries of the splitting patterns observed in the simulated dynamics are found to be in good agreement with predictions obtained by solving the dominant dynamical instabilities from the corresponding Bogoliubov equations. Furthermore, we observe…

YEE-LIKE SCHEMESDiscretizationGROSS-PITAEVSKII EQUATIONEFFICIENTFOS: Physical sciencesHarmonic (mathematics)GASES114 Physical sciences01 natural sciences010305 fluids & plasmaslaw.inventionsymbols.namesakelaw0103 physical sciencesSUPERFLOW010306 general physicsNUMERICAL-SOLUTIONVORTEXta113PhysicsCondensed Matter::Quantum GasesSTABILITYta114Condensed Matter::OtherNumerical analysisTime evolutionMONOPOLESBose-Einstein condensatesVortexMAXWELLS EQUATIONSGross–Pitaevskii equationClassical mechanicsMaxwell's equationsQuantum Gases (cond-mat.quant-gas)symbolsCondensed Matter - Quantum Gasesvortices in superfluidsBose–Einstein condensate
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