Sample records for vibrational spectral diffusion

  1. Hydrogen bond dynamics and vibrational spectral diffusion in ...

    Indian Academy of Sciences (India)

    We present an ab initio molecular dynamics study of vibrational spectral diffusion and hydrogen bond dynamics in aqueous solution of acetone at room temperature. It is found that the frequencies of OD bonds in the acetone hydration shell have a higher stretch frequency than those in the bulk water. Also, on average, the ...

  2. A first principles theoretical study of vibrational spectral diffusion and hydrogen bond dynamics in aqueous ionic solutions: D2O in hydration shells of Cl(-) ions. (United States)

    Mallik, Bhabani S; Semparithi, A; Chandra, Amalendu


    A theoretical study of vibrational spectral diffusion and hydrogen bond dynamics in aqueous ionic solutions is presented from first principles without employing any empirical potential models. The present calculations are based on ab initio molecular dynamics for trajectory generation and wavelet analysis of the simulated trajectories for time dependent frequency calculations. Results are obtained for two different deuterated aqueous solutions: the first one is a relatively dilute solution of a single Cl(-) ion and the second one is a concentrated solution of NaCl ( approximately 3M) dissolved in liquid D(2)O. It is found that the frequencies of OD bonds in the anion hydration shell, i.e., those which are hydrogen bonded to the chloride ion, have a higher stretch frequency than those in the bulk water. Also, on average, the frequencies of hydration shell OD modes are found to increase with increase in the anion-water hydrogen bond distance. On the dynamical side, when the vibrational spectral diffusion is calculated exclusively for the hydration shell water molecules in the first solution, the dynamics reveals three time scales: a short-time relaxation ( approximately 200 fs) corresponding to the dynamics of intact ion-water hydrogen bonds, a slower relaxation ( approximately 3 ps) corresponding to the lifetimes of chloride ion-water hydrogen bonds, and another longer-time constant ( approximately 20 ps) corresponding to the escape dynamics of water from the anion hydration shell. Existence of such three time scales for hydration shell water molecules was also reported earlier for water containing a single iodide ion using classical molecular dynamics [B. Nigro et al., J. Phys. Chem. A 110, 11237 (2006)]. Hence, the present study confirms the basic results of this earlier work using a different methodology. However, when the vibrational spectral diffusion is calculated over all the OD modes, only two time scales of approximately 150 fs and approximately 2.7 ps are

  3. Spectral clustering with epidemic diffusion (United States)

    Smith, Laura M.; Lerman, Kristina; Garcia-Cardona, Cristina; Percus, Allon G.; Ghosh, Rumi


    Spectral clustering is widely used to partition graphs into distinct modules or communities. Existing methods for spectral clustering use the eigenvalues and eigenvectors of the graph Laplacian, an operator that is closely associated with random walks on graphs. We propose a spectral partitioning method that exploits the properties of epidemic diffusion. An epidemic is a dynamic process that, unlike the random walk, simultaneously transitions to all the neighbors of a given node. We show that the replicator, an operator describing epidemic diffusion, is equivalent to the symmetric normalized Laplacian of a reweighted graph with edges reweighted by the eigenvector centralities of their incident nodes. Thus, more weight is given to edges connecting more central nodes. We describe a method that partitions the nodes based on the componentwise ratio of the replicator's second eigenvector to the first and compare its performance to traditional spectral clustering techniques on synthetic graphs with known community structure. We demonstrate that the replicator gives preference to dense, clique-like structures, enabling it to more effectively discover communities that may be obscured by dense intercommunity linking.

  4. Diffusion of solid fuelon a vibrating grate

    DEFF Research Database (Denmark)

    Sabelström, Hanna Katarina

    of vibrations can be incorporated into a numerical model. The chosen model approach has been to separate the gas and solid phases into two independent models related to each other through the bed porosity. By treating the bed as a porous media and using Ergun's equation for the gas flow, the numerical work...... is simplified and the computational time shortened. The vibrations are affecting the transport and mixing of the fuel and incorporated into the model through the diffusion coefficient in the conservation equation of the solid phase. Experimental work has been carried out with the aim to study the behaviour...... of wood pellets on a vibrating grate and deriving the diffusion coefficient to be used in the numerical model. Three different grate designs are used and the particle trajectories have been captured by a camera placed above the grate. The diffusion coefficient is defined as the deviation from the mean...

  5. Structural Vibration Monitoring Using Cumulative Spectral Analysis

    Directory of Open Access Journals (Sweden)

    Satoru Goto


    Full Text Available This paper describes a resonance decay estimation for structural health monitoring in the presence of nonstationary vibrations. In structural health monitoring, the structure's frequency response and resonant decay characteristics are very important for understanding how the structure changes. Cumulative spectral analysis (CSA estimates the frequency decay by using the impulse response. However, measuring the impulse response of buildings is impractical due to the need to shake the building itself. In a previous study, we reported on system damping monitoring using cumulative harmonic analysis (CHA, which is based on CSA. The current study describes scale model experiments on estimating the hidden resonance decay under non-stationary noise conditions by using CSA for structural condition monitoring.

  6. Evaluation of satellite derived spectral diffuse attenuation coefficients

    Digital Repository Service at National Institute of Oceanography (India)

    Suresh, T.; Talaulikar, M.; Desa, E.; Mascarenhas, A.A.M.Q.; Matondkar, S.G.P.

    Spectral diffuse attenuation K sub(d)(lambda) is an important apparent optical property that provide information about the attenuation of the spectral downwelling solar irradiance with depth in water. The spectral K sub(d)(lambda) at lambda = 412...

  7. Vibrational echo spectral observables and frequency fluctuations of ...

    Indian Academy of Sciences (India)

    Home; Journals; Journal of Chemical Sciences; Volume 129; Issue 7. Vibrational echo spectral observables and frequency fluctuations of hydration shell water around a fluoride ion from first principles simulations. DEEPAK OJHA AMALENDU CHANDRA. REGULAR ARTICLE Volume 129 Issue 7 July 2017 pp 1069-1080 ...


    Directory of Open Access Journals (Sweden)

    Belhadef RACHID


    Full Text Available Spectral analysis is the key tool for the study of vibration signals in rotating machinery. In this work, the vibration analy-sis applied for conditional preventive maintenance of such machines is proposed, as part of resolved problems related to vibration detection on the organs of these machines. The vibration signal of a centrifugal pump was treated to mount the benefits of the approach proposed. The obtained results present the signal estimation of a pump vibration using Fourier transform technique compared by the spectral analysis methods based on Prony approach.

  9. Spectral Components Analysis of Diffuse Emission Processes

    Energy Technology Data Exchange (ETDEWEB)

    Malyshev, Dmitry; /KIPAC, Menlo Park


    We develop a novel method to separate the components of a diffuse emission process based on an association with the energy spectra. Most of the existing methods use some information about the spatial distribution of components, e.g., closeness to an external template, independence of components etc., in order to separate them. In this paper we propose a method where one puts conditions on the spectra only. The advantages of our method are: 1) it is internal: the maps of the components are constructed as combinations of data in different energy bins, 2) the components may be correlated among each other, 3) the method is semi-blind: in many cases, it is sufficient to assume a functional form of the spectra and determine the parameters from a maximization of a likelihood function. As an example, we derive the CMB map and the foreground maps for seven yeas of WMAP data. In an Appendix, we present a generalization of the method, where one can also add a number of external templates.

  10. Imaging Nonequilibrium Atomic Vibrations with X-ray Diffuse Scattering

    Energy Technology Data Exchange (ETDEWEB)

    Trigo, M.; Chen, J.; Vishwanath, V.H.; /SLAC; Sheu, Y.M.; /Michigan U.; Graber, T.; Henning, R.; /U. Chicago; Reis, D; /SLAC /Stanford U., Appl. Phys. Dept.


    We use picosecond x-ray diffuse scattering to image the nonequilibrium vibrations of the lattice following ultrafast laser excitation. We present images of nonequilibrium phonons in InP and InSb throughout the Brillouin-zone which remain out of equilibrium up to nanoseconds. The results are analyzed using a Born model that helps identify the phonon branches contributing to the observed features in the time-resolved diffuse scattering. In InP this analysis shows a delayed increase in the transverse acoustic (TA) phonon population along high-symmetry directions accompanied by a decrease in the longitudinal acoustic (LA) phonons. In InSb the increase in TA phonon population is less directional.

  11. Noise and diffusion in vibrated self-propelled particles (United States)

    Walsh, Lee; Schlossberg, Sarah; Baskaran, Aparna; Menon, Narayanan

    Active-matter systems are often modeled in the lab by studying the two-dimensional dynamics of granular particles driven by vibration in the third dimension. If the vibrational noise is rectified by the shape of the particle, the resulting motion of the particle shows directed motion superimposed on diffusion. We use particles designed for polar motion along a body axis as well as others that break isotropy in various ways. The long-term motion is typically theoretically modeled by a Langevin equation that encodes a self-propulsion velocity along the body axis as well as uncorrelated rotational and translational noise, all of which are treated as independent parameters. For a dilute system of granular tiles confined to a horizontal plane and vertically vibrated, we measure the long-time single-particle dynamics as well as the short-time distributions of translational and rotational motion. From these we characterize the different correlation functions that determine the noise and test the assumptions of the conventional Langevin dynamics used for self-propelled particles.

  12. Non-diffuseness of vibration fields in ribbed plates. (United States)

    Brunskog, Jonas; Chung, Hyuck


    This paper presents numerical simulations of structural intensity in a rib-reinforced plate, investigating the diffuseness. Many prediction models of building and structural acoustics, such as statistical energy analysis or energy flow methods, assume the vibrational wave fields to be diffuse. However, the diffuseness assumption is not always valid. One such example is a rib-reinforced plate typically found in a lightweight floor with wooden joists. Other examples can be found in aircraft and ship structures. The structural intensity of a ribbed plate is computed at low to mid frequencies using the Fourier sine expansion of the transverse displacement of the plate. Hamilton's principle is used in combination with thin plate theory and Euler beam theory. The model takes into account interactions between components. The Fourier sine modes are re-formulated as plane waves in a radial coordinate system, which can express the structural intensity in terms of the angular component of the modes. In the simulations, ensemble averages and rain-on-the-roof excitations are used. The numerical results show that the structural intensity varies significantly as the angle of propagation changes and cannot be assumed to form a diffuse field. © 2011 Acoustical Society of America

  13. Image completion by diffusion maps and spectral relaxation. (United States)

    Gepshtein, Shai; Keller, Yosi


    We present a framework for image inpainting that utilizes the diffusion framework approach to spectral dimensionality reduction. We show that on formulating the inpainting problem in the embedding domain, the domain to be inpainted is smoother in general, particularly for the textured images. Thus, the textured images can be inpainted through simple exemplar-based and variational methods. We discuss the properties of the induced smoothness and relate it to the underlying assumptions used in contemporary inpainting schemes. As the diffusion embedding is nonlinear and noninvertible, we propose a novel computational approach to approximate the inverse mapping from the inpainted embedding space to the image domain. We formulate the mapping as a discrete optimization problem, solved through spectral relaxation. The effectiveness of the presented method is exemplified by inpainting real images, where it is shown to compare favorably with contemporary state-of-the-art schemes.

  14. Solutal-thermo-diffusion convection in a vibrating rectangular cavity

    Energy Technology Data Exchange (ETDEWEB)

    Chacha, M. [UAE University, Department of Mechanical Engineering, PO Box 17555, AD, Al Ain (United Arab Emirates); Saghir, M.Z. [Ryerson University, Department of Mechanical Engineering, 350 Victoria Street, ON, M5B 2K3, Toronto (Canada)


    Diffusion-dominated experiments on-board the International Space Station and other free-flying platforms are affected by the convective flow due to the residual acceleration field and/or to the oscillatory accelerations (g-jitters) caused by several external sources. We are interested in investigating these effects on the solutal-thermo-diffusion for a binary fluid mixture. We considered a rectangular rigid cavity filled with methane (20%) and normal butane (80%), subject to a temperature difference on its lateral walls and radiation heat transfer on the horizontal walls. The full transient Navier-Stokes equations, accounting for a unique mode of oscillatory acceleration, coupled with the mass and heat transfer formulations and the equation of state of the fluid were solved numerically using the control volume technique. The species transport equation accounts for varying diffusion coefficients with the temperature and the fluid composition and their effect is analysed as compared to that of their average constant values. Results revealed that convection is enhanced and temperature and species profiles distortion from purely diffusive (zero-gravity) condition increases in a buoyancy-destabilizing configuration. The numerical study shows that by elimination both the residual gravity and the g-jitter levels are essential to achieve nearly purely diffusive conditions when their direction is orthogonal to that of the temperature gradient. For the configuration investigated, the g-jitter is found to reduce compositional variation. When quasi-steady state conditions are attained, thermal and compositional quantities fluctuate following a mode whose fundamental (primary) frequency is equal to that of the initially imposed vibration. (authors)

  15. Some remarks on relativistic diffusion and the spectral dimension criterion (United States)

    Muniz, C. R.; Cunha, M. S.; Filho, R. N. Costa; Bezerra, V. B.


    The spectral dimension ds for high energies is calculated using the Relativistic Schrödinger Equation Analytically Continued (RSEAC) instead of the so-called Telegraph's equation (TE), in both ultraviolet (UV) and infrared (IR) regimens. Regarding the TE, the recent literature presents difficulties related to its stochastic derivation and interpretation, advocating the use of the RSEAC to properly describe the relativistic diffusion phenomena. Taking into account that the Lorentz symmetry is broken in UV regime at Lifshitz point, we show that there exists a degeneracy in very high energies, meaning that both the RSEAC and TE correctly describe the diffusion processes at these energy scales, at least under the spectral dimension criterion. In fact, both the equations yield the same result, namely, ds=2 , a dimensional reduction that is compatible with several theories of quantum gravity. This result is reached even when one takes into account a cosmological model, as for example, the de Sitter universe. On the other hand, in the IR regimen, such degeneracy is lifted in favor of the approach via TE, due to the fact that only this equation provides the correct value for ds, which is equal to the actual number of spacetime dimensions, i.e., ds=4 , while RSEAC yields ds=3 , so that a diffusing particle described by this method experiences a three-dimensional spacetime.

  16. Discrimination of periodontal diseases using diffuse reflectance spectral intensity ratios (United States)

    Chandra Sekhar, Prasanth; Betsy, Joseph; Presanthila, Janam; Subhash, Narayanan


    This clinical study was to demonstrate the applicability of diffuse reflectance (DR) intensity ratio R620/R575 in the quantification and discrimination of periodontitis and gingivitis from healthy gingiva. DR spectral measurements were carried out with white-light illumination from 70 healthy sites in 30 healthy volunteers, and 63 gingivitis- and 58 periodontitis-infected sites in 60 patients. Clinical parameters such as probing pocket depth, clinical attachment level, and gingival index were recorded in patient population. Diagnostic accuracies for discrimination of gingivitis and periodontitis from healthy gingiva were determined by comparison of spectral signatures with clinical parameters. Divergence of average DR spectral intensity ratio between control and test groups was studied using analysis of variance. The mean DR spectrum on normalization at 620 nm showed marked differences between healthy tissue, gingivitis, and periodontitis. Hemoglobin concentration and apparent SO2 (oxygen saturation) were also calculated for healthy, gingivitis, and periodontitis sites. DR spectral intensities at 545 and 575 nm showed a decreasing trend with progression of disease. Among the various DR intensity ratios studied, the R620/R575 ratio provided a sensitivity of 90% and specificity of 94% for discrimination of healthy tissues from gingivitis and a sensitivity of 91% and specificity of 100% for discrimination of gingivitis from periodontitis.

  17. Hydrogen bond dynamics and vibrational spectral diffusion in ...

    Indian Academy of Sciences (India)

    Marx D and Hutter J 2000 in Modern methods and algorithms of quantum chemistry (ed) J Grotendorst. (NIC, FZ Jülich, ADDRESS) for downloads see . 27. Fuentes M, Guttorp P and Sampson P D 2007 in Statisti- cal methods for spatio-temporal systems, chapter 3 (eds).

  18. Imaging acoustic vibrations in an ear model using spectrally encoded interferometry (United States)

    Grechin, Sveta; Yelin, Dvir


    Imaging vibrational patterns of the tympanic membrane would allow an accurate measurement of its mechanical properties and provide early diagnosis of various hearing disorders. Various optical technologies have been suggested to address this challenge and demonstrated in vitro using point scanning and full-field interferometry. Spectrally encoded imaging has been previously demonstrated capable of imaging tissue acoustic vibrations with high spatial resolution, including two-dimensional phase and amplitude mapping. In this work, we demonstrate a compact optical apparatus for imaging acoustic vibrations that could be incorporated into a commercially available digital otoscope. By transmitting harmonic sound waves through the otoscope insufflation port and analyzing the spectral interferograms using custom-built software, we demonstrate high-resolution vibration imaging of a circular rubber membrane within an ear model.

  19. Spectral diffusion of quasi localized excitons in single silicon nanocrystals

    Energy Technology Data Exchange (ETDEWEB)

    Martin, Joerg; Cichos, Frank [Centre for nanostructured Materials and Analytics, Institute of Physics, Chemnitz University of Technology, Reichenhainer Street 70, 09107 Chemnitz (Germany); Borczyskowski, Christian von, E-mail: [Centre for nanostructured Materials and Analytics, Institute of Physics, Chemnitz University of Technology, Reichenhainer Street 70, 09107 Chemnitz (Germany)


    Evolution in time of photoluminescence spectra of SiO{sub x} capped single silicon nanocrystals has been investigated by means of confocal optical spectroscopy at room temperature. Large spectral jumps between subsequent spectra of up to 40 meV have been detected leading to noticeable line broadening and variation in the electron-phonon coupling. Further, a correlation between emission energy and emission intensity has been found and discussed in terms of an intrinsic Stark effect. Anti-correlated variations of the electron-phonon coupling to Si and SiO{sub 2} phonons as a function of photoluminescence energy indicate that the nearly localized excition is to some extent coupled to phonons in the shell covering the silicon nanocrystal. However, coupling is reduced upon increasing Stark effect, while at the same time coupling to phonons of the Si core increases. - Highlights: Black-Right-Pointing-Pointer Single silicon nanocrystals are detected via confocal microscopy. Black-Right-Pointing-Pointer Photoluminescence energies fluctuate strongly in time. Black-Right-Pointing-Pointer Spectral fluctuation is described in the form of spectral diffusion. Black-Right-Pointing-Pointer Dynamic processes are strongly controlled by electron-phonon coupling.

  20. Vibrational echo spectral observables and frequency fluctuations of ...

    Indian Academy of Sciences (India)

    Deepak Ojha

    Vibrational echo; frequency fluctuations; hydration shell water; fluoride ion; ab initio molecular dynamics. 1. Introduction. Ions dissolved in liquid water play important roles in several chemical and biological processes.1,2 Simi- larly, water molecules in aqueous ionic solutions exhibit different dynamics in comparison to pure ...

  1. Reorientation-induced spectral diffusion of non-isotropic orientation distributions (United States)

    Ren, Zhe; Garrett-Roe, Sean


    When reorientation of a vibrational chromophore is faster than the relaxation of its local environment, the frequency fluctuation correlation function (FFCF) measured by two-dimensional infrared spectroscopy (2D-IR) spectroscopy is an interplay of scalar structural spectral diffusion and vectorial reorientation-induced spectral diffusion (RISD). Theory has been established to calculate the RISD component of different polarization configurations with the assumption that the molecule orients randomly in a local electric field. We show here that in the [BMIM][SCN]/AOT/chlorobenzene system, where the local electric field is strong, this assumption is incapable of reproducing the experimental results. We modify the current theory by assuming a Boltzmann distribution of transition dipoles of the chromophores in a local electric field and use a Markov chain model to calculate the RISD component of 2D-IR with different polarization configurations. The result reproduces key features of the experiment and suggests a potential ion-exchange in the [BMIM][SCN]/AOT/chlorobenzene system.

  2. Homogeneous linewidth and spectral diffusion in semiconductor nanocrystals (United States)

    Kruger, Sasha Dawn Tavenner

    Semiconductor nanocrystals a few nanometers in extent exhibit unique electronic and optical properties. These properties depend on the size and dimensionality of the confinement potential. The optical absorption spectrum of nanocrystals generally features a zero-phonon line (ZPL). Its width indicates the coupling of the electron to the electromagnetic vacuum and to phonons. Electron-phonon interactions are one strong source of exciton decoherence. The ZPL linewidth yields the total decoherence rate. This dissertation presents experimental studies of the decoherence rate in CdSe/ZnS core/shell quantum dots (QDs), nanorods, and PbS QDs. The spectroscopic work is accomplished by using high-resolution spectral-hole burning (SHB), which eliminates effects of inhomogeneous broadening due to nanocrystal size variations. SHB response-dependence on the measurement timescale is also used to probe spectral diffusion:random spectral shifts in the optical transition frequency due to a fluctuating local environment. These studies provide important information on decoherence processes in nanocrystals. SHB response obtained from spherical CdSe/ZnS QDs exhibits a sharp ZPL and discrete acoustic phonon sidebands due to phonon-assisted transitions. The suppression of effects of spectral diffusion in the SHB measurement leads to a ZPL homogeneous linewidth of 1.5 GHz; corresponding to a decoherence rate of 0.75 GHz, which is more than one order-of-magnitude smaller than that observed previously, still far exceeding the expected radiative linewidth. The observed acoustic phonon sidebands are in agreement with a theoretical estimate of the confined phonon modes in nanocrystals. No ZPL, however, was observed in the SHB response of PbS QDs, reflecting the strong electron-phonon interaction in these nanocrystals. The 0-D to 1-D transition is of particular interest, and is examined by comparing decoherence rates in QDs to those in nanorods. SHB response obtained from nanorods reveals a

  3. Single Molecule Spectral Diffusion in a Solid Detected Via Fluorescence Spectroscopy (United States)


    NO. NO ACCESSION NO. 11. TITLE (Include Security Classification) Single Molecule Spectral Diffusion In A Solid Detected Via Fluorescence Spectroscopy...and identify by block number) FIELD jGROUP SUB-GROUP_ Single molecule spectroscopy Precision detection Spectral diffusion, Pentacene in p-terphenyl 19... Single Molecule Spectral Diffusion ’n A Solid Detected Via Fluorescence Spectroscopy hy W. P. Ambrose, T. Basche, and W. E. Moerner

  4. Optical vibration detection spectral analysis assembly and method for detecting vibration in an object of interest (United States)

    Hale, Thomas C.; Telschow, Kenneth L.


    A vibration detection assembly is described which includes an emitter of light which has object and reference beams, the object beam reflected off of a vibrating object of interest; and a photorefractive substance having a given response time and which passes the reflected object beam and the reference beam, the reference beam and the object beam interfering within the photorefractive substance to create a space charge field which develops within the response time of the photorefractive substance.

  5. An introduction to random vibrations, spectral & wavelet analysis

    CERN Document Server

    Newland, D E


    One of the first engineering books to cover wavelet analysis, this classic text describes and illustrates basic theory, with a detailed explanation of the workings of discrete wavelet transforms. Computer algorithms are explained and supported by examples and a set of problems, and an appendix lists ten computer programs for calculating and displaying wavelet transforms.Starting with an introduction to probability distributions and averages, the text examines joint probability distributions, ensemble averages, and correlation; Fourier analysis; spectral density and excitation response relation

  6. Optimum Resolution Bandwidth for Spectral Analysis of Stationary Random Vibration Data

    Directory of Open Access Journals (Sweden)

    Allan G. Piersol


    Full Text Available This article presents a methodology for selecting the frequency resolution bandwidth for the spectral analysis of stationary random vibration signals in an optimum manner. Specifically, the resolution bandwidth that will produce power spectral density estimates with a minimum mean square error is determined for any given measurement duration (averaging time, and methods of approximating the optimum bandwidth using practical spectral analysis procedures are detailed. The determination of the optimum resolution bandwidth requires an estimate for the damping ratio of the vibrating structure that produced the measured vibration signal and the analysis averaging time. It is shown that the optimum resolution bandwidth varies approximately with the 0.8 power of the damping ratio and the bandwidth center frequency, and the −0.2 power of the averaging time. Also, any resolution bandwidth within ±50% of the optimum bandwidth will produce power spectral density (PSD estimates with an error that is no more than 25% above the minimum achievable error. If a damping ratio of about 5% for structural resonances is assumed, a constant percentage resolution bandwidth of 1/12 octave, but no less than 2.5 Hz, will provide a near optimum PSD analysis for an averaging time of 2 seconds over the frequency range from 20 to 2000 Hz. A simple scaling formula allows the determination of appropriate bandwidths for other damping ratios and averaging times.

  7. Resonant diffusion of normal alkanes in zeolites: Effect of the zeolite structure and alkane molecule vibrations

    CERN Document Server

    Tsekov, R


    Diffusion of normal alkanes in one-dimensional zeolites is theoretically studied on the basis of the stochastic equation formalism. The calculated diffusion coefficient accounts for the vibrations of the diffusing molecule and zeolite framework, molecule-zeolite interaction, and specific structure of the zeolite. It is shown that when the interaction potential is predominantly determined by the zeolite pore structure, the diffusion coefficient varies periodically with the number of carbon atoms of the alkane molecule, a phenomenon called resonant diffusion. A criterion for observable resonance is obtained from the balance between the interaction potentials of the molecule due to the atomic and pore structures of the zeolite. It shows that the diffusion is not resonant in zeolites without pore structure, such as ZSM-12. Moreover, even in zeolites with developed pore structure no resonant dependence of the diffusion constant can be detected if the pore structure energy barriers are not at least three times high...

  8. Molecular structure, vibrational spectral analysis, NBO, HOMO-LUMO and conformational studies of ninhydrin (United States)

    Arivazhagan, M.; Anitha Rexalin, D.


    The FT-IR and FT-Raman vibrational spectra of ninhydrin have been recorded in the range 4000-400 cm-1and 3600-50 cm-1, respectively. A detailed vibrational spectral analysis has been carried out and assignments of the observed fundamental bands have been proposed on the basis of peak positions and relative intensities. The optimized molecular geometry, vibrational frequencies, atomic charges, dipole moment, rotational constants and several thermodynamic parameters in the ground state are calculated using ab initio HF and density functional B3LYP methods with 6-311++G(d,p) basis set combination. In order to find the most optimized geometry, the energy calculations are carried out for various possible conformers. Keto and enol forms of ninhydrin are also studied. The condensed summary of the principal NBOs shows the occupancy, orbital energy and the qualitative pattern of delocalization interactions of ninhydrin. The calculated HOMO-LUMO energies reveal that charge transfer occurs within the molecule. The predicted first hyperpolarizability also shows that the ninhydrin molecule have good optical quality and nonlinear optical (NLO) behavior. With the help of specific scaling procedures, the observed vibrational wave numbers in FT-IR and FT-Raman spectra are analyzed and assigned to different normal modes of the molecule.

  9. Non-diffuseness of vibration fields in ribbed plates

    DEFF Research Database (Denmark)

    Brunskog, Jonas; Chung, Hyuck


    . However, the diffuseness assumption is not always valid. One such example is a rib-reinforced plate typically found in a lightweight floor with wooden joists. Other examples can be found in aircraft and ship structures. The structural intensity of a ribbed plate is computed at low to mid frequencies using...... the Fourier sine expansion of the transverse displacement of the plate. Hamilton's principle is used in combination with thin plate theory and Euler beam theory. The model takes into account interactions between components. The Fourier sine modes are re-formulated as plane waves in a radial coordinate system...

  10. Evaluation of the desert dust effects on global, direct and diffuse spectral ultraviolet irradiance

    Directory of Open Access Journals (Sweden)

    R. Román


    Full Text Available This paper presents a study of a strong desert dust episode over the Iberian Peninsula, and its effect on the spectral ultraviolet (UV irradiance in Granada, Spain. Remote sensing measurements, forecast models, and synoptic analysis are used to identify a Saharan desert dust outbreak that affected the Iberian Peninsula starting 20 July 2009. Additionally, a Bentham DMc150 spectroradiometer is employed to obtain global, direct and diffuse spectral UV irradiances every 15 minutes in Granada. The desert dust caused a large attenuation of the direct UV irradiance (up to 55%, while the diffuse UV irradiance increased up to 40% at 400 nm. The UVSPEC/LibRadtran radiative transfer model is used to study the spectral dependence of the experimental UV irradiance ratios (ratios of spectral irradiance for the day with the highest aerosol load to that measured in days with low–moderate load. The spectral increase or decrease of the UV direct irradiance ratios depends on a new parameter: a threshold wavelength. The spectral dependence of the UV diffuse irradiance ratio can be explained because under the influence of the intense dust outbreak, the Mie scattering by aerosols at shorter wavelengths is stronger than the Rayleigh scattering by gases. Finally, the sensitivity analysis of the aerosol absorption properties shows a substantial attenuation of UV spectral irradiance with a weak spectral dependence.

  11. Spectral diffusion and dynamic nuclear polarization: Beyond the high temperature approximation. (United States)

    Wenckebach, W Th


    Dynamic Nuclear Polarization (DNP) has proven itself most powerful for the orientation of nuclear spins in polarized targets and for hyperpolarization in magnetic resonance imaging (MRI). Unfortunately, the theoretical description of some of the processes involved in DNP invokes the high temperature approximation, in which Boltzmann factors are expanded up to first order, while the high electron and nuclear spin polarization required for many applications do not justify such an approximation. A previous article extended the description of one of the mechanisms of DNP-thermal mixing-beyond the high temperature approximation (Wenckebach, 2017). But that extension is still limited: it assumes that fast spectral diffusion creates a local equilibrium in the electron spin system. Provotorov's theory of cross-relaxation enables a consistent further extension to slower spectral diffusion, but also invokes the high temperature approximation. The present article extends the theory of cross-relaxation to low temperature and applies it to spectral diffusion in glasses doped with paramagnetic centres with anisotropic g-tensors. The formalism is used to describe DNP via the mechanism of the cross effect. In the limit of fast spectral diffusion the results converge to those obtained in Wenckebach (2017) for thermal mixing. In the limit of slow spectral diffusion a hole is burnt in the electron spin resonance (ESR) signal, just as predicted by more simple models. The theory is applied to DNP of proton and (13)C spins in samples doped with the radical TEMPO. Copyright © 2017. Published by Elsevier Inc.

  12. INTRODUCTION: Surface Dynamics, Phonons, Adsorbate Vibrations and Diffusion (United States)

    Bruch, L. W.


    -temperature operation, as well as improving the spectral purity, modulation speed and peak power output. Many applications in medicine, environmental sensing and communications can be addressed with the achievement of significant improvements in these parameters. Semiconductor optical amplifiers (SOAs) are also important devices of interest, since it is widely predicted that the market for SOAs in photonic access networks will increase dramatically in the next few years. In addition to EELs and SOAs, vertical cavity surface-emitting lasers (VCSELs), vertical external cavity surface-emitting lasers (VECSELs), vertical cavity semiconductor optical amplifiers (VCSOAs), and semiconductor saturable absorber mirrors (SESAMs) are of increasing importance. The VECSELs can potentially incorporate saturable absorbers for very high repetition rate (~100 GHz) pulsed and potentially MEMS-tuneable sources. VECSEL devices in the 2-3 µm range for applications in e.g. free-space optical (FSO) communications, are possible using InAsN/InGaAs/InP with AlGaAs metamorphic mirror growth. Semiconductor saturable-absorber mirror structures (SESAMs) have demonstrated widespread applicability for self-starting passive mode locking of (diode-pumped) solid-state lasers, to produce high-performance picosecond and femtosecond laser sources for scientific, instrumentation and industrial use. Very recently, these devices have also shown applicability for ultra short pulse generation at >GHz repetition rates, both in DPSS lasers and surface-emitting semiconductor lasers. These devices are undoped monolithic DBR structures incorporating one or more quantum wells for saturable absorption. Low-loss and high-damage threshold requirements demand pseudomorphic growth, and have, until very recently, essentially limited these devices to the 800-1100 nm range, but extension beyond this range is urgently required by a host of mode locking applications. In addition to these devices modulators and photodiodes, including quantum

  13. Spectral-spatial classification combined with diffusion theory based inverse modeling of hyperspectral images (United States)

    Paluchowski, Lukasz A.; Bjorgan, Asgeir; Nordgaard, Hâvard B.; Randeberg, Lise L.


    Hyperspectral imagery opens a new perspective for biomedical diagnostics and tissue characterization. High spectral resolution can give insight into optical properties of the skin tissue. However, at the same time the amount of collected data represents a challenge when it comes to decomposition into clusters and extraction of useful diagnostic information. In this study spectral-spatial classification and inverse diffusion modeling were employed to hyperspectral images obtained from a porcine burn model using a hyperspectral push-broom camera. The implemented method takes advantage of spatial and spectral information simultaneously, and provides information about the average optical properties within each cluster. The implemented algorithm allows mapping spectral and spatial heterogeneity of the burn injury as well as dynamic changes of spectral properties within the burn area. The combination of statistical and physics informed tools allowed for initial separation of different burn wounds and further detailed characterization of the injuries in short post-injury time.

  14. Classification of Error-Diffused Halftone Images Based on Spectral Regression Kernel Discriminant Analysis

    Directory of Open Access Journals (Sweden)

    Zhigao Zeng


    Full Text Available This paper proposes a novel algorithm to solve the challenging problem of classifying error-diffused halftone images. We firstly design the class feature matrices, after extracting the image patches according to their statistics characteristics, to classify the error-diffused halftone images. Then, the spectral regression kernel discriminant analysis is used for feature dimension reduction. The error-diffused halftone images are finally classified using an idea similar to the nearest centroids classifier. As demonstrated by the experimental results, our method is fast and can achieve a high classification accuracy rate with an added benefit of robustness in tackling noise.

  15. Stochastic chaos induced by diffusion processes with identical spectral density but different probability density functions. (United States)

    Lei, Youming; Zheng, Fan


    Stochastic chaos induced by diffusion processes, with identical spectral density but different probability density functions (PDFs), is investigated in selected lightly damped Hamiltonian systems. The threshold amplitude of diffusion processes for the onset of chaos is derived by using the stochastic Melnikov method together with a mean-square criterion. Two quasi-Hamiltonian systems, namely, a damped single pendulum and damped Duffing oscillator perturbed by stochastic excitations, are used as illustrative examples. Four different cases of stochastic processes are taking as the driving excitations. It is shown that in such two systems the spectral density of diffusion processes completely determines the threshold amplitude for chaos, regardless of the shape of their PDFs, Gaussian or otherwise. Furthermore, the mean top Lyapunov exponent is employed to verify analytical results. The results obtained by numerical simulations are in accordance with the analytical results. This demonstrates that the stochastic Melnikov method is effective in predicting the onset of chaos in the quasi-Hamiltonian systems.

  16. Noise and diffusion of a vibrated self-propelled granular particle. (United States)

    Walsh, Lee; Wagner, Caleb G; Schlossberg, Sarah; Olson, Christopher; Baskaran, Aparna; Menon, Narayanan


    Granular materials are an important physical realization of active matter. In vibration-fluidized granular matter, both diffusion and self-propulsion derive from the same collisional forcing, unlike many other active systems where there is a clean separation between the origin of single-particle mobility and the coupling to noise. Here we present experimental studies of single-particle motion in a vibrated granular monolayer, along with theoretical analysis that compares grain motion at short and long time scales to the assumptions and predictions, respectively, of the active Brownian particle (ABP) model. Our results show that despite the unique relation between noise and propulsion, a variety of granular particles are correctly described by the ABP model. Additionally, our scheme of analysis for validating the inputs and outputs of the model can be applied to other granular and non-granular active systems.

  17. Energy calibration issues in nuclear resonant vibrational spectroscopy: observing small spectral shifts and making fast calibrations. (United States)

    Wang, Hongxin; Yoda, Yoshitaka; Dong, Weibing; Huang, Songping D


    The conventional energy calibration for nuclear resonant vibrational spectroscopy (NRVS) is usually long. Meanwhile, taking NRVS samples out of the cryostat increases the chance of sample damage, which makes it impossible to carry out an energy calibration during one NRVS measurement. In this study, by manipulating the 14.4 keV beam through the main measurement chamber without moving out the NRVS sample, two alternative calibration procedures have been proposed and established: (i) an in situ calibration procedure, which measures the main NRVS sample at stage A and the calibration sample at stage B simultaneously, and calibrates the energies for observing extremely small spectral shifts; for example, the 0.3 meV energy shift between the 100%-(57)Fe-enriched [Fe4S4Cl4](=) and 10%-(57)Fe and 90%-(54)Fe labeled [Fe4S4Cl4](=) has been well resolved; (ii) a quick-switching energy calibration procedure, which reduces each calibration time from 3-4 h to about 30 min. Although the quick-switching calibration is not in situ, it is suitable for normal NRVS measurements.

  18. Spectral analysis and multigrid preconditioners for two-dimensional space-fractional diffusion equations (United States)

    Moghaderi, Hamid; Dehghan, Mehdi; Donatelli, Marco; Mazza, Mariarosa


    Fractional diffusion equations (FDEs) are a mathematical tool used for describing some special diffusion phenomena arising in many different applications like porous media and computational finance. In this paper, we focus on a two-dimensional space-FDE problem discretized by means of a second order finite difference scheme obtained as combination of the Crank-Nicolson scheme and the so-called weighted and shifted Grünwald formula. By fully exploiting the Toeplitz-like structure of the resulting linear system, we provide a detailed spectral analysis of the coefficient matrix at each time step, both in the case of constant and variable diffusion coefficients. Such a spectral analysis has a very crucial role, since it can be used for designing fast and robust iterative solvers. In particular, we employ the obtained spectral information to define a Galerkin multigrid method based on the classical linear interpolation as grid transfer operator and damped-Jacobi as smoother, and to prove the linear convergence rate of the corresponding two-grid method. The theoretical analysis suggests that the proposed grid transfer operator is strong enough for working also with the V-cycle method and the geometric multigrid. On this basis, we introduce two computationally favourable variants of the proposed multigrid method and we use them as preconditioners for Krylov methods. Several numerical results confirm that the resulting preconditioning strategies still keep a linear convergence rate.

  19. The experimental vibrational infrared spectrum of lemon peel and simulation of spectral properties of the plant cell wall (United States)

    Berezin, K. V.; Shagautdinova, I. T.; Chernavina, M. L.; Novoselova, A. V.; Dvoretskii, K. N.; Likhter, A. M.


    The experimental vibrational IR spectra of the outer part of lemon peel are recorded in the range of 3800-650 cm-1. The effect of artificial and natural dehydration of the peel on its vibrational spectrum is studied. It is shown that the colored outer layer of lemon peel does not have a noticeable effect on the vibrational spectrum. Upon 28-day storage of a lemon under natural laboratory conditions, only sequential dehydration processes are reflected in the vibrational spectrum of the peel. Within the framework of the theoretical DFT/B3LYP/6-31G(d) method, a model of a plant cell wall is developed consisting of a number of polymeric molecules of dietary fibers like cellulose, hemicellulose, pectin, lignin, some polyphenolic compounds (hesperetin glycoside-flavonoid), and a free water cluster. Using a supermolecular approach, the spectral properties of the wall of a lemon peel cell was simulated, and a detailed theoretical interpretation of the recorded vibrational spectrum is given.

  20. The design, construction, and calibration of a spectral diffuse/global irradiance meter (United States)

    Crowther, Blake Glenn


    Vicarious calibration methods have been developed to calibrate radiometric sensors in-flight. One such method, the irradiance-based method, requires the measurement of the diffuse-to-global (diffuse-to-total) irradiance ratio. Diffuse/global irradiance measurements may also be used to deduce atmospheric descriptors and provide a comparison with atmospheric modeling predictions. I describe the design, construction, calibration, and application of a spectral diffuse/global irradiance meter that can accomplish these objectives in this dissertation. I develop general integrating sphere theory, modeling methods, and describe the resultant computer model. The model results agreed with theory to better than 1% for a simple unbaffled integrating sphere. I applied the model to design an interior baffled integrating sphere-based cosine collector. I developed a method of tolerating the thermal expansion of Spectralonoler and the collector was constructed. Measurements of the collector angular response agreed with the model predictions to better than 4% for input zenith angles from 0o to 70o. The resulting instrument is automated and collects diffuse and global irradiance from 300 nm to 1100 nm. It has a nominal 12 nm full-width at half-maximum bandpass and has a minimum sampling interval of 1 nm. I estimate the uncertainty of the measurements to be 3.2%. The largest contributor to the total uncertainty is the measurement uncertainty of the diffuse irradiance at 2.5%. The instrument was used in a field experiment. Optical depths derived from the diffuse/global irradiance measurements agreed with those derived from a solar radiometer to within 0.008. Diffuse-to-global irradiance measurements made by the instrument were compared with an independent method and found to generally agree within 6%. The measurements were consistently lower than radiative transfer modeling estimates. Top of the atmosphere relative radiances computed from the two independent diffuse

  1. Oral cancer detection using diffuse reflectance spectral ratio R540/R575 of oxygenated hemoglobin bands (United States)

    Subhash, N.; Mallia, J. R.; Thomas, S. S.; Mathews, A.; Sebastian, P.; Madhaven, J.


    A low-cost, fast, and noninvasive method for early diagnosis of malignant lesions of oral mucosa based on diffuse reflectance spectral signatures is presented. In this technique, output of a tungsten halogen lamp is guided to the tissue through the central fiber of a reflection probe whose surrounding six fibers collects tissue reflectance. Ex vivo diffuse reflectance spectra in the 400 to 600-nm region is measured from surgically removed oral cavity lesions using a miniature fiber optic spectrometer connected to a computer. Reflectance spectral intensity is higher in malignant tissues and shows dips at 542 and 577 nm owing to absorption from oxygenated hemoglobin (HbO2). Measurements carried out, within an hour of surgical excision, on malignant lesion and adjoining uninvolved mucosa show that these absorption features are more prominent in neoplastic tissues owing to increased microvasculature and blood content. It is observed that reflectance intensity ratio of hemoglobin bands, R540/R575, from malignant sites are always lower than that from normal sites and vary according to the histological grade of malignancy. The diffuse reflectance intensity ratio R540/R575 of the hemoglobin bands appears to be a useful tool to discriminate between malignant lesions and normal mucosa of the oral cavity in a clinical setting.

  2. FT-IR and Raman vibrational microspectroscopies used for spectral biodiagnosis of human tissues


    Lin, Shan-Yang; Li, Mei-Jane; Cheng, Wen-Ting


    Fourier transform infrared (FT-IR) and Raman vibrational microspectroscopies used for biomedical diagnosis of human tissues are reviewed from basic principle to biological applications. The advantages and disadvantages of both vibrational microspectroscopies are compared to highlight their efficiency and adaptability for noninvasively investigating the chemical compositions of ultrastructual human tissues at different disease states. Biochemical fingerprints applied to the biological samples ...

  3. Spatial and spectral features of soft diffuse X ray background seen by the Einstein observatory (United States)

    Micela, G.; Harnden, F. R.; Rosner, R., Jr.; Sciortino, S.; Vaiana, G. S.


    A survey of the diffuse soft X-ray background as seen directly by the Einstein Observatory Imaging Proportional Counter (IPC) is presented. A source free region of the detector 1 by 1 degree field is used. The background in the 0.16 to 3.5 keV spectral region is viewed. The data covers roughly 5 percent of the sky, with some bias in coverage towards the galactic plane. The moderate energy resolution of the IPC enables the characterization and the production of maps of the background as a function of energy within the Einstein passband. The results are compared with previous observations of the diffuse X-ray background. The implications for galactic structure and for the soft component of the extragalactic X-ray background are discussed.

  4. Prediction of euphotic depths and diffuse attenuation coefficients from absorption profiles: a model based on comparisons between vertical profiles of spectral absorption, spectral irradiance, and P (United States)

    Zaneveld, J. Ronald V.; Pegau, Scott; Barnard, Andrew H.; Mueller, James L.; Maske, Helmut; Valdez, Eduardo; Lara-Lara, Ruben; Alvarez-Borrego, Saul


    A model is presented which predicts the diffuse attenuation coefficient of downwelling irradiance as a function of depth and the depth of the euphotic zone as based on the one percent level of photosynthetically active radiation from vertical profiles of spectral absorption and attenuation. The model is tested using data obtained in the Gulf of California. The modeled diffuse attenuation coefficients and PAR levels ar shown to have average errors of less than five percent when compared to the measured values.

  5. Singular solution of the Feller diffusion equation via a spectral decomposition (United States)

    Gan, Xinjun; Waxman, David


    Feller studied a branching process and found that the distribution for this process approximately obeys a diffusion equation [W. Feller, in Proceedings of the Second Berkeley Symposium on Mathematical Statistics and Probability (University of California Press, Berkeley and Los Angeles, 1951), pp. 227-246]. This diffusion equation and its generalizations play an important role in many scientific problems, including, physics, biology, finance, and probability theory. We work under the assumption that the fundamental solution represents a probability density and should account for all of the probability in the problem. Thus, under the circumstances where the random process can be irreversibly absorbed at the boundary, this should lead to the presence of a Dirac delta function in the fundamental solution at the boundary. However, such a feature is not present in the standard approach (Laplace transformation). Here we require that the total integrated probability is conserved. This yields a fundamental solution which, when appropriate, contains a term proportional to a Dirac delta function at the boundary. We determine the fundamental solution directly from the diffusion equation via spectral decomposition. We obtain exact expressions for the eigenfunctions, and when the fundamental solution contains a Dirac delta function at the boundary, every eigenfunction of the forward diffusion operator contains a delta function. We show how these combine to produce a weight of the delta function at the boundary which ensures the total integrated probability is conserved. The solution we present covers cases where parameters are time dependent, thereby greatly extending its applicability.

  6. Microwave Spectral Taxonomy and Astronomical Searches for Vibrationally-Excited C_2S and C_3S (United States)

    McGuire, Brett A.; Martin-Drumel, Marie-Aline; Stanton, John F.; McCarthy, Michael C.


    C_2S and C_3S are common interstellar species, and have relatively simple reaction chemistries. For these reasons, they frequently serve as probes of chemical evolution and physical conditions in rich astronomical sources. Because their rotational lines are often conspicuous there, detection of C_2S and C_3S in vibrationally-excited states might provide additional insight into formation pathways and excitation conditions. However, knowledge of the vibrational satellite transitions of both species is incomplete. Here, we report laboratory measurements of rotational spectra of vibrationally-excited C_2S and C_3S obtained from two microwave spectral taxonomy studies, in which CS_2 alone or in combination with a hydrocarbon precursor (acetylene or diacetylene), were produced using an electrical discharge. For C_3S, these studies, in combination with high-level quantum chemical calculations, greatly extend previous microwave measurements, while for C_2S, satellite transitions from several vibrational states have been observed for the first time. On the basis of precise laboratory rest frequencies, renewed searches for these transitions can be undertaken with confidence in publicly-available astronomical line surveys.

  7. Structure activity relationship, vibrational spectral investigation and molecular docking analysis of anti-neuronal drug 4-(2-Aminoethyl) morpholine (United States)

    Edwin, Bismi; Amalanathan, M.; Chadha, Ridhima; Maiti, Nandita; Kapoor, Sudhir; Hubert Joe, I.


    Vibrational spectral analysis and quantum chemical computations based on density functional theory have been performed on the anti-neuronal drug 4-(2-aminoethyl) morpholine. The geometry, intermolecular hydrogen bond, and harmonic vibrational frequencies of the title molecule have been investigated with the help of B3LYP method. The calculated molecular geometry has been compared with the experimental data. The various intramolecular interactions have been exposed by natural bond orbital analysis. Analysis of SERS bands in comparison to the normal Raman spectrum indicates the chemisorption of the drug on the silver surface. The analysis of the electron density of HOMO and LUMO gives an idea of the delocalization and low value of energy gap indicates electron transport in the molecule and thereby bioactivity. Effective docking of the drug molecule with 2C6C protein also enhances its bioactive nature.


    Directory of Open Access Journals (Sweden)



    Full Text Available Seat vibration is one of the major causes of discomfort in moving vehicle. Tyre, engine, drivetrain and aerodynamic forces excite the cabin and interior through various pathways. In this paper, the contributions of tyre and engine vibration to seat excitations are studied. Virtual Source Analysis (VSA is implemented to decompose the source signals into incoherent phenomena. Studying these phenomena (virtual sources shows the amount and frequency bands that physical sources affect the seat vibration as the response channel. Experiment is conducted while riding on smooth and bumpy roads. Road roughness is characterized using International Roughness Index (IRI. VSA technique approve that tyre is the main source of seat vibration for the moving vehicle. Seat vibration has significant values below 400 Hz and tyre is found to be the dominant source of excitations for both smooth and bumpy roads. For smooth road, strong engine harmonics below 200 Hz also has some involvements. But in bumpy road, tyre vibration rise up and become the dominant broadband source of excitations. Tyre damper and engine mount Frequency Response Function (FRF analysis show that these parts are designed to be highly efficient below 1400 Hz and 200 Hz, respectively. These ranges are identical with those that were found as the critical operational frequency spans in VSA.

  9. Vibrational Spectral Studies and Ab initio Computations of a Nonlinear Food Dye Carmoisine (United States)

    Snehalatha, M.; Ravikumar, C.; Sekar, N.; Jayakumar, V. S.; Joe, I. Hubert


    FT-IR and Raman techniques were employed for the vibrational characterization of the food dye Carmoisine (E122). The equilibrium geometry, various bonding features, and harmonic vibrational wavenumbers have been investigated with the help of density functional theory (DFT) calculations. The first hyperpolarizability of the molecule is calculated. A good correlation was found between the computed and experimental wavenumbers. Azo stretching wavenumbers have been lowered due to conjugation and π-electron delocalization. The optimized structure indicates intramolecular C-H …O=S hydrogen bonding in the molecule. Intramolecular charge transfer (ICT) responsible for the optical nonlinearity of the dye molecule has been discussed theoretically and experimentally.

  10. Pseudo spectral collocation with Maxwell polynomials for kinetic equations with energy diffusion (United States)

    Sánchez-Vizuet, Tonatiuh; Cerfon, Antoine J.


    We study the approximation and stability properties of a recently popularized discretization strategy for the speed variable in kinetic equations, based on pseudo-spectral collocation on a grid defined by the zeros of a non-standard family of orthogonal polynomials called Maxwell polynomials. Taking a one-dimensional equation describing energy diffusion due to Fokker–Planck collisions with a Maxwell–Boltzmann background distribution as the test bench for the performance of the scheme, we find that Maxwell based discretizations outperform other commonly used schemes in most situations, often by orders of magnitude. This provides a strong motivation for their use in high-dimensional gyrokinetic simulations. However, we also show that Maxwell based schemes are subject to a non-modal time stepping instability in their most straightforward implementation, so that special care must be given to the discrete representation of the linear operators in order to benefit from the advantages provided by Maxwell polynomials.

  11. Multi-spectral and fluorescence diffuse optical tomography of breast cancer (United States)

    Corlu, Alper

    Multi-spectral and fluorescence diffuse optical tomography (DOT) techniques are explored and applied to image human breast cancer in vivo. Image reconstruction algorithms that utilize first and second order gradient information are described in detail. Breast DOT requires large computational memory and long run times. To this end, parallel computation techniques were developed appropriate to each reconstruction algorithm. A parallel plate DOT instrument developed for breast cancer imaging is described. The system relies heavily on continuous-wave (CW) transmission measurements and utilizes frequency domain (FD) measurements on the reemission side. However, traditional DOT image reconstruction methods based on CW measurements fail to separate tissue absorption and scattering uniquely. In this manuscript, multi-spectral DOT is shown to be capable of minimizing cross-talk and retrieving spectral parameters almost uniquely when the measurement wavelengths are optimized. A theoretical framework to select optimum wavelengths is provided, and tested with computer simulations. Results from phantom spectroscopy experiments and in vivo patient measurements support the notion that multi-spectral methods are superior to traditional DOT image reconstruction schemes. The same breast DOT instrument is improved and utilized to obtain the first in vivo images of human breast cancer based on fluorescence DOT (FDOT). To this end the fluorophore Indocyanine Green (ICG) is injected intravenously and fluorescence excitation and detection are accomplished in the soft-compression, parallel-plane, transmission geometry using laser sources at 786 nm and spectrally filtered CCD detection. Careful phantom and in vivo measurements are carried on to assure that the signals are due to ICG fluorescence, rather than tissue autofluorescence and excitation light leakage. An in vivo measurement protocol is designed to maximize the ICG contrast by acquiring full fluorescence tomographic scan during

  12. Improved measurement of the spectral index of the diffuse radio background between 90 and 190 MHz (United States)

    Mozdzen, T. J.; Bowman, J. D.; Monsalve, R. A.; Rogers, A. E. E.


    We report absolutely calibrated measurements of diffuse radio emission between 90 and 190 MHz from the Experiment to Detect the Global EoR Signature (EDGES). EDGES employs a wide beam zenith-pointing dipole antenna centred on a declination of -26.7°. We measure the sky brightness temperature as a function of frequency averaged over the EDGES beam from 211 nights of data acquired from 2015 July to 2016 March. We derive the spectral index, β, as a function of local sidereal time (LST) and find -2.60 > β > -2.62 ± 0.02 between 0 and 12 h LST. When the Galactic Centre is in the sky, the spectral index flattens, reaching β = -2.50 ± 0.02 at 17.7 h. The EDGES instrument is shown to be very stable throughout the observations with night-to-night reproducibility of σβ GSM) of de Oliveira-Costa et al. and with fits between the Guzmán et al. 45 MHz and Haslam et al. 408 MHz maps. We find good agreement at the transit of the Galactic Centre. Away from transit, the GSM tends to overpredict (GSM less negative) by 0.05 < Δβ = βGSM - βEDGES < 0.12, while the 45-408 MHz fits tend to overpredict by Δβ < 0.05.

  13. Fast and accurate implementation of Fourier spectral approximations of nonlocal diffusion operators and its applications (United States)

    Du, Qiang; Yang, Jiang


    This work is concerned with the Fourier spectral approximation of various integral differential equations associated with some linear nonlocal diffusion and peridynamic operators under periodic boundary conditions. For radially symmetric kernels, the nonlocal operators under consideration are diagonalizable in the Fourier space so that the main computational challenge is on the accurate and fast evaluation of their eigenvalues or Fourier symbols consisting of possibly singular and highly oscillatory integrals. For a large class of fractional power-like kernels, we propose a new approach based on reformulating the Fourier symbols both as coefficients of a series expansion and solutions of some simple ODE models. We then propose a hybrid algorithm that utilizes both truncated series expansions and high order Runge-Kutta ODE solvers to provide fast evaluation of Fourier symbols in both one and higher dimensional spaces. It is shown that this hybrid algorithm is robust, efficient and accurate. As applications, we combine this hybrid spectral discretization in the spatial variables and the fourth-order exponential time differencing Runge-Kutta for temporal discretization to offer high order approximations of some nonlocal gradient dynamics including nonlocal Allen-Cahn equations, nonlocal Cahn-Hilliard equations, and nonlocal phase-field crystal models. Numerical results show the accuracy and effectiveness of the fully discrete scheme and illustrate some interesting phenomena associated with the nonlocal models.

  14. Fast and accurate implementation of Fourier spectral approximations of nonlocal diffusion operators and its applications

    Energy Technology Data Exchange (ETDEWEB)

    Du, Qiang, E-mail:; Yang, Jiang, E-mail:


    This work is concerned with the Fourier spectral approximation of various integral differential equations associated with some linear nonlocal diffusion and peridynamic operators under periodic boundary conditions. For radially symmetric kernels, the nonlocal operators under consideration are diagonalizable in the Fourier space so that the main computational challenge is on the accurate and fast evaluation of their eigenvalues or Fourier symbols consisting of possibly singular and highly oscillatory integrals. For a large class of fractional power-like kernels, we propose a new approach based on reformulating the Fourier symbols both as coefficients of a series expansion and solutions of some simple ODE models. We then propose a hybrid algorithm that utilizes both truncated series expansions and high order Runge–Kutta ODE solvers to provide fast evaluation of Fourier symbols in both one and higher dimensional spaces. It is shown that this hybrid algorithm is robust, efficient and accurate. As applications, we combine this hybrid spectral discretization in the spatial variables and the fourth-order exponential time differencing Runge–Kutta for temporal discretization to offer high order approximations of some nonlocal gradient dynamics including nonlocal Allen–Cahn equations, nonlocal Cahn–Hilliard equations, and nonlocal phase-field crystal models. Numerical results show the accuracy and effectiveness of the fully discrete scheme and illustrate some interesting phenomena associated with the nonlocal models.

  15. High-speed Vibrational Imaging and Spectral Analysis of Lipid Bodies by Compound Raman Microscopy


    Slipchenko, Mikhail N.; Le, Thuc T.; Chen, Hongtao; Cheng, Ji-Xin


    Cells store excess energy in the form of cytoplasmic lipid droplets. At present, it is unclear how different types of fatty acids contribute to the formation of lipid-droplets. We describe a compound Raman microscope capable of both high-speed chemical imaging and quantitative spectral analysis on the same platform. We use a picosecond laser source to perform coherent Raman scattering imaging of a biological sample and confocal Raman spectral analysis at points of interest. The potential of t...

  16. Absolute measurement of subnanometer scale vibration of cochlear partition of an excised guinea pig cochlea using spectral-domain phase-sensitive optical coherence tomography (United States)

    Subhash, Hrebesh M.; Choudhury, Niloy; Jacques, Steven L.; Wang, Ruikang K.; Chen, Fangyi; Zha, Dingjun; Nuttall, Alfred L.


    Direct measurement of absolute vibration parameters from different locations within the mammalian organ of Corti is crucial for understanding the hearing mechanics such as how sound propagates through the cochlea and how sound stimulates the vibration of various structures of the cochlea, namely, basilar membrane (BM), recticular lamina, outer hair cells and tectorial membrane (TM). In this study we demonstrate the feasibility a modified phase-sensitive spectral domain optical coherence tomography system to provide subnanometer scale vibration information from multiple angles within the imaging beam. The system has the potential to provide depth resolved absolute vibration measurement of tissue microstructures from each of the delay-encoded vibration images with a noise floor of ~0.3nm at 200Hz.

  17. Vibrational spectral investigation on xanthine and its derivatives—theophylline, caffeine and theobromine (United States)

    Gunasekaran, S.; Sankari, G.; Ponnusamy, S.


    A normal coordinate analysis has been carried out on four compounds having a similar ring structure with different side chain substitutions, which are xanthine, caffeine, theophylline, and theobromine. Xanthine is chemically known as 2,6-dihydroxy purine. Caffeine, theophylline and theobromine are methylated xanthines. Considering the methyl groups as point mass, the number of normal modes of vibrations can be distributed as Γ vib=27 A'+12 A″ based on C s point group symmetry associated with the structures. In the present work 15 A' and 12 A″ normal modes are considered. A new set of orthonormal symmetry co-ordinates have been constructed. Wilson's F- G matrix method has been adopted for the normal coordinate analysis. A satisfactory vibrational band assignment has been made by employing the FTIR and FT Raman spectra of the compounds. The potential energy distribution is calculated with the arrived values of the force constants and hence the agreement of the frequency assignment has been checked.

  18. Soil moisture prediction of bare soil profiles using diffuse spectral reflectance information and vadose zone flow modeling

    NARCIS (Netherlands)

    Babaeian, E.; Homaee, M.; Montzka, C.; Vereecken, H.; Norouzi, A.A.; van Genuchten, M.Th.


    Soil hydraulic property information of the vadose zone is key to quantifying the temporal and spatial variability of soil moisture, and for modeling water flow and contaminant transport processes in the near surface. This study deals with exploring the feasibility of using diffuse soil spectral

  19. A Hybrid Finite Element-Fourier Spectral Method for Vibration Analysis of Structures with Elastic Boundary Conditions

    Directory of Open Access Journals (Sweden)

    Wan-You Li


    Full Text Available A novel hybrid method, which simultaneously possesses the efficiency of Fourier spectral method (FSM and the applicability of the finite element method (FEM, is presented for the vibration analysis of structures with elastic boundary conditions. The FSM, as one type of analytical approaches with excellent convergence and accuracy, is mainly limited to problems with relatively regular geometry. The purpose of the current study is to extend the FSM to problems with irregular geometry via the FEM and attempt to take full advantage of the FSM and the conventional FEM for structural vibration problems. The computational domain of general shape is divided into several subdomains firstly, some of which are represented by the FSM while the rest by the FEM. Then, fictitious springs are introduced for connecting these subdomains. Sufficient details are given to describe the development of such a hybrid method. Numerical examples of a one-dimensional Euler-Bernoulli beam and a two-dimensional rectangular plate show that the present method has good accuracy and efficiency. Further, one irregular-shaped plate which consists of one rectangular plate and one semi-circular plate also demonstrates the capability of the present method applied to irregular structures.

  20. Spectral investigations of 2,5-difluoroaniline by using mass, electronic absorption, NMR, and vibrational spectra (United States)

    Kose, Etem; Karabacak, Mehmet; Bardak, Fehmi; Atac, Ahmet


    One of the most significant aromatic amines is aniline, a primary aromatic amine replacing one hydrogen atom of a benzene molecule with an amino group (NH2). This study reports experimental and theoretical investigation of 2,5-difluoroaniline molecule (2,5-DFA) by using mass, ultraviolet-visible (UV-vis), 1H and 13C nuclear magnetic resonance (NMR), Fourier transform infrared and Raman (FT-IR and FT-Raman) spectra, and supported with theoretical calculations. Mass spectrum (MS) of 2,5-DFA is presented with their stabilities. The UV-vis spectra of the molecule are recorded in the range of 190-400 nm in water and ethanol solvents. The 1H and 13C NMR chemical shifts are recorded in CDCl3 solution. The vibrational spectra are recorded in the region 4000-400 cm-1 (FT-IR) and 4000-10 cm-1 (FT-Raman), respectively. Theoretical studies are underpinned the experimental results as described below; 2,5-DFA molecule is optimized by using B3LYP/6-311++G(d,p) basis set. The mass spectrum is evaluated and possible fragmentations are proposed based on the stable structure. The electronic properties, such as excitation energies, oscillator strengths, wavelengths, frontier molecular orbitals (FMO), HOMO and LUMO energies, are determined by time-dependent density functional theory (TD-DFT). The electrostatic potential surface (ESPs), density of state (DOS) diagrams are also prepared and evaluated. In addition to these, reduced density gradient (RDG) analysis is performed, and thermodynamic features are carried out theoretically. The NMR spectra (1H and 13C) are calculated by using the gauge-invariant atomic orbital (GIAO) method. The vibrational spectra of 2,5-DFA molecule are obtained by using DFT/B3LYP method with 6-311++G(d,p) basis set. Fundamental vibrations are assigned based on the potential energy distribution (PED) of the vibrational modes. The nonlinear optical properties (NLO) are also investigated. The theoretical and experimental results give a detailed description of

  1. Vibrational spectral investigation on xanthine and its derivatives--theophylline, caffeine and theobromine. (United States)

    Gunasekaran, S; Sankari, G; Ponnusamy, S


    A normal coordinate analysis has been carried out on four compounds having a similar ring structure with different side chain substitutions, which are xanthine, caffeine, theophylline, and theobromine. Xanthine is chemically known as 2,6-dihydroxy purine. Caffeine, theophylline and theobromine are methylated xanthines. Considering the methyl groups as point mass, the number of normal modes of vibrations can be distributed as Gamma(vib) = 27 A' + 12 A" based on C(s) point group symmetry associated with the structures. In the present work 15 A' and 12 A'' normal modes are considered. A new set of orthonormal symmetry co-ordinates have been constructed. Wilson's F-G matrix method has been adopted for the normal coordinate analysis. A satisfactory vibrational band assignment has been made by employing the FTIR and FT Raman spectra of the compounds. The potential energy distribution is calculated with the arrived values of the force constants and hence the agreement of the frequency assignment has been checked.

  2. The Microtremor H/V Spectral Ratio: The Physical Basis of the Diffuse Field Assumption (United States)

    Sanchez-Sesma, F. J.


    The microtremor H/V spectral ratio (MHVSR) is popular to obtain the dominant frequency at a site. Despite the success of MHVSR some controversy arose regarding its physical basis. One approach is the Diffuse Field Assumption, DFA. It is then assumed that noise diffuse features come from multiple scattering within the medium. According to theory, the average of the autocorrelation is proportional to directional energy density (DED) and to the imaginary part of the Green's function for same source and receiver. Then, the square of MHVSR is a ratio of DEDs which, in a horizontally layered system, is 2xImG11/ImG33, where ImG11 and ImG33 are the imaginary parts of Green's functions for horizontal and vertical components. This has physical implications that emerge from the duality DED-force, implicit in the DFA. Consider a surface force at a half-space. The radiated energy is carried away by various wave types and the proportions of each one are precisely the fractions of the energy densities of a diffuse elastic wave field at the free surface. Thus, some properties of applied forces are also characteristics of DEDs. For example, consider a Poisson solid. For a normal point load, 67 per cent of energy is carried away by Rayleigh waves. For the tangential case, it is less well known that, 77 per cent of energy goes as shear waves. In a full space, 92 per cent of the energy is emitted as shear waves. The horizontal DED at the half-space surface implies significant emission of down-going shear waves that explains the curious stair-like resonance spectrum of ImG11. Both ImG11 and ImG33 grow linearly versus frequency and this represents wave emission. For a layered medium, besides wave emission, the ensuing variations correspond to reflected waves. For high frequencies, ImG33 depends on the properties of the top layer. Reflected body waves are very small and Rayleigh waves behave in the top layer as in a kind of mini half-space. From HVSR one can invert the velocity model

  3. Composition-independent mean temperature measurements in laminar diffusion flames using spectral lineshape information (United States)

    Zelenak, D.; Narayanaswamy, V.


    Temperature is an important thermochemical property in combusting flows that holds the key to uncovering pollutant formation, flame extinction, and heat release. In a practical combustion environment, the local composition is typically unknown, which hinders the effectiveness of many traditional non-intrusive thermometry techniques. This study aims to offset this limitation by developing a laser-based thermometry technique that does not require prior knowledge of the local composition. Two methods for obtaining temperature are demonstrated in this work, both of which make use of the spectral line broadening of an absorbing species (krypton) seeded into the flow. In the first method, the local Doppler broadening is extracted from an excitation scan to yield the corresponding temperature, while the second method utilizes compositional scaling information of the collisional broadening and collisional shift to determine the temperature. Both methods are demonstrated by measuring the radial temperature profile of a steady laminar CH4/N2 diffusion flame with an air co-flow. The accuracy of the temperature measurements obtained using both methods are evaluated using corresponding temperature profiles determined from computational simulations.

  4. Fourier spectral methods for fractional-in-space reaction-diffusion equations

    KAUST Repository

    Bueno-Orovio, Alfonso


    © 2014, Springer Science+Business Media Dordrecht. Fractional differential equations are becoming increasingly used as a powerful modelling approach for understanding the many aspects of nonlocality and spatial heterogeneity. However, the numerical approximation of these models is demanding and imposes a number of computational constraints. In this paper, we introduce Fourier spectral methods as an attractive and easy-to-code alternative for the integration of fractional-in-space reaction-diffusion equations described by the fractional Laplacian in bounded rectangular domains of ℝ. The main advantages of the proposed schemes is that they yield a fully diagonal representation of the fractional operator, with increased accuracy and efficiency when compared to low-order counterparts, and a completely straightforward extension to two and three spatial dimensions. Our approach is illustrated by solving several problems of practical interest, including the fractional Allen–Cahn, FitzHugh–Nagumo and Gray–Scott models, together with an analysis of the properties of these systems in terms of the fractional power of the underlying Laplacian operator.

  5. A new information diffusion modelling technique based on vibrating string equation and its application in natural disaster risk assessment (United States)

    Bai, Cheng-Zu; Zhang, Ren; Hong, Mei; Qian, Long-xia; Wang, Zhengxin


    In this paper, to naturally fill the gap in incomplete data, a new algorithm is proposed for estimating the risk of natural disasters based on the information diffusion theory and the equation of the vibrating string. Two experiments are performed with small samples to investigate its effectiveness. Furthermore, to demonstrate the practicality of the new algorithm, it is applied to study the relationship between epicentral intensity and earthquake magnitude, with strong-motion earthquake observations measured in Yunnan Province in China. The regression model, the back-propagation neural network and the conventional information diffusion model are also involved for comparison. All results show that the new algorithm, which can unravel fuzzy information in incomplete data, is better than the main existing methods for risk estimation.

  6. Spectral Analysis of Pressure, Noise and Vibration Velocity Measurement in Cavitation (United States)

    Jablonská, Jana; Mahdal, Miroslav; Kozubková, Milada


    The article deals with experimental investigation of water cavitation in the convergent-divergent nozzle of rectangular cross-section. In practice, a quick and simple determination of cavitation is essential, especially if it is basic cavitation or cavitation generated additionally by the air being sucked. Air influences the formation, development and size of the cavity area in hydraulic elements. Removal or reduction of the cavity area is possible by structural changes of the element. In case of the cavitation with the suction air, it is necessary to find the source of the air and seal it. The pressure gradient, the flow, the oxygen content in the tank, and hence the air dissolved in the water, the air flow rate, the noise intensity and the vibration velocity on the nozzle wall were measured on laboratory equipment. From the selected measurements the frequency spectrum of the variation of the water flow of the cavity with cavitation without air saturation and with air saturation was compared and evaluated.

  7. Spectral intensities in cubic systems. I. Progressions based upon parity vibrational modes

    Energy Technology Data Exchange (ETDEWEB)

    Acevedo, R.; Vasquez, S.O. [Department of Basic Chemistry, Faculty of Physical and Mathematical Sciences, University of Chile. Tupper 2069, Casilla 2777, Santiago, Chile (Chile); Meruane, T. [Department of Chemistry, Universidad Metropolitana de Ciencias de la Educacion. Av. J.P. Alessandri 774, Casilla 147, C. Santiago, Chile (Chile); Poblete, V. [Department of Nuclear Materials, Lo Aguirre, Comision Chilena de Energia Nuclear. Amunategui 95, Casilla 188-D, Santiago, Chile (Chile); Pozo, J. [Facultad de Ciencias de la Ingenieria. Universidad Diego Portales. Casilla 298-V, Santiago, Chile (Chile)


    The well-resolved emission and absorption spectra of centrosymmetric coordination compounds of the transition metal ions have been used widely to provide the experimental data against which to test theoretical models of vibronic intensities. With reference to the {sup 2} E{sub g} {yields} {sup 4} A{sub 2g} luminescence transition, at a perfect octahedral site in Cs{sub 2}SiF{sub 6}, over than one hundred vibronic lines are observed with line widths of a few wavenumber spread over some 3000 cm{sup -1}. This paper reports a through examination of both the electronic and vibrational factors, which influences the observed vibronic intensities of the various assigned and identified lines in the spectra of the MnF{sub 6} {sup 2-} complex ion in the Cs{sub 2}SiF{sub 6} cubic lattice. The origin and nature of higher order vibronic interactions are analysed on the basis of a symmetrized vibronic crystal field-ligand polarization model. (Author)

  8. Using Fixed-Node Diffusion Monte Carlo to Probe Rotation-Vibration Coupling in Highly Fluxional Asymmetric Top Molecules (United States)

    Petit, Andrew S.; Wellen, Bethany A.; McCoy, Anne B.


    Our group has developed a fixed-node Diffusion Monte Carlo (DMC) methodology that can be used to describe rotationally excited states of highly fluxional symmetric top molecules. This technique has been thoroughly benchmarked using rotationally excited states of H_3^+, H_3O^+, and NH_3 with J≤12. Here, we report a recently developed extension of this methodology to asymmetric top molecules which undergo large amplitude, zero-point vibrational motion. The nodal surfaces used in the fixed-node DMC calculations are obtained from rigid-rotor wave functions calculated using the system's ground state vibrationally averaged rotational constants. The algorithms used to evaluate node crossing and re-crossing are generalized to account for the pronounced curvature exhibited by the nodal surfaces of asymmetric top molecules with κ ≈ 0 due to the strong mixing of two or more symmetric top basis functions. Finally, the insight that can be obtained from these calculations into the nature and strength of the vibration-rotation coupling present in highly fluxional asymmetric top molecules will be briefly discussed and further elaborated on in the following talk. A. S. Petit and A. B. McCoy, J. Phys. Chem. A 113, 12706 (2009). A. S. Petit, B. A. Wellen, and A. B. McCoy, J. Chem. Phys. 136, 074101 (2012).

  9. Intrinsic Chirality and Prochirality at Air/R-(+)- and S-(-)-Limonene Interfaces: Spectral Signatures with Interference Chiral Sum-Frequency Generation Vibrational Spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Fu, Li; Zhang, Yun; Wei, Zhehao; Wang, Hongfei


    We report in this work detailed measurements on the chiral and achiral sum-frequency vibrational spectra in the C-H stretching vibration region (2800-3050cm-1) of the air/liquid interfaces of R-limonene and S-limonene, using the recently developed high-resolution broadband sum-frequency generation vibrational spectroscopy (HR-BB-SFG-VS). The achiral SFG spectra of R-limonene and S-limonene, as well as the equal amount (50/50) racemic mixture show that the enantiomers are with the same interfacial orientations. The interference chiral SFG spectra of the limonene enantiomers exhibit spectral signature from chiral response of the Cα-H stretching mode, and spectral signature from prochiral response of the CH2 asymmetric stretching mode, respectively. The chiral spectral feature of the Cα-H stretching mode changes sign from R-limonene to S-limonene, and disappears for the 50/50 racemic mixture. While the prochiral spectral feature of the CH2 asymmetric stretching mode is the same for R-limonene and S-limonene, and also surprisingly remains the same for the 50/50 racemic mixture. These results provided detail information in understanding the structure and chirality of molecular interfaces, and demonstrated the sensitivity and potential of SFG-VS as unique spectroscopic tool for chirality characterization and chiral recognition at the molecular interface.

  10. SAFARI 2000 AERONET-derived Diffuse Spectral Irradiance for Eight Core Sites (United States)

    National Aeronautics and Space Administration — ABSTRACT: This data set contains monthly mean values of diffuse irradiance fraction [f(Ediff), or ratio of diffuse-to-total irradiance] at ground level for a...

  11. SAFARI 2000 AERONET-derived Diffuse Spectral Irradiance for Eight Core Sites (United States)

    National Aeronautics and Space Administration — This data set contains monthly mean values of diffuse irradiance fraction [f(Ediff), or ratio of diffuse-to-total irradiance] at ground level for a 30-degree solar...

  12. Spectral shape of a signal in light-induced diffusive pulling (pushing) of particles into a light beam

    Energy Technology Data Exchange (ETDEWEB)

    Parkhomenko, A I; Shalagin, A M [Institute of Automation and Electrometry, Siberian Branch of the Russian Academy of Sciences, Novosibirsk (Russian Federation)


    We study theoretically how the dependences of transport collision frequencies ν{sub i}, collision broadening γ and collision shift Δ of the levels on the velocity v of resonant particles influence lightinduced diffusive pulling (pushing) (LDP) effects in the framework of a generalised model of strong collisions in the case of velocitydependent collision rates (so-called kangaroo model). It is found that allowance for the dependences ν{sub i}(v), γ(v) and Δ(v) does not change the spectral shape of an LDP signal. In particular, in the case of low-intensity radiation, the spectral dependence of the LDP signal coincides with the absorption line shape. It is shown that the magnitude of the LDP effect is proportional to the difference between the diffusion coefficients of particles in the excited and ground states. It is found that the spectral anomalies previously predicted in the LDP effect [Gel'mukhanov F.Kh. JETP Lett., 55, 214 (1992)] for an idealised model of the Lorentz gas (the limiting case of heavy buffer particles), which arise due to the dependences ν{sub i}(v), γ(v) and Δ(v), are typical only for this gas. At a realistic ratio of the masses of absorbing and buffer particles, spectral anomalies do not occur in the LDP effect. (nonlinear optical phenomena)

  13. A spectral dynamic stiffness method for free vibration analysis of plane elastodynamic problems (United States)

    Liu, X.; Banerjee, J. R.


    A highly efficient and accurate analytical spectral dynamic stiffness (SDS) method for modal analysis of plane elastodynamic problems based on both plane stress and plane strain assumptions is presented in this paper. First, the general solution satisfying the governing differential equation exactly is derived by applying two types of one-dimensional modified Fourier series. Then the SDS matrix for an element is formulated symbolically using the general solution. The SDS matrices are assembled directly in a similar way to that of the finite element method, demonstrating the method's capability to model complex structures. Any arbitrary boundary conditions are represented accurately in the form of the modified Fourier series. The Wittrick-Williams algorithm is then used as the solution technique where the mode count problem (J0) of a fully-clamped element is resolved. The proposed method gives highly accurate solutions with remarkable computational efficiency, covering low, medium and high frequency ranges. The method is applied to both plane stress and plane strain problems with simple as well as complex geometries. All results from the theory in this paper are accurate up to the last figures quoted to serve as benchmarks.

  14. Spectral methods for study of the G-protein-coupled receptor rhodopsin: I. Vibrational and electronic spectroscopy (United States)

    Struts, A. V.; Barmasov, A. V.; Brown, M. F.


    Here we review the application of modern spectral methods for the study of G-protein-coupled receptors (GPCRs) using rhodopsin as a prototype. Because X-ray analysis gives us immobile snapshots of protein conformations, it is imperative to apply spectroscopic methods for elucidating their function: vibrational (Raman, FTIR), electronic (UV-visible absorption, fluorescence) spectroscopies, and magnetic resonance (electron paramagnetic resonance, EPR), and nuclear magnetic resonance (NMR). In the first of the two companion articles, we discuss the application of optical spectroscopy for studying rhodopsin in a membrane environment. Information is obtained regarding the time-ordered sequence of events in rhodopsin activation. Isomerization of the chromophore and deprotonation of the retinal Schiff base leads to a structural change of the protein involving the motion of helices H5 and H6 in a pH-dependent process. Information is obtained that is unavailable from X-ray crystallography, which can be combined with spectroscopic studies to achieve a more complete understanding of GPCR function.

  15. Nonlinear analysis of a two-degree-of-freedom vibration energy harvester using high order spectral analysis techniques (United States)

    Nico, V.; Frizzell, R.; Punch, J.


    Conventional vibration energy harvesters are generally based on linear mass-spring oscillator models. Major limitations with common designs are their narrow bandwidths and the increase of resonant frequency as the device is scaled down. To overcome these problems, a two-degree-of-freedom nonlinear velocity-amplified energy harvester has been developed. The device comprises two masses, oscillating one inside the other, between four sets of nonlinear magnetic springs. Impacts between the masses allow momentum transfer from the heavier mass to the lighter, providing velocity amplification. This paper studies the nonlinear effects introduced by the presence of magnetic springs, using high order spectral analysis techniques on experimental and simulated data obtained for a range of excitation levels and magnetic spring configurations, which enabled the effective spring constant to be varied. Standard power spectrum analysis only provide limited information on the response of nonlinear systems. Instead, bispectral analysis is used here to provide deeper insight of the complex dynamics of the nonlinear velocity-amplified energy harvester. The analysis allows identification of period-doubling and couplings between modes that could be used to choose geometrical parameters to enhance the bandwidth of the device.

  16. Vibrational sum frequency spectroscopy studies at solid/liquid interfaces : Influence of the experimental geometry in the spectral shape and enhancement


    Liljeblad, Jonathan F.D.; Tyrode, Eric


    The influence of the experimental geometry, specifically the angles of incidence (AOI) of the exciting beams, on the enhancement of the vibrational sum frequency spectroscopy (VSFS) spectra has been systematically investigated, particularly when approaching total internal reflection (TIR) conditions. Theoretical simulations of the spectral intensity as a function of the AOI and infrared wavelength at three different polarization combinations were critically compared to experimental data obtai...

  17. Path-length-resolved diffusive particle dynamics in spectral-domain optical coherence tomography. (United States)

    Kalkman, J; Sprik, R; van Leeuwen, T G


    We describe a new method to measure the decorrelation rate of the optical coherence tomography (OCT) magnitude simultaneously in space and time. We measure the decorrelation rate of the OCT magnitude in a Fourier-domain OCT system for a large range of translational diffusion coefficients by varying the sphere diameter. The described method uses the sensitivity advantage of Fourier-domain OCT over time-domain OCT to increase the particle diffusion imaging speed by a factor of 200. By coherent gating, we reduce the contribution of multiple scattering to the detected signal, allowing a quantitative study of diffusive particle dynamics in high concentration samples. We demonstrate that this technique is well suited to image diffusive particle dynamics in samples with a complex geometry as we measure the morphology and diffusive particle dynamics simultaneously with both high spatial and high temporal resolution.

  18. Impact of blood volume changes within the human skin on the diffuse reflectance measurements in visible and NIR spectral ranges (United States)

    Zherebtsov, Evgeny; Bykov, Alexander; Popov, Alexey; Doronin, Alexander; Meglinski, Igor


    We consider changes in the volume of blood and oxygen saturation caused by a pulse wave and their influence on the diffuse reflectance spectra in the visible/NIR spectral range. CUDA-based Monte-Carlo model was used for routine simulation of detector depth sensitivity (sampling volume) and skin spectra, and their variations associated with physiological changes in the human skin. The results presented in the form of animated graphs of sampling volume changes for scaling of the parameters of the main human skin layers related to the results of experimental measurements are of particular interest for pulse oximetry, photoplethysmography, Doppler flowmetry, reflectance spectroscopy.

  19. Spectral diffuse reflectance and autofluorescence imaging can perform early prediction of blood vessel occlusion in skin flaps. (United States)

    Chen, Shuo; Zhu, Caigang; Hoe-Kong Chui, Christopher; Sheoran, Gyanendra; Tan, Bien-Keem; Liu, Quan


    Flap transfer has become a common technique in reconstructive surgery. However, a significant number of compromised skin flaps are not successfully salvaged because the current clinical method for flap assessment relies heavily on the clinician's experience. Vascular occlusion is the major reason for flap failure, thus the accurate and objective early prediction of blood vessel occlusion is vitally important. Our parallel point measurement study has demonstrated the great potential of joint diffuse reflectance and autofluorescence spectroscopy in the early detection and differentiation of venous and arterial occlusion in skin flaps. Unfortunately, the technique of point measurements is not suitable to examine a large skin flap when a high spatial resolution is required. In this study, we attempted to overcome this problem by performing spectral diffuse reflectance and autofluorescence imaging on a rat skin flap model. Both imaging data and reconstructed spectra were used to statistically differentiate control flaps, arterially occluded flaps and venously occluded flaps. Our preliminary results suggest that the technique of joint diffuse reflectance and autofluorescence spectroscopic imaging can achieve high classification accuracy thus could be used to detect and differentiate flaps with venous and arterial occlusion accurately at an early time point in a large skin flap. Typical reconstructed spectra of (a) diffuse reflectance and (b) autofluorescence after normalization. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  20. Acoustic vibrations contribute to the diffuse scatter produced by ribosome crystals

    Energy Technology Data Exchange (ETDEWEB)

    Polikanov, Yury S.; Moore, Peter B.


    The diffuse scattering pattern produced by frozen crystals of the 70S ribosome fromThermus thermophilusis as highly structured as it would be if it resulted entirely from domain-scale motions within these particles. However, the qualitative properties of the scattering pattern suggest that acoustic displacements of the crystal lattice make a major contribution to it.

  1. A variational multi-scale method with spectral approximation of the sub-scales: Application to the 1D advection-diffusion equations

    KAUST Repository

    Chacón Rebollo, Tomás


    This paper introduces a variational multi-scale method where the sub-grid scales are computed by spectral approximations. It is based upon an extension of the spectral theorem to non necessarily self-adjoint elliptic operators that have an associated base of eigenfunctions which are orthonormal in weighted L2 spaces. This allows to element-wise calculate the sub-grid scales by means of the associated spectral expansion. We propose a feasible VMS-spectral method by truncation of this spectral expansion to a finite number of modes. We apply this general framework to the convection-diffusion equation, by analytically computing the family of eigenfunctions. We perform a convergence and error analysis. We also present some numerical tests that show the stability of the method for an odd number of spectral modes, and an improvement of accuracy in the large resolved scales, due to the adding of the sub-grid spectral scales.

  2. Spectral Dependent Degradation of the Solar Diffuser on Suomi-NPP VIIRS Due to Surface Roughness-Induced Rayleigh Scattering

    Directory of Open Access Journals (Sweden)

    Xi Shao


    Full Text Available The Visible Infrared Imaging Radiometer Suite (VIIRS onboard Suomi National Polar Orbiting Partnership (SNPP uses a solar diffuser (SD as its radiometric calibrator for the reflective solar band calibration. The SD is made of Spectralon™ (one type of fluoropolymer and was chosen because of its controlled reflectance in the Visible/Near-Infrared/Shortwave-Infrared region and its near-Lambertian reflectance property. On-orbit changes in VIIRS SD reflectance as monitored by the Solar Diffuser Stability Monitor showed faster degradation of SD reflectance for 0.4 to 0.6 µm channels than the longer wavelength channels. Analysis of VIIRS SD reflectance data show that the spectral dependent degradation of SD reflectance in short wavelength can be explained with a SD Surface Roughness (length scale << wavelength based Rayleigh Scattering (SRRS model due to exposure to solar UV radiation and energetic particles. The characteristic length parameter of the SD surface roughness is derived from the long term reflectance data of the VIIRS SD and it changes at approximately the tens of nanometers level over the operational period of VIIRS. This estimated roughness length scale is consistent with the experimental result from radiation exposure of a fluoropolymer sample and validates the applicability of the Rayleigh scattering-based model. The model is also applicable to explaining the spectral dependent degradation of the SDs on other satellites. This novel approach allows us to better understand the physical processes of the SD degradation, and is complementary to previous mathematics based models.

  3. Spatiotemporal patterns in reaction-diffusion system and in a vibrated granular bed

    Energy Technology Data Exchange (ETDEWEB)

    Swinney, H.L.; Lee, K.J.; McCormick, W.D. [Univ. of Texas, Austin, TX (United States)


    Experiments on a quasi-two-dimensional reaction-diffusion system reveal transitions from a uniform state to stationary hexagonal, striped, and rhombic spatial patterns. For other reactor conditions lamellae and self-replicating spot patterns are observed. These patterns form in continuously fed thin gel reactors that can be maintained indefinitely in well-defined nonequilibrium states. Reaction-diffusion models with two chemical species yield patterns similar to those observed in the experiments. Pattern formation is also being examined in vertically oscillated thin granular layers (typically 3-30 particle diameters deep). For small acceleration amplitudes, a granular layer is flat, but above a well-defined critical acceleration amplitude, spatial patterns spontaneously form. Disordered time-dependent granular patterns are observed as well as regular patterns of squares, stripes, and hexagons. A one-dimensional model consisting of a completely inelastic ball colliding with a sinusoidally oscillating platform provides a semi-quantitative description of most of the observed bifurcations between the different spatiotemporal regimes.

  4. Path-length-resolved diffusive particle dynamics in spectral-domain optical coherence tomography

    NARCIS (Netherlands)

    Kalkman, J.; Sprik, R.; van Leeuwen, T.G.


    We describe a new method to measure the decorrelation rate of the optical coherence tomography (OCT) magnitude simultaneously in space and time. We measure the decorrelation rate of the OCT magnitude in a Fourier-domain OCT system for a large range of translational diffusion coefficients by varying

  5. Spectral features of the diffusive shock acceleration of electrons at the termination shock (United States)

    Prinsloo, Phillip; Toit Strauss, Du; Potgieter, Marius


    Following the revelation that the source of the anomalous cosmic rays was, contrary to expectation, not located at the termination shock, the diffusive shock acceleration mechanism came under increased criticism. With regards to galactic cosmic rays, however, its involvement in their re-acceleration is less disputed, but the extent of this involvement had to be reaffirmed given the new parameter constraints provided by the Voyager spacecraft. Hence, the features of diffusive shock acceleration, studied in the context of the transport of galactic electrons, are investigated using a numerical cosmic-ray modulation model that makes provision for the effects of this acceleration mechanism. The imprint of diffusive shock acceleration on the energy distributions of galactic electrons arriving at the termination shock is studied, along with the interplay between this acceleration mechanism and transport processes such as drift and diffusion. An important overarching set of results is that if the energy distribution of electrons incident at the termination shock is softer than the power law associated with the shock compression ratio, the latter is adopted by the accelerated particles, while if the converse is true, the incident distribution's intensity is raised uniformly. This intensity increase is in turn dependent on how similar the incident spectrum is to the power law associated with the compression ratio. The influence of other transport processes on cosmic-ray re-acceleration hence hinges on how they alter energy distributions incident at the termination shock.

  6. Spectral Analysis and Computation of Effective Diffusivities for Steady Random Flows (United States)


    Such methods have been extended to steady flows where particles diffuse according to linear collisions [42], solute transport in porous media [8...application to solute transport in porous media . Ann. Appl. Probab., 9(4):951–1020, 1999. [9] L. Biferale, A. Crisanti, M. Vergassola, and A. Vulpiani. Eddy...and M. G. Forest. An anelastic, scale-separated model for mixing, with application to atmospheric transport phenomena . Phys. Fluids, 11(4):880–892

  7. The Soleil View on Prototypical Organic Nitriles: Selected Vibrational Modes of Ethyl Cyanide, C_2H_5CN, and Spectroscopic Analysis Using AN Automated Spectral Assignment Procedure (asap) (United States)

    Endres, Christian; Caselli, Paola; Martin-Drumel, Marie-Aline; McCarthy, Michael C.; Pirali, Olivier; Wehres, Nadine; Schlemmer, Stephan; Thorwirth, Sven


    Vibrational spectra of small organic nitriles, propionitrile and n-butyronitrile, have been investigated at high spectral resolution at the French national synchroton facility SOLEIL using Fourier-transform far-infrared spectroscopy (< 700 cm-1). The Automated Spectral Assignment Procedure (ASAP) has been used for line assignement and accurate determination of rotational level energies, in particular, of the ν20=1 and the ν12=1 states of propionitrile. The analysis does not only confirm the applicability of the ASAP in the treatment of (dense) high-resolution infrared spectra but also reveals some of its limitations which will be discussed in some detail. M. A. Martin-Drumel, C. P. Endres, O. Zingsheim, T. Salomon, J. van Wijngaarden, O. Pirali, S. Gruet, F. Lewen, S. Schlemmer, M. C. McCarthy, and S. Thorwirth 2015, J. Mol. Spectrosc. 315, 72

  8. Finite difference/spectral approximations for the distributed order time fractional reaction-diffusion equation on an unbounded domain (United States)

    Chen, Hu; Lü, Shujuan; Chen, Wenping


    The numerical approximation of the distributed order time fractional reaction-diffusion equation on a semi-infinite spatial domain is discussed in this paper. A fully discrete scheme based on finite difference method in time and spectral approximation using Laguerre functions in space is proposed. The scheme is unconditionally stable and convergent with order O (τ2 + Δα2 +N (1 - m) / 2), where τ, Δα, N, and m are the time-step size, step size in distributed-order variable, polynomial degree, and regularity in the space variable of the exact solution, respectively. A pseudospectral scheme is also proposed and analyzed. Some numerical examples are presented to demonstrate the efficiency of the proposed scheme.

  9. Spectral statistics in damped systems: Diffuse field decay curvature for materials characterization

    Energy Technology Data Exchange (ETDEWEB)

    Burkhardt, J. [Department of Engineering, Purdue University at Fort Wayne, 2101 Coliseum Boulevard East, Fort Wayne, Indiana 46805-1499 (United States)


    A new nondestructive technique is proposed which exploits the unique decay characteristics of diffuse fields in nonproportionally damped systems. A power-law decay model is derived and advanced as the basis for the inverse estimation of both the strength and spatial extent of the dissipative region in nonproportionally damped systems. In materials where mechanical damage results in increased internal friction, a common effect in many engineering metals, this technique is proposed as a nondestructive technique for characterizing such damage. The results of numerical experiments on nonproportionally damped acoustic systems are presented which support the proposed technique. {copyright} {ital 1997 Acoustical Society of America.}

  10. Vibrational spectral investigation, NBO, first hyperpolarizability and UV-Vis spectral analysis of 3,5-dichlorobenzonitrile and m-bromobenzonitrile by ab initio and density functional theory methods. (United States)

    Senthil kumar, J; Jeyavijayan, S; Arivazhagan, M


    The FT-IR and FT-Raman spectra of 3,5-dichlorobenzonitrile and m-bromobenzonitrile have been recorded in the region 4000-400 cm(-1) and 3500-50 cm(-1), respectively. The optimized geometry, wave numbers and intensity of vibrational bonds of title molecules are obtained by ab initio and DFT level of theory with complete relaxation in the potential energy surface using 6-311++G(d, p) basis set. A complete vibrational assignments aided by the theoretical harmonic frequency, analysis have been proposed. The harmonic vibrational frequencies calculated have been compared with experimental FT-IR and FT-Raman spectra. The observed and calculated frequencies are found to be in good agreement. Stability of the molecule arising from hyperconjugative interactions, charge delocalization have been analyzed using natural bond orbital (NBO) analysis. The UV-Vis spectral analysis of the molecules has also been done which confirms the charge transfer of the molecules. Furthermore, the first hyperpolarizability and total dipole moment of the molecules have been calculated. Copyright © 2014 Elsevier B.V. All rights reserved.

  11. Spectral ratios of ambient noise based on the diffuse field theory: Improved inversion of H/V in layered media using analytical properties of Green functions (United States)

    Sanchez-Sesma, F. J.; Perton, M.; Piña, J.; Luzón, F.; Garcia-Jerez, A.; Rodriguez-Castellanos, A.


    It is well know the popularity of H/V spectral ratio to extract the dominant frequency of soil sites for microzonation studies (Nakamura, 1989). It is relatively easy to make measurements as only one station is needed. Despite its success, this approach had not solid theoretical basis until a proposal to link ambient noise vibrations with diffuse field theory was made (Sánchez-Sesma et al, 2011a). Based on this theory the average spectral density of a given motion of a point, also called directional energy density (Perton et al, 2009), is proportional to the imaginary part of Green function precisely at the observation point. The proportionality implies that vector components are all multiplied by the current spectral level of the diffuse illumination. Appropriate normalization is crucial to make the experimental spectral ratios closer to the theoretical counterpart. According to this theory the square of H/V is twice the ratio of ImG11 and ImG33, where ImG11 and ImG33 are the imaginary part of Green functions at the load point for horizontal and vertical components, respectively. From ImG11 it could be possible through Fourier analysis to extract pseudo reflections and thus constrain the inversion of soil profile. We propose to assess ImG11 removing the influence of illumination spectrum using the H/V spectral ratio and an estimate of ImG33 (obtained from a priori model) by means of ImG11=0.5(H/V)2*ImG33. It has been found that ImG33 is less sensitive to details of stratigraphy. In fact, the most relevant property is the Poisson ratio of the uppermost layer which controls the slope in high frequency (Sánchez-Sesma et al, 2011b). Pseudo-reflection seismograms are thus obtained from Fourier transform, back to time domain, of i{ImG11-ImG11HSS}, where ImG11HSS is the imaginary part of Green functions at the load point for horizontal load at the surface of a half-space with the properties of the uppermost layer. With the obtained model ImG33 can be updated and the

  12. Spectral analysis, vibrational assignments, NBO analysis, NMR, UV-Vis, hyperpolarizability analysis of 2-aminofluorene by density functional theory. (United States)

    Jone Pradeepa, S; Sundaraganesan, N


    In this present investigation, the collective experimental and theoretical study on molecular structure, vibrational analysis and NBO analysis has been reported for 2-aminofluorene. FT-IR spectrum was recorded in the range 4000-400 cm(-1). FT-Raman spectrum was recorded in the range 4000-50 cm(-1). The molecular geometry, vibrational spectra, and natural bond orbital analysis (NBO) were calculated for 2-aminofluorene using Density Functional Theory (DFT) based on B3LYP/6-31G(d,p) model chemistry. (13)C and (1)H NMR chemical shifts of 2-aminofluorene were calculated using GIAO method. The computed vibrational and NMR spectra were compared with the experimental results. The total energy distribution (TED) was derived to deepen the understanding of different modes of vibrations contributed by respective wavenumber. The experimental UV-Vis spectra was recorded in the region of 400-200 nm and correlated with simulated spectra by suitably solvated B3LYP/6-31G(d,p) model. The HOMO-LUMO energies were measured with time dependent DFT approach. The nonlinearity of the title compound was confirmed by hyperpolarizabilty examination. Using theoretical calculation Molecular Electrostatic Potential (MEP) was investigated. Copyright © 2014 Elsevier B.V. All rights reserved.

  13. Atropisomerism at C ̶ N bonds: Structural conformations and vibrational spectral study of Iminothiazoline Derivatives with density functional theoretical optimizations

    Directory of Open Access Journals (Sweden)



    Full Text Available The isolation of the pair atropisomers of the both iminothiazoline derivatives and the spectroscopic analytical of the compound have been computed using B3LYP/6-31G(d,p level to derive the equilibrium geometry, conformational stability, molecular orbital energies and vibrational frequencies was studied in this paper.

  14. In vivo inflammation mapping of periodontal disease based on diffuse reflectance spectral imaging: a clinical study (United States)

    Prasanth, Chandra Sekhar; Betsy, Joseph; Jayanthi, Jayaraj L.; Nisha, Unni G.; Prasantila, Janam; Subhash, Narayanan


    Since conventional techniques using periodontal probes have inherent drawbacks in the diagnosis of different grades of gingival inflammation, development of noninvasive screening devices becomes significant. Diffuse reflectance (DR) spectra recorded with white light illumination is utilized to detect periodontal inflammation from the oxygenated hemoglobin absorption ratio R620/R575. A multispectral imaging system is utilized to record narrow-band DR images at 575 and 620 nm from the anterior sextant of the gingivia of 15 healthy volunteers and 25 patients (N=40). An experienced periodontist assesses the level of gingival inflammation at each site through periodontal probing and assigns diagnosis as healthy, mild, moderate, or severe inflammation. The DR image ratio R620/R575 computed for each pixel (8-μm resolution) from the monochrome images is pseudo-color-mapped to identify gingival inflammation sites. The DR image ratio values at each site are compared with clinical diagnosis to estimate the specificity and sensitivity of the DR imaging technique in inflammation mapping. The high diagnostic accuracy is utilized to detect underlying inflammation in six patients with a previous history of periodontitis.

  15. Diffusion


    Gierl, Heribert


    Diffusion. - In: Handwörterbuch des Marketing / hrsg. von Bruno Tietz ... - 2., völlig neu gestalt. Aufl. - Stuttgart : Schäffer-Poeschel, 1995. - S. 469-477. - (Enzyklopädie der Betriebswirtschaftslehre ; 4)

  16. Experimental Raman and IR spectral and theoretical studies of vibrational spectrum and molecular structure of Pantothenic acid (vitamin B5) (United States)

    Srivastava, Mayuri; Singh, N. P.; Yadav, R. A.


    Vibrational spectrum of Pantothenic acid has been investigated using experimental IR and Raman spectroscopies and density functional theory methods available with the Gaussian 09 software. Vibrational assignments of the observed IR and Raman bands have been proposed in light of the results obtained from computations. In order to assign the observed IR and Raman frequencies the potential energy distributions (PEDs) have also been computed using GAR2PED software. Optimized geometrical parameters suggest that the overall symmetry of the molecule is C1. The molecule is found to possess eight conformations. Conformational analysis was carried out to obtain the most stable configuration of the molecule. In the present paper the vibrational features of the lowest energy conformer C-I have been studied. The two methyl groups have slightly distorted symmetries from C3V. The acidic Osbnd H bond is found to be the smallest one. To investigate molecular stability and bond strength we have used natural bond orbital analysis (NBO). Charge transfer occurs in the molecule have been shown by the calculated highest occupied molecular orbital-lowest unoccupied molecular orbital (HOMO-LUMO) energies. The mapping of electron density iso-surface with electrostatic potential (ESP), has been carried out to get the information about the size, shape, charge density distribution and site of chemical reactivity of the molecule.

  17. A Spectral Finite Element Model for Vibration Analysis of a Beam Based on General Higher-Order Theory

    Directory of Open Access Journals (Sweden)

    Jiao Sujuan


    Full Text Available The spectral element matrix is derived for a straight and uniform beam element having an arbitrary cross-section. The general higher-order beam theory is used, which accurately accounts for the transverse shear deformation out of the cross-sectional plane and antielastic-type deformation within the cross-sectional plane. Two coupled equations of motion are derived by use of Hamilton's principle along with the full three-dimensional constitutive relations. The theoretical expressions of the spectral element matrix are formulated from the exact solutions of the coupled governing equations. The developed spectral element matrix is directly applied to calculate the exact natural frequencies and mode shapes of the illustrative examples. Numerical results of the thick isotropic beams with rectangular and elliptical cross-sections are presented for a wide variety of cross-section aspect ratios.

  18. Sum frequency generation vibrational spectroscopy (SFG-VS) for complex molecular surfaces and interfaces: Spectral lineshape measurement and analysis plus some controversial issues

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Hong-Fei


    Sum-frequency generation vibrational spectroscopy (SFG-VS) was first developed in the 1980s and it has been proven a uniquely sensitive and surface/interface selective spectroscopic probe for characterization of the structure, conformation and dynamics of molecular surfaces and interfaces. In recent years, there has been significant progress in the development of methodology and instrumentation in the SFG-VS toolbox that has significantly broadened the application to complex molecular surfaces and interfaces. In this review, after presenting a unified view on the theory and methodology focusing on the SFG-VS spectral lineshape, as well as the new opportunities in SFG-VS applications with such developments, some of the controversial issues that have been puzzling the community are to be discussed. The aim of this review is to present to the researchers and students interested in molecular surfaces and interfacial sciences up-to-date perspectives complementary to the existing textbooks and reviews on SFG-VS.

  19. Spectral assignment and orientational analysis in a vibrational sum frequency generation study of DPPC monolayers at the air/water interface. (United States)

    Feng, Rong-Juan; Li, Xia; Zhang, Zhen; Lu, Zhou; Guo, Yuan


    The interfacial behavior of the benchmark zwitterionic phospholipid molecule dipalmitoylphosphatidylcholine (DPPC) has been extensively investigated by surface-selective vibrational sum frequency generation spectroscopy (VSFG). However, there is still a lack of agreement between various orientational measurements of phospholipid monolayers at the air/water interface, mainly because of the difficulty in assigning congested VSFG features. In this study, polarization-dependent VSFG measurements reveal a frequency shift between the in-plane and out-of-plane antisymmetric stretching modes of the terminal methyl groups in the DPPC alkyl tails, favoring the model of Cs local symmetry rather than the previously assumed C3v symmetry. Further VSFG experiments of isotopically labeled DPPC successfully capture the vibrational signatures of the glycerol backbone. With the newly derived VSFG polarization selection rules for Cs symmetry and the refreshed spectral assignments, the average tilt angles of the alkyl tail groups, choline headgroup, and glycerol backbone of DPPC molecules can all be determined, showing the powerful capability of VSFG spectroscopy in revealing the structural details at interfaces. The VSFG polarization dependence rules and the orientational analysis procedures developed for Cs symmetry in this work are applicable to other bulky molecules in which the methyl group cannot freely rotate, and they therefore have general applications in future VSFG studies.

  20. A computer code for forward calculation and inversion of the H/V spectral ratio under the diffuse field assumption (United States)

    García-Jerez, Antonio; Piña-Flores, José; Sánchez-Sesma, Francisco J.; Luzón, Francisco; Perton, Mathieu


    During a quarter of a century, the main characteristics of the horizontal-to-vertical spectral ratio of ambient noise HVSRN have been extensively used for site effect assessment. In spite of the uncertainties about the optimum theoretical model to describe these observations, over the last decade several schemes for inversion of the full HVSRN curve for near surface surveying have been developed. In this work, a computer code for forward calculation of H/V spectra based on the diffuse field assumption (DFA) is presented and tested. It takes advantage of the recently stated connection between the HVSRN and the elastodynamic Green's function which arises from the ambient noise interferometry theory. The algorithm allows for (1) a natural calculation of the Green's functions imaginary parts by using suitable contour integrals in the complex wavenumber plane, and (2) separate calculation of the contributions of Rayleigh, Love, P-SV and SH waves as well. The stability of the algorithm at high frequencies is preserved by means of an adaptation of the Wang's orthonormalization method to the calculation of dispersion curves, surface-waves medium responses and contributions of body waves. This code has been combined with a variety of inversion methods to make up a powerful tool for passive seismic surveying.

  1. A computer code for forward calculation and inversion of the H/V spectral ratio under the diffuse field assumption

    CERN Document Server

    García-Jerez, Antonio; Sánchez-Sesma, Francisco J; Luzón, Francisco; Perton, Mathieu


    During a quarter of a century, the main characteristics of the horizontal-to-vertical spectral ratio of ambient noise HVSRN have been extensively used for site effect assessment. In spite of the uncertainties about the optimum theoretical model to describe these observations, several schemes for inversion of the full HVSRN curve for near surface surveying have been developed over the last decade. In this work, a computer code for forward calculation of H/V spectra based on the diffuse field assumption (DFA) is presented and tested.It takes advantage of the recently stated connection between the HVSRN and the elastodynamic Green's function which arises from the ambient noise interferometry theory. The algorithm allows for (1) a natural calculation of the Green's functions imaginary parts by using suitable contour integrals in the complex wavenumber plane, and (2) separate calculation of the contributions of Rayleigh, Love, P-SV and SH waves as well. The stability of the algorithm at high frequencies is preserv...

  2. Modeling and inversion of the microtremor H/ V spectral ratio: physical basis behind the diffuse field approach (United States)

    Sánchez-Sesma, Francisco J.


    Microtremor H/ V spectral ratio (MHVSR) has gained popularity to assess the dominant frequency of soil sites. It requires measurement of ground motion due to seismic ambient noise at a site and a relatively simple processing. Theory asserts that the ensemble average of the autocorrelation of motion components belonging to a diffuse field at a given receiver gives the directional energy densities (DEDs) which are proportional to the imaginary parts of the Green's function components when both source and receiver are the same point and the directions of force and response coincide. Therefore, the MHVSR can be modeled as the square root of 2 × Im G 11/Im G 33, where Im G 11 and Im G 33 are the imaginary parts of Green's functions at the load point for the horizontal (sub-index 1) and vertical (sub-index 3) components, respectively. This connection has physical implications that emerge from the duality DED force and allows understanding the behavior of the MHVSR. For a given model, the imaginary parts of the Green's functions are integrals along a radial wavenumber. To deal with these integrals, we have used either the popular discrete wavenumber method or the Cauchy's residue theorem at the poles that account for surface waves normal modes giving the contributions due to Rayleigh and Love waves. For the retrieval of the velocity structure, one can minimize the weighted differences between observations and calculated values using the strategy of an inversion scheme. In this research, we used simulated annealing but other optimization techniques can be used as well. This last approach allows computing separately the contributions of different wave types. An example is presented for the mouth of Andarax River at Almería, Spain. [Figure not available: see fulltext.

  3. The inversion of spectral ratio H/V in a layered system using the diffuse field assumption (DFA) (United States)

    Piña-Flores, José; Perton, Mathieu; García-Jerez, Antonio; Carmona, Enrique; Luzón, Francisco; Molina-Villegas, Juan C.; Sánchez-Sesma, Francisco J.


    In order to evaluate the site effects on seismic ground motion and establish preventive measures to mitigate these effects, the dynamic characterization of sites is mandatory. Among the various geophysical tools aimed to this end, the horizontal to vertical spectral ratio (H/V) is a simple way to assess the dominant frequency of a site from seismic ambient noise. The aim of this communication is contributing to enhance the potential of this measurement with a novel method that allows extracting from the H/V the elastic properties of the subsoil, assumed here as a multilayer medium. For that purpose, we adopt the diffuse field assumption from both the experimental and the modelling perspectives. At the experimental end, the idea is to define general criteria that make the data processing closely supported by theory. On the modelling front, the challenge is to compute efficiently the imaginary part of Green's function. The Cauchy's residue theory in the horizontal wavenumber complex plane is the selected approach. This method allows both identifying the contributions of body and surface waves and computing them separately. This permits exploring the theoretical properties of the H/V under different compositions of the seismic ambient noise. This answers some questions that historically aroused and gives new insights into the H/V method. The efficient forward calculation is the prime ingredient of an inversion scheme based on both gradient and heuristic searches. The availability of efficient forward calculation of H/V allows exploring some relevant relationships between the H/V curves and the parameters. This allows generating useful criteria to speed up inversion. As in many inverse problems, the non-uniqueness issues also emerge here. A joint inversion method that considers also the dispersion curves of surface waves extracted from seismic ambient noise is presented and applied to experimental data. This joint scheme mitigates effectively the non-uniqueness.

  4. Synthesis, XRD single crystal structure analysis, vibrational spectral analysis, molecular dynamics and molecular docking studies of 2-(3-methoxy-4-hydroxyphenyl) benzothiazole (United States)

    Sarau Devi, A.; Aswathy, V. V.; Sheena Mary, Y.; Yohannan Panicker, C.; Armaković, Stevan; Armaković, Sanja J.; Ravindran, Reena; Van Alsenoy, C.


    The vibrational spectra and corresponding vibrational assignments of 2-(3-methoxy-4-hydroxyphenyl)benzothiazole is reported. Single crystal XRD data of the title compound is reported and the orientation of methoxy group is cis to nitrogen atom of the thiazole ring. The phenyl ring breathing modes of the title compound are assigned at 1042 and 731 cm-1 theoretically. The charge transfer within the molecule is studied using frontier molecular orbital analysis. The chemical reactivity descriptors are calculated theoretically. The NMR spectral data predicted theoretically are in good agreement with the experimental data. The strong negative region spread over the phenyl rings, nitrogen atom and oxygen atom of the hydroxyl group in the MEP plot is due to the immense conjugative and hyper conjugative resonance charge delocalization of π-electrons. Molecule sites prone to electrophilic attacks have been determined by analysis of ALIE surfaces, while Fukui functions provided further insight into the local reactivity properties of title molecule. Autoxidation properties have been investigated by calculation of bond dissociation energies (BDEs) of hydrogen abstraction, while BDEs of the rest of the single acyclic bonds were valuable for the further investigation of degradation properties. Calculation of radial distribution functions was performed in order to determine which atoms of the title molecule have pronounced interactions with water molecules. The title compound forms a stable complex with aryl hydrocarbon receptor and can be a lead compound for developing new anti-tumor drug. Antimicrobial properties of the title compound was screened against one bacterial culture Escherchia coli and four fungal cultures viz., Aspergillus niger, Pencillum chrysogenum, Saccharomyces cerevisiae and Rhyzopus stolonifer.

  5. A Reliable Spectral Method to Reaction-Diffusion Equations in Entrapped-Cell Photobioreactor Packed with Gel Granules Using Chebyshev Wavelets. (United States)

    Selvi, M Salai Mathi; Hariharan, G; Kannan, K


    A mathematical model of a reaction-diffusion within an entrapped-cell photobioreactor packed with gel granules containing immobilized photosynthetic bacterial cells is discussed. A theoretical model is based on a system of coupled nonlinear reaction-diffusion equations. In this research work, we have developed an efficient wavelet-based spectral approach for solving the proposed model. Analytical expressions for the concentration of substrate and product are established for all values of reaction-diffusion parameters using second kind Chebyshev wavelet method. The analytical results were also compared with Homotopy perturbation method (HPM) and Adomian decomposition method (ADM). Satisfactory agreement with ADM and HPM solutions is observed. Moreover, the use of Chebyshev wavelets is found to be simple, reliable, efficient, and computationally attractive.

  6. A Parallel 3D Spectral Difference Method for Solutions of Compressible Navier Stokes Equations on Deforming Grids and Simulations of Vortex Induced Vibration (United States)

    DeJong, Andrew

    Numerical models of fluid-structure interaction have grown in importance due to increasing interest in environmental energy harvesting, airfoil-gust interactions, and bio-inspired formation flying. Powered by increasingly powerful parallel computers, such models seek to explain the fundamental physics behind the complex, unsteady fluid-structure phenomena. To this end, a high-fidelity computational model based on the high-order spectral difference method on 3D unstructured, dynamic meshes has been developed. The spectral difference method constructs continuous solution fields within each element with a Riemann solver to compute the inviscid fluxes at the element interfaces and an averaging mechanism to compute the viscous fluxes. This method has shown promise in the past as a highly accurate, yet sufficiently fast method for solving unsteady viscous compressible flows. The solver is monolithically coupled to the equations of motion of an elastically mounted 3-degree of freedom rigid bluff body undergoing flow-induced lift, drag, and torque. The mesh is deformed using 4 methods: an analytic function, Laplace equation, biharmonic equation, and a bi-elliptic equation with variable diffusivity. This single system of equations -- fluid and structure -- is advanced through time using a 5-stage, 4th-order Runge-Kutta scheme. Message Passing Interface is used to run the coupled system in parallel on up to 240 processors. The solver is validated against previously published numerical and experimental data for an elastically mounted cylinder. The effect of adding an upstream body and inducing wake galloping is observed.

  7. Time domain investigation on excitonic spectral diffusion in CdSe quantum dots grown on vicinal surface GaAs substrates (United States)

    Makino, T.; André, R.; Gérard, J.-M.; Romestain, R.; Dang, Le Si; Bartels, M.; Lischka, K.; Schikora, D.


    Two monolayers of CdSe sandwiched by ZnSe layers were grown by molecular-beam epitaxy on a vicinal GaAs surface substrate. Small ensembles of these self-assembled quantum dots (QD) have been studied at low temperatures using micro-photoluminescence spectroscopy. We observe reversible spectral diffusion in individual QD luminescence lines. The energy shift is negligibly small at low optical excitation power and amount to about 0.7 meV under higher excitation (0.6 kW/cm2). Because the energy shift is found to be significantly smaller than the exciton-biexciton splitting of CdSe QDs even under high excitation, the conventional spectral filtering could be used to effectively select the exciton-related emission from these QDs.

  8. Development of Surfaces Optically Suitable for Flat Solar Panels. [using a reflectometer which separately evaluates spectral and diffuse reflectivities of surfaces (United States)


    A reflectometer which can separately evaluate the spectral and diffuse reflectivities of surfaces is described. A phase locked detection system for the reflectometer is also described. A selective coating on aluminum potentially useful for flat plate solar collector applications is presented. The coating is composed of strongly bound copper oxide (divalent) and is formed by an etching process performed on an aluminum alloy with high copper content. Fabrication costs are expected to be small due to the one stop fabrication process. A number of conclusions gathered from the literature as to the required optical properties of flat plate solar collectors are discussed.

  9. Estimates of site response based on spectral ratio between horizontal and vertical components of ambient vibrations in the source zone of 2001 Bhuj earthquake (United States)

    Natarajan, Thulasiraman; Rajendran, Kusala


    We investigated the site response characteristics of Kachchh rift basin over the meizoseismal area of the 2001, Mw 7.6, Bhuj (NW India) earthquake using the spectral ratio of the horizontal and vertical components of ambient vibrations. Using the available knowledge on the regional geology of Kachchh and well documented ground responses from the earthquake, we evaluated the H/V curves pattern across sediment filled valleys and uplifted areas generally characterized by weathered sandstones. Although our H/V curves showed a largely fuzzy nature, we found that the hierarchical clustering method was useful for comparing large numbers of response curves and identifying the areas with similar responses. Broad and plateau shaped peaks of a cluster of curves within the valley region suggests the possibility of basin effects within valley. Fundamental resonance frequencies (f0) are found in the narrow range of 0.1-2.3 Hz and their spatial distribution demarcated the uplifted regions from the valleys. In contrary, low H/V peak amplitudes (A0 = 2-4) were observed on the uplifted areas and varying values (2-9) were found within valleys. Compared to the amplification factors, the liquefaction indices (kg) were able to effectively indicate the areas which experienced severe liquefaction. The amplification ranges obtained in the current study were found to be comparable to those obtained from earthquake data for a limited number of seismic stations located on uplifted areas; however the values on the valley region may not reflect their true amplification potential due to basin effects. Our study highlights the practical usefulness as well as limitations of the H/V method to study complex geological settings as Kachchh.

  10. Vibration analysis of cryocoolers (United States)

    Tomaru, Takayuki; Suzuki, Toshikazu; Haruyama, Tomiyoshi; Shintomi, Takakazu; Yamamoto, Akira; Koyama, Tomohiro; Li, Rui


    The vibrations of Gifford-McMahon (GM) and pulse-tube (PT) cryocoolers were measured and analyzed. The vibrations of the cold-stage and cold-head were measured separately to investigate their vibration mechanisms. The measurements were performed while maintaining the thermal conditions of the cryocoolers at a steady state. We found that the vibration of the cold-head for the 4 K PT cryocooler was two orders of magnitude smaller than that of the 4 K GM cryocooler. On the other hand, the vibration of the cold-stages for both cryocoolers was of the same order of magnitude. From a spectral analysis of the vibrations and a simulation, we concluded that the vibration of the cold-stage is caused by an elastic deformation of the pulse tubes (or cylinders) due to the pressure oscillation of the working gas.

  11. Vibration analysis of cryocoolers

    Energy Technology Data Exchange (ETDEWEB)

    Tomaru, Takayuki; Suzuki, Toshikazu; Haruyama, Tomiyoshi; Shintomi, Takakazu; Yamamoto, Akira [High Energy Accelerator Research Organization (KEK), Tsukuba, Ibaraki (Japan); Koyama, Tomohiro; Rui Li [Sumitomo Heavy Industries Ltd., Tokyo (Japan)


    The vibrations of Gifford-McMahon (GM) and pulse-tube (PT) cryocoolers were measured and analyzed. The vibrations of the cold-stage and cold-head were measured separately to investigate their vibration mechanisms. The measurements were performed while maintaining the thermal conditions of the cryocoolers at a steady state. We found that the vibration of the cold-head for the 4 K PT cryocooler was two orders of magnitude smaller than that of the 4 K GM cryocooler. On the other hand, the vibration of the cold-stages for both cryocoolers was of the same order of magnitude. From a spectral analysis of the vibrations and a simulation, we concluded that the vibration of the cold-stage is caused by an elastic deformation of the pulse tubes (or cylinders) due to the pressure oscillation of the working gas. (Author)

  12. Application of a simplified calculation for full-wave microtremor H/ V spectral ratio based on the diffuse field approximation to identify underground velocity structures (United States)

    Wu, Hao; Masaki, Kazuaki; Irikura, Kojiro; Sánchez-Sesma, Francisco José


    Under the diffuse field approximation, the full-wave (FW) microtremor H/ V spectral ratio ( H/ V) is modeled as the square root of the ratio of the sum of imaginary parts of the Green's function of the horizontal components to that of the vertical one. For a given layered medium, the FW H/ V can be well approximated with only surface waves (SW) H/ V of the "cap-layered" medium which consists of the given layered medium and a new larger velocity half-space (cap layer) at large depth. Because the contribution of surface waves can be simply obtained by the residue theorem, the computation of SW H/ V of cap-layered medium is faster than that of FW H/ V evaluated by discrete wavenumber method and contour integration method. The simplified computation of SW H/ V was then applied to identify the underground velocity structures at six KiK-net strong-motion stations. The inverted underground velocity structures were used to evaluate FW H/ Vs which were consistent with the SW H/ Vs of corresponding cap-layered media. The previous study on surface waves H/ Vs proposed with the distributed surface sources assumption and a fixed Rayleigh-to-Love waves amplitude ratio for horizontal motions showed a good agreement with the SW H/ Vs of our study. The consistency between observed and theoretical spectral ratios, such as the earthquake motions of H/ V spectral ratio and spectral ratio of horizontal motions between surface and bottom of borehole, indicated that the underground velocity structures identified from SW H/ V of cap-layered medium were well resolved by the new method.[Figure not available: see fulltext.

  13. Effect of simulated precompression, compression pressure and tableting speed on an offline diffuse transmittance and reflectance near-infrared spectral information of model intact caffeine tablets. (United States)

    Vranic, Branko Z; Vandamme, Thierry F


    Near-infrared spectroscopy (NIRS) is used in the pharmaceutical industry for monitoring drug content during the tablet manufacturing process. It is of critical importance to understand the effect of process factors on NIRS performance. Design of Experiments (DoE) methodology was applied in this work for the systematic study of the effects of compression pressure, precompression pressure and tableting speed on an average Euclidean distance (AED), which reflects spectral features of the tablets, and root mean-squared error of prediction (RMSEP) as key performance indicator of NIRS calibration models. Caffeine tablets were manufactured in 17 experimental runs in accordance with D-optimal design. Developed diffuse transmittance (DT) and diffuse reflectance (DR) calibration models were tested on five independent test sets to confirm the conclusions of the DoE. Compression pressure and tableting speed have shown significant effect on the studied responses in DT mode, whereas all three studied factors have shown a significant effect in DR mode. Significant factors were considered in the development of the global calibration models. The authors suggest further study of RMSEP and AED responses to draw reliable conclusions on the effects of tableting process factors. The global calibration model in DT mode has shown superior performance compared to DR mode.

  14. An automatic measuring system for mapping of spectral and angular dependence of direct and diffuse solar radiation; Et automatisk maalesystem for kartlegging av vinkel- og spektralfordeling av direkte og diffus solstraaling

    Energy Technology Data Exchange (ETDEWEB)

    Grandum, Oddbjoern


    In optimizing solar systems, it is necessary to know the spectral and angular dependence of the radiation. The general nonlinear character of most solar energy systems accentuates this. This thesis describes a spectroradiometer that will measure both the direct component of the solar radiation and the angular dependence of the diffuse component. Radiation from a selected part of the sky is transported through a movable set of tube sections on to a stationary set of three monochromators with detectors. The beam transport system may effectively be looked upon as a single long tube aimed at a particular spot in the sky. The half value of the effective opening angle is 1.3{sup o} for diffuse radiation and 2.8{sup o} for direct radiation. The whole measurement process is controlled and operated by a PC and normally runs without manual attention. The instrument is built into a caravan. The thesis describes in detail the experimental apparatus, calibration and measurement accuracies. To map the diffuse radiation, one divides the sky into 26 sectors of equal solid angle. A complete measurement cycle is then made at a random point within each sector. These measurements are modelled by fitting to spherical harmonics, enforcing symmetry around the solar direction and the horizontal plane. The direct radiation is measured separately. Also the circumsolar sector is given special treatment. The measurements are routinely checked against global radiation measured in parallel by a standard pyranometer, and direct solar radiation by a pyrheliometer. An extensive improvement programme is being planned for the instrument, including the use of a photomultiplier tube to measure the UV part of the spectrum, a diode array for the 400-1100 nm range, and use of a Ge diode for the 1000-1900 nm range. 78 refs., 90 figs., 31 tabs.

  15. Normal coordinate analysis, molecular structure, vibrational and electronic spectral investigation of 7-(1,3-dioxolan-2-ylmethyl)-1,3-dimethylpurine-2,6-dione by ab initio HF and DFT method (United States)

    Prabakaran, A.; Muthu, S.


    In the present work, the characterization of 7-(1,3-dioxolan-2-ylmethyl)-1,3-dimethylpurine-2,6-dione (7DDMP26D) molecule was carried out by quantum chemical method and vibrational spectral techniques. The FT-IR (4000-400 cm-1) and FT-Raman (4000-100 cm-1) spectra of 7DDMP26D were recorded in solid phase. The UV-Vis absorption spectrum of the 7DDMP26D was recorded in the range of 200-400 nm. The molecular geometry, harmonic vibrational frequencies and bonding features of 7DDMP26D in the ground state have been calculated by HF and DFT methods using 6-31G(d,p) basis set. The complete vibrational frequency assignments were made by normal coordinate analysis (NCA) following the scaled quantum mechanical force field methodology (SQMF). The molecular stability and bond strength were investigated by applying the natural bond orbital analysis (NBO). The electronic properties, such as excitation energies, absorption wavelength, HOMO and LUMO energies were performed by time-depended DFT (TD-DFT) approach. The other molecular properties like electrostatic potential (ESP), Fukui function and thermodynamic properties of the title compound at different temperatures have been calculated. Finally, the calculation results were analyzed to simulate infrared, FT-Raman and UV spectra of the title compound which shows better agreement with observed spectra.

  16. Difference of horizontal-to-vertical spectral ratios of observed earthquakes and microtremors and its application to S-wave velocity inversion based on the diffuse field concept (United States)

    Kawase, Hiroshi; Mori, Yuta; Nagashima, Fumiaki


    We have been discussing the validity of using the horizontal-to-vertical spectral ratios (HVRs) as a substitute for S-wave amplifications after Nakamura first proposed the idea in 1989. So far a formula for HVRs had not been derived that fully utilized their physical characteristics until a recent proposal based on the diffuse field concept. There is another source of confusion that comes from the mixed use of HVRs from earthquake and microtremors, although their wave fields are hardly the same. In this study, we compared HVRs from observed microtremors (MHVR) and those from observed earthquake motions (EHVR) at one hundred K-NET and KiK-net stations. We found that MHVR and EHVR share similarities, especially until their first peak frequency, but have significant differences in the higher frequency range. This is because microtremors mainly consist of surface waves so that peaks associated with higher modes would not be prominent, while seismic motions mainly consist of upwardly propagating plain body waves so that higher mode resonances can be seen in high frequency. We defined here the spectral amplitude ratio between them as EMR and calculated their average. We categorize all the sites into five bins by their fundamental peak frequencies in MHVR. Once we obtained EMRs for five categories, we back-calculated EHVRs from MHVRs, which we call pseudo-EHVRs (pEHVR). We found that pEHVR is much closer to EHVR than MHVR. Then we use our inversion code to invert the one-dimensional S-wave velocity structures from EHVRs based on the diffuse field concept. We also applied the same code to pEHVRs and MHVRs for comparison. We found that pEHVRs yield velocity structures much closer to those by EHVRs than those by MHVRs. This is natural since what we have done up to here is circular except for the average operation in EMRs. Finally, we showed independent examples of data not used in the EMR calculation, where better ground structures were successfully identified from p

  17. Provenance of Holocene sediment on the Chukchi-Alaskan margin based on combined diffuse spectral reflectance and quantitative X-Ray Diffraction analysis (United States)

    Ortiz, J.D.; Polyak, L.; Grebmeier, J.M.; Darby, D.; Eberl, D.D.; Naidu, S.; Nof, D.


    Sediment clay and silt mineral assemblages provide an excellent means of assessing the provenance of fine-grained Arctic sediment especially when a unique mineral assemblage can be tied to specific source areas. The diffuse spectral reflectance (DSR) first derivative measurements and quantitative X-Ray Diffraction (qXRD) on a high-resolution sediment core from the continental slope north of Alaska constrain the sediment mineralogy. DSR results are augmented by measurements on several adjacent cores and compared to surface sediment samples from the northern Alaskan shelf and slope. Using Principal Component Analysis (PCA), we infer that the three leading DSR modes relate to mixtures of smectite + dolomite, illite + goethite, and chlorite + muscovite. This interpretation is consistent with the down core qXRD results. While the smectite + dolomite, and illite + goethite factors show increased variability down core, the chlorite + muscovite factor had highest positive loadings in the middle Holocene, between ca. 6.0 and 3.6??ka. Because the most likely source of the chlorite + muscovite suite in this vicinity lies in the North Pacific, we argue that the oscillations in chlorite + muscovite values likely reflect an increase in the inflow of Pacific water to the Arctic through the Bering Strait. The time interval of this event is associated in other parts of the globe with a non-linear response of the climate system to the decrease in insolation, which may be related to changes in water exchange between the Pacific and Arctic Ocean. ?? 2009 Elsevier B.V.


    Leonenko, Nikolai N; Meerschaert, Mark M; Sikorskii, Alla


    Pearson diffusions are governed by diffusion equations with polynomial coefficients. Fractional Pearson diffusions are governed by the corresponding time-fractional diffusion equation. They are useful for modeling sub-diffusive phenomena, caused by particle sticking and trapping. This paper provides explicit strong solutions for fractional Pearson diffusions, using spectral methods. It also presents stochastic solutions, using a non-Markovian inverse stable time change.

  19. Ultrafast Vibrational Dynamics of Water Disentangled by Reverse Nonequilibrium Ab Initio Molecular Dynamics Simulations

    Directory of Open Access Journals (Sweden)

    Yuki Nagata


    Full Text Available Water is a unique solvent with strong, yet highly dynamic, intermolecular interactions. Many insights into this distinctive liquid have been obtained using ultrafast vibrational spectroscopy of water’s O-H stretch vibration. However, it has been challenging to separate the different contributions to the dynamics of the O-H stretch vibration in H_{2}O. Here, we present a novel nonequilibrium molecular dynamics (NEMD algorithm that allows for a detailed picture of water vibrational dynamics by generating nonequilibrium vibrationally excited states at targeted vibrational frequencies. Our ab initio NEMD simulations reproduce the experimentally observed time scales of vibrational dynamics in H_{2}O. The approach presented in this work uniquely disentangles the effects on the vibrational dynamics of four contributions: the delocalization of the O-H stretch mode, structural dynamics of the hydrogen bonded network, intramolecular coupling within water molecules, and intermolecular coupling between water molecules (near-resonant energy transfer between O-H groups. Our results illustrate that intermolecular energy transfer and the delocalization of the O-H stretch mode are particularly important for the spectral diffusion in H_{2}O.

  20. The seismic ambient noise spectral ratio H/V under de diffuse field approach for simple layered models: Asymptotic behavior for low and high frequencies (United States)

    Luzón, F.; García-Jerez, A.; Sanchez-Sesma, F. J.; Lunedei, E.; Albarello, D.; Santoyo, M. A.; Almendros, J.


    The possibility of retrieving the elastodynamic Green's tensor between two points within an elastic medium from time-domain correlation of ambient noise recorded at such sites was duly confirmed in the pioneering seismic experiments by Campillo and Paul (2003) and Shapiro and Campillo (2004). Afterwards, several theoretical works on this subject have been conducted for simple models showing that such a possibility implies the condition of diffuse wavefield which requires isotropy of the illumination or the fulfillment of certain relationships between the energies of different types of waves (derived from the energy equipartition principle). In this work we examine the reliability of the usual assumptions that emerge from the Diffuse Field Approach (DFA). In particular we deal with the wavefield composition in applications regarding the passive seismic prospecting. We revise briefly the more general formulation of the DFA for full wavefield (FW). In this case the contribution of each wave to the horizontal-and vertical power spectra at surface are analyzed for a simple elastic waveguide (for instance the continental crust-upper mantle interface). Special attention is paid to their compositions at low-and high-frequencies, obtaining the relative powers of each surface wave (SW) type by means of a semi-analytical analysis. We found for some simple models that if body waves are removed from the analysis, the high-frequency horizontal asymptote of the H/V spectral ratio decreases slightly (from 1.33 for FW to around 1.14 for SW) and shows dependence on both the Poisson's ratio of the crust and the S-wave velocity contrast (while FW-H/V asymptote depends on the former only). Experimental tests for a broad band network deployed at SW Pyrenees edge provide H/V curves compatible with any of these values in the band 0.2-1Hz, approximately, supporting the applicability of the DFA approximation. Coexistence of multiple SW-modes produces distortion in the amplitude of both

  1. Z-scan measurements of the third-order optical nonlinearities and vibrational spectral studies by DFT computations on azo dye 1-(2-Methylphenylazo)-2-napthol (United States)

    Sreenath, M. C.; Mathew, S.; Hubert Joe, I.; Rastogi, V. K.


    The nonlinear optical properties of azo dye 1-(2-Methylphenylazo)-2-napthol have been studied. The complete vibrational features and electronic absorption spectra of the title compound were analyzed by FT-IR, FT-Raman and UV-visible spectra combined with density functional theory and time-dependent density functional computations respectively. Nonlinear optical behavior was investigated by calculating the second-order hyperpolarizablity at DFT level. Third-order nonlinear optical parameters of 1-(2-Methylphenylazo)-2-napthol were measured using closed and open aperture Z-scan technique. The Z-scan result confirms, the dye exhibit self-focusing effect and the sign of the refractive nonlinearity is positive. The nonlinear refractive index (n2), nonlinear absorption coefficient (β), real and imaginary parts of third-order susceptibility (χ (3)) and second-order hyperpolarizability (γ) are calculated. The calculated results indicated that 1-(2-Methylphenylazo)-2-napthol have potential applications in optoelectronics and photonics.

  2. Synthesis, crystal structure, vibrational spectral analysis and Z-scan studies of a new organic crystal N,N‧dimethylurea ninhydrin: A scaled quantum mechanical force field study (United States)

    John, Jerin Susan; Sajan, D.; Umadevi, T.; Chaitanya, K.; Sankar, Pranitha; Philip, Reji


    A new organic material, N,N‧dimethylurea ninhydrin (3a,8a-dihydroxy-1,3-dimethyl-1,3,3a,8a-tetrahydroindeno[2,1-d]imidazole-2,8-dione) (NDUN) was synthesized. Structural details were obtained from single crystal X-ray diffraction (XRD) data. A detailed interpretation of the vibrational spectra is carried out with the aid of normal coordinate analysis following the scaled quantum mechanical force field methodology. TG/DTA and 1H NMR studies were carried out. Linear optical properties were studied from UV-Vis spectra. From the open aperture Z-scan data, it is found that the molecule shows third order nonlinear optical behaviour due to two photon absorption (2PA) mechanism.

  3. Vibrational spectroscopy of resveratrol (United States)

    Billes, Ferenc; Mohammed-Ziegler, Ildikó; Mikosch, Hans; Tyihák, Ernő


    In this article the authors deal with the experimental and theoretical interpretation of the vibrational spectra of trans-resveratrol (3,5,4'-trihydroxy- trans-stilbene) of diverse beneficial biological activity. Infrared and Raman spectra of the compound were recorded; density functional calculations were carried out resulting in the optimized geometry and several properties of the molecule. Based on the calculated force constants, a normal coordinate analysis yielded the character of the vibrational modes and the assignment of the measured spectral bands.

  4. Man-Induced Vibrations

    DEFF Research Database (Denmark)

    Jönsson, Jeppe; Hansen, Lars Pilegaard


    concerned with spectator-induced vertical vibrations on grandstands. The idea is to use impulse response analysis and base the load description on the load impulse. If the method is feasable, it could be used in connection with the formulation of requirements in building codes. During the last two decades...... work has been done on the measurement of the exact load functions and related reponse analysis. A recent work using a spectral description has been performed by Per-Erik Erikson and includes a good literature survey. Bachmann and Ammann give a good overview of vibrations caused by human activity. Other...


    Directory of Open Access Journals (Sweden)

    E. O. Zaitsev


    Full Text Available The objective of this paper is development and experimental verification special software of spectral analysis. Spectral analysis use of controlled vibrations objects. Spectral analysis of vibration based on use maximum-entropy autoregressive method of spectral analysis by the Berg algorithm. For measured signals use preliminary analysis based on regression analysis. This analysis of the signal enables to eliminate uninformative parameters such as – the noise and the trend. For preliminary analysis developed special software tools. Non-contact measurement of mechanical vibrations parameters rotating diffusely-reflecting surfaces used in circumstances where the use of contact sensors difficult or impossible for a number of reasons, including lack of access to the object, the small size of the controlled area controlled portion has a high temperature or is affected by strong electromagnetic fields. For control use offered laser measuring system. This measuring system overcomes the shortcomings interference or Doppler optical measuring systems. Such as measure the large amplitude and inharmonious vibration. On the basis of the proposed methods developed special software tools for use measuring laser system. LabVIEW using for developed special software. Experimental research of the proposed method of vibration signals processing is checked in the analysis of the diagnostic information obtained by measuring the vibration system grinding diamond wheel cold solid tungsten-containing alloy TK8. A result of work special software tools was complex spectrum obtained «purified» from non-informative parameters. Spectrum of the signal corresponding to the vibration process observed object. 

  6. Carrier diffusion as a measure of carrier/exciton transfer rate in InAs/InGaAsP/InP hybrid quantum dot-quantum well structures emitting at telecom spectral range (United States)

    Rudno-Rudziński, W.; Biegańska, D.; Misiewicz, J.; Lelarge, F.; Rousseau, B.; Sek, G.


    We investigate the diffusion of photo-generated carriers (excitons) in hybrid two dimensional-zero dimensional tunnel injection structures, based on strongly elongated InAs quantum dots (called quantum dashes, QDashes) of various heights, designed for emission at around 1.5 μm, separated by a 3.5 nm wide barrier from an 8 nm wide In0.64Ga0.36As0.78P0.22 quantum well (QW). By measuring the spectrally filtered real space images of the photoluminescence patterns with high resolution, we probe the spatial extent of the emission from QDashes. Deconvolution with the exciting light spot shape allows us to extract the carrier/exciton diffusion lengths. For the non-resonant excitation case, the diffusion length depends strongly on excitation power, pointing at carrier interactions and phonons as its main driving mechanisms. For the case of excitation resonant with absorption in the adjacent QW, the diffusion length does not depend on excitation power for low excitation levels since the generated carriers do not have sufficient excess kinetic energy. It is also found that the diffusion length depends on the quantum-mechanical coupling strength between QW and QDashes, controlled by changing the dash size. It influences the energy difference between the QDash ground state of the system and the quantum well levels, which affects the tunneling rates. When that QW-QDash level separation decreases, the probability of capturing excitons generated in the QW by QDashes increases, which is reflected by the decreased diffusion length from approx. 5 down to 3 μm.

  7. Vibrations et relaxations dans les molécules biologiques. Apports de la diffusion incohérente inélastique de neutrons (United States)

    Zanotti, J.-M.


    Le présent document ne se veut pas un article de revue mais plutôt un élément d'initiation à une technique encore marginale en Biologie. Le lecteur est supposé être un non spécialiste de la diffusion de neutrons poursuivant une thématique à connotation biologique ou biophysique mettant en jeu des phénomènes dynamiques. En raison de la forte section de diffusion incohérente de l'atome d'hydrogène et de l'abondance de cet élément dans les protéines, la diffusion incohérente inélastique de neutrons est une technique irremplaçable pour sonder la dynamique interne des macromolécules biologiques. Après un rappel succinct des éléments théoriques de base, nous décrivons le fonctionnement de différents types de spectromètres inélastiques par temps de vol sur source continue ou pulsée et discutons leurs mérites respectifs. Les deux alternatives utilisées pour décrire la dynamique des protéines sont abordées: (i)l'une en termes de physique statistique, issue de la physique des verres, (ii) la seconde est une interprétation mécanistique. Nous montrons dans ce cas, comment mettre à profit les complémentarités de domaines en vecteur de diffusion et de résolution en énergie de différents spectromètres inélastiques de neutrons (temps de vol, backscattering et spin-écho) pour accéder, à l'aide d'un modèle physique simple, à la dynamique des protéines sur une échelle de temps allant d'une fraction de picoseconde à quelques nanosecondes.

  8. High Spectral Resolution Observation of the Soft Diffuse X-ray Background in the Direction of the Galactic Anti-Center (United States)

    Wulf, Dallas; Eckart, Mega E.; Galeazzi, Massimiliano; Jaeckel, Felix; Kelley, Richard L.; Kilbourne, Caroline A.; McCammon, Dan; Morgan, Kelsey M.; Porter, Frederick S.; Szymkowiak, Andrew E.


    High spectral resolution observations in the soft x-rays are necessary for understanding and modelling the hot component of the interstellar medium and its contribution to the Soft X-ray Background (SXRB). This extended source emission cannot be resolved with most wavelength dispersive spectrometers, making energy dispersive microcalorimeters the ideal choice for these observations. We present here the analysis of the most recent sounding rocket flight of the University of Wisconsin-Madison/Goddard Space Flight Center X-ray Quantum Calorimeter (XQC), a large area silicon thermistor microcalorimeter. This 111 second observation integrates a nearly 1 steradian field of view in the direction of the galactic anti-center (l, b = 165°, -5°) and features ~5 eV spectral resolution below 1 keV. Direct comparison will also be made to the previous, high-latitude observations.

  9. Monitoring vibrations

    Energy Technology Data Exchange (ETDEWEB)

    Tiryaki, B. [Hacettepe University (Turkey). Dept. of Mining Engineering


    The paper examines the prediction and optimisation of machine vibrations in longwall shearers. Underground studies were carried out at the Middle Anatolian Lignite Mine, between 1993 and 1997. Several shearer drums with different pick lacing arrangements were designed and tested on double-ended ranging longwall shearers employed at the mine. A computer program called the Vibration Analysis Program (VAP) was developed for analysing machine vibrations in longwall shearers. Shearer drums that were tested underground, as well as some provided by leading manufacturers, were analyzed using these programs. The results of the experiments and computer analyses are given in the article. 4 refs., 9 figs.

  10. Spectral reflectance properties (0.4-2.5 um) of secondary Fe-oxide, Fe-hydroxide, and Fe-sulfate-hydrate minerals associated with sulfide-bearing mine waste (United States)

    Crowley, J.K.; Williams, D.E.; Hammarstrom1, J.M.; Piatak, N.; Mars, J.C.; Chou, I-Ming


    Fifteen Fe-oxide, Fe-hydroxide, and Fe-sulphate-hydrate mineral species commonly associated with sulphide bearing mine wastes were characterized by using X-ray powder diffraction and scanning electron microscope methods. Diffuse reflectance spectra of the samples show diagnostic absorption features related to electronic processes involving ferric and/or ferrous iron, and to vibrational processes involving water and hydroxyl ions. Such spectral features enable field and remote sensing based studies of the mineral distributions. Because secondary minerals are sensitive indicators of pH, Eh, relative humidity, and other environmental conditions, spectral mapping of these minerals promises to have important applications to mine waste remediation studies. This report releases digital (ascii) spectra ( of the fifteen mineral samples to facilitate usage of the data with spectral libraries and spectral analysis software. The spectral data are provided in a two-column format listing wavelength (in micrometers) and reflectance, respectively.

  11. Vibrational Diver (United States)

    Kozlov, Victor; Ivanova, Alevtina; Schipitsyn, Vitalii; Stambouli, Moncef


    The paper is concerned with dynamics of light solid in cavity with liquid subjected to rotational vibration in the external force field. New vibrational phenomenon - diving of a light cylinder to the cavity bottom is found. The experimental investigation of a horizontal annulus with a partition has shown that under vibration a light body situated in the upper part of the layer is displaced in a threshold manner some distance away from the boundary. In this case the body executes symmetric tangential oscillations. An increase of the vibration intensity leads to a tangential displacement of the body near the external boundary. This displacement is caused by the tangential component of the vibrational lift force, which appears as soon as the oscillations lose symmetry. In this case the trajectory of the body oscillatory motion has the form of a loop. The tangential lift force makes stable the position of the body on the inclined section of the layer and even in its lower part. A theoretical interpretation has been proposed, which explains stabilization of a quasi-equilibrium state of a light body near the cavity bottom in the framework of vibrational hydromechanics.

  12. Broadband time-resolved diffuse optical spectrometer for clinical diagnostics: characterization and in-vivo measurements in the 600-1350 nm spectral range (United States)

    Konugolu Venkata Sekar, Sanathana; Farina, Andrea; Martinenghi, Edoardo; Dalla Mora, Alberto; Taroni, Paola; Pifferi, Antonio; Durduran, Turgut; Pagliazzi, Marco; Lindner, Claus; Farzam, Parisa; Mora, Mireia; Squarcia, Mattia; Urbano-Ispizua, A.


    We report on the design, performance assessment, and first in vivo measurement of a Time-Resolved Diffuse Optical system for broadband (600-1350 nm) nm measurement of absorption and scattering spectra of biological tissues for non-invasive clinical diagnostics. Two strategies to reduce drift and enhance responsivity are adopted. The system was enrolled in a first in vivo test phase on healthy volunteers, carrying out non-invasive, in vivo quantification of key tissue constituents (oxy- and deoxy-hemoglobin, water, lipids, collagen) and tissue micro-structure (scatterer size and density).

  13. Analysis of Vibration Diagnostics Methods for Induction Motors

    Directory of Open Access Journals (Sweden)

    A. P. Kalinov


    Full Text Available The paper presents an analysis of existing vibration diagnostics methods. In order to evaluate an efficiency of method application the following criteria have been proposed: volume of input data required for establishing diagnosis, data content, software and hardware level, execution time for vibration diagnostics. According to the mentioned criteria a classification of vibration diagnostics methods for determination of their advantages and disadvantages, search for their development and improvement has been presented in paper. The paper contains a comparative estimation of methods in accordance with the proposed  criteria. According to this estimation the most efficient methods are a spectral analysis and spectral analysis of the vibration signal envelope.

  14. Vibrating minds

    CERN Document Server


    Ed Witten is one of the leading scientists in the field of string theory, the theory that describes elementary particles as vibrating strings. This week he leaves CERN after having spent a few months here on sabbatical. His wish is that the LHC will unveil supersymmetry.

  15. Normalized spectral damage of a linear system over different spectral loading patterns (United States)

    Kim, Chan-Jung


    Spectral fatigue damage is affected by different loading patterns; the damage may be accumulated in a different manner because the spectral pattern has an influence on stresses or strains. The normalization of spectral damage with respect to spectral loading acceleration is a novel solution to compare the accumulated fatigue damage over different spectral loading patterns. To evaluate the sensitivity of fatigue damage over different spectral loading cases, a simple notched specimen is used to conduct a uniaxial vibration test for two representative spectral patterns-random and harmonic-between 30 and 3000 Hz. The fatigue damage to the simple specimen is analyzed for different spectral loading cases using the normalized spectral damage from the measured response data for both acceleration and strain. The influence of spectral loading patterns is discussed based on these analyses.

  16. Self-excited and subharmonic vibrations in a pilot rotor (United States)

    Kumenko, A. I.; Kostyukov, V. N.; Kuzminykh, N. Yu.; Timin, A. V.


    The paper reviews the publications on low-frequency vibration in power plants. It is noted that the regulatory literature poorly defines the issues of rating and diagnosing self-excited and subharmonic vibrations. Analysis of the literature and ISO standards shows that despite the considerable experience gained by specialists in low-frequency vibration control, a number of issues, such as subharmonic resonances and nonlinear properties of complicated multi-seated rotor systems supported by journal bearings, are still understudied and require further calculations and experiments. The paper presents some results obtained in experiments of low-frequency vibrations for a rotor supported by journal bearings and having a residual deflection. The experimental results confirmed the classical hysteresis of self-excited vibrations - the difference in the boundaries of self-excited vibrations during ascent and descent is about 4 Hz. The arears of appearance and disappearance of subharmonic vibrations are shown using the spectral characteristics of vibrations and cascade spectra.

  17. The spectral shift function and spectral flow


    Azamov, N. A.; Carey, A.L.; Sukochev, F. A.


    This paper extends Krein's spectral shift function theory to the setting of semifinite spectral triples. We define the spectral shift function under these hypotheses via Birman-Solomyak spectral averaging formula and show that it computes spectral flow.

  18. Entropy in sound and vibration: towards a new paradigm. (United States)

    Le Bot, A


    This paper describes a discussion on the method and the status of a statistical theory of sound and vibration, called statistical energy analysis (SEA). SEA is a simple theory of sound and vibration in elastic structures that applies when the vibrational energy is diffusely distributed. We show that SEA is a thermodynamical theory of sound and vibration, based on a law of exchange of energy analogous to the Clausius principle. We further investigate the notion of entropy in this context and discuss its meaning. We show that entropy is a measure of information lost in the passage from the classical theory of sound and vibration and SEA, its thermodynamical counterpart.

  19. Acoustic vibration problem for dissipative fluids


    Lepe, Felipe; Meddahi, Salim; Mora, David; Rodríguez, Rodolfo


    In this paper we analyze a finite element method for solving a quadratic eigenvalue problem derived from the acoustic vibration problem for a heterogeneous dissipative fluid. The problem is shown to be equivalent to the spectral problem for a noncompact operator and athorough spectral characterization is given. The numerical discretization of the problem is based on Raviart-Thomas finite elements. The method is proved to be free of spurious modes and to converge with optimal order. Finally, w...

  20. Ultrafast electronic relaxation and vibrational dynamics in a polyacetylene derivative (United States)

    Kobayashi, Takayoshi; Iiyama, Tsugumasa; Okamura, Kotaro; Du, Juan; Masuda, Toshio


    Real-time vibrational spectra in a polyacetylene derivative, poly[o-TFMPA([o-(trifluoromethyl) phenyl]acetylene)] in a broad electronic spectral region were observed using a sub-7-fs laser. Using the frequencies and initial phases of vibrational modes obtained by the spectroscopy, the assignment of the wavepackets was made. From the first moment, Huang-Rhys parameters were determined for six most prominent modes, which characterize the potential hypersurface composed of multi-dimensional vibrational mode spaces.

  1. Urban vibrations

    DEFF Research Database (Denmark)

    Morrison, Ann; Knudsen, L.; Andersen, Hans Jørgen


      lab   studies   in   that   we   found   a   decreased   detection   rate   in   busy   environments.   Here   we   test   with   a   much   larger   sample   and   age   range,   and   contribute   with   the   first   vibration  sensitivity  testing  outside  the  lab  in  an  urban   public...

  2. Anharmonic vibrational and electronic spectral study of 2-amino-4-hydroxy-6-methylpyrimidine: A combined experimental (FTIR, FT-Raman, UV-Vis) and theoretical (DFT, MP2) approach (United States)

    Faizan, Mohd; Bhat, Sheeraz Ahmad; Alam, Mohammad Jane; Afroz, Ziya; Ahmad, Shabbir


    A combined experimental and theoretical study of the structure, vibrational spectra and electronic spectra of 2-amino-4-hydroxy-6-methylpyrimidine in the ground electronic state are reported. Anharmonic frequencies for the most stable conformer have been simulated using GVPT2, VSCF and PT2-VSCF methods with potential energy surface calculated using MP2 and DFT level of theory with 6-311G(d,p) basis set. The vibrational spectra (FTIR and FT-Raman) are interpreted in terms of fundamental, combination and overtone bands. It is found that the experimental and the VPT2 computed frequencies are in well agreement. The experimental and the calculated UV-Vis spectrum in gas and ethanol solvent are found comparable. Furthermore, HOMO-LUMO analysis, NLO, MEP, and natural charges of the molecule are also reported.

  3. Spectral stratigraphy (United States)

    Lang, Harold R.


    A new approach to stratigraphic analysis is described which uses photogeologic and spectral interpretation of multispectral remote sensing data combined with topographic information to determine the attitude, thickness, and lithology of strata exposed at the surface. The new stratigraphic procedure is illustrated by examples in the literature. The published results demonstrate the potential of spectral stratigraphy for mapping strata, determining dip and strike, measuring and correlating stratigraphic sequences, defining lithofacies, mapping biofacies, and interpreting geological structures.

  4. Vibrational relaxation pathways of AI and AII modes in N-methylacetamide clusters

    NARCIS (Netherlands)

    Piatkowski, L.; Bakker, H.J.


    We studied the pathways of vibrational energy relaxation of the amide I (~1660 cm-1) and amide II (~1560 cm-1) vibrational modes of N-methylacetamide (NMA) in CCl4 solution using two-color femtosecond vibrational spectroscopy. We measured the transient spectral dynamics upon excitation of each of

  5. Broadband Vibration Attenuation Using Hybrid Periodic Rods

    Directory of Open Access Journals (Sweden)

    S. Asiri


    Full Text Available This paper presents both theoretically and experimentally a new kind of a broadband vibration isolator. It is a table-like system formed by four parallel hybrid periodic rods connected between two plates. The rods consist of an assembly of periodic cells, each cell being composed of a short rod and piezoelectric inserts. By actively controlling the piezoelectric elements, it is shown that the periodic rods can efficiently attenuate the propagation of vibration from the upper plate to the lower one within critical frequency bands and consequently minimize the effects of transmission of undesirable vibration and sound radiation. In such a system, longitudinal waves can propagate from the vibration source in the upper plate to the lower one along the rods only within specific frequency bands called the "Pass Bands" and wave propagation is efficiently attenuated within other frequency bands called the "Stop Bands". The spectral width of these bands can be tuned according to the nature of the external excitation. The theory governing the operation of this class of vibration isolator is presented and their tunable filtering characteristics are demonstrated experimentally as functions of their design parameters. This concept can be employed in many applications to control the wave propagation and the force transmission of longitudinal vibrations both in the spectral and spatial domains in an attempt to stop/attenuate the propagation of undesirable disturbances.

  6. Influence of the spectral distribution of a solar simulator and of the outer diffuse radiation in the estimation of the optical yield of a thermal solar receiver; Influencia de la distribucion espectral de un simulador solar y de la radiacion difusa exterior en la estimacion del rendimiento optico de un captador solar termico

    Energy Technology Data Exchange (ETDEWEB)

    Sallaberry, F.; Garcia de Jalon, A.; Ramirez, L.; Olano, X.; Bernad, I.; Erice, R.


    In this paper we will show the results of the analysis of factors that influence the estimation of optical efficiency of solar thermal collectors testes according to the European standard UNE-EN 12975-2. Indoor tests with solar simulator involve control of the spectrum of its lamps to ensure that the difference with the Sun one does not change the optical efficiency {eta}{sub 0} of the collector. For outdoor tests, the diffuse radiation should be control as well. In the laboratory (LCS) of CENER, solar collectors tests are done according to part 6.1 of the standard UNE{sub E}N 12975-2 in continuous solar simulator. This study estimated the spectral correction applied to the estimation of optical efficiency of some solar collectors, with different selective materials. Likewise, we will weight the influence of terms related to diffuse radiation and spectral distribution. (Author)

  7. Theory of vibration protection

    CERN Document Server

    Karnovsky, Igor A


    This text is an advancement of the theory of vibration protection of mechanical systems with lumped and distributed parameters. The book offers various concepts and methods of solving vibration protection problems, discusses the advantages and disadvantages of different methods, and the fields of their effective applications. Fundamental approaches of vibration protection, which are considered in this book, are the passive, parametric and optimal active vibration protection. The passive vibration protection is based on vibration isolation, vibration damping and dynamic absorbers. Parametric vibration protection theory is based on the Shchipanov-Luzin invariance principle. Optimal active vibration protection theory is based on the Pontryagin principle and the Krein moment method. The book also contains special topics such as suppression of vibrations at the source of their occurrence and the harmful influence of vibrations on humans. Numerous examples, which illustrate the theoretical ideas of each chapter, ar...

  8. Piezoelectric energy harvesting from broadband random vibrations (United States)

    Adhikari, S.; Friswell, M. I.; Inman, D. J.


    Energy harvesting for the purpose of powering low power electronic sensor systems has received explosive attention in the last few years. Most works using deterministic approaches focusing on using the piezoelectric effect to harvest ambient vibration energy have concentrated on cantilever beams at resonance using harmonic excitation. Here, using a stochastic approach, we focus on using a stack configuration and harvesting broadband vibration energy, a more practically available ambient source. It is assumed that the ambient base excitation is stationary Gaussian white noise, which has a constant power-spectral density across the frequency range considered. The mean power acquired from a piezoelectric vibration-based energy harvester subjected to random base excitation is derived using the theory of random vibrations. Two cases, namely the harvesting circuit with and without an inductor, have been considered. Exact closed-form expressions involving non-dimensional parameters of the electromechanical system have been given and illustrated using numerical examples.

  9. Fault diagnosis of planetary gearboxes via torsional vibration signal analysis (United States)

    Feng, Zhipeng; Zuo, Ming J.


    Torsional vibration signals are theoretically free from the amplitude modulation effect caused by time variant vibration transfer paths due to the rotation of planet carrier and sun gear, and therefore their spectral structure are simpler than transverse vibration signals. Thus, it is potentially easy and effective to diagnose planetary gearbox faults via torsional vibration signal analysis. We give explicit equations to model torsional vibration signals, considering both distributed gear faults (like manufacturing or assembly errors) and local gear faults (like pitting, crack or breakage of one tooth), and derive the characteristics of both the traditional Fourier spectrum and the proposed demodulated spectra of amplitude envelope and instantaneous frequency. These derivations are not only effective to diagnose single gear fault of planetary gearboxes, but can also be generalized to detect and locate multiple gear faults. We validate experimentally the signal models, as well as the Fourier spectral analysis and demodulation analysis methods.

  10. Characterization of pollen by vibrational spectroscopy. (United States)

    Zimmermann, Boris


    Classification, discrimination, and biochemical assignment of vibrational spectra of pollen samples belonging to 43 different species of the order Pinales has been made using three different vibrational techniques. The comparative study of transmission (KBr pellet) and attenuated total reflection (ATR) Fourier transform infrared (FT-IR) and FT-Raman spectroscopies was based on substantial variability of pollen grain size, shape, and relative biochemical composition. Depending on the penetration depth of the probe light, vibrational techniques acquire predominant information either on pollen grain walls (FT-Raman and ATR-FT-IR) or intracellular material (transmission FT-IR). Compared with the other two methods, transmission FT-IR obtains more comprehensive information and as a result achieves superior spectral identification and discrimination of pollen. The results strongly indicate that biochemical similarities of pollen grains belonging to the same plant genus or family lead to similar features in corresponding vibrational spectra. The exploitation of that property in aerobiological monitoring was demonstrated by simple and rapid pollen identification based on relatively small spectral libraries, with the same (or better) taxonomic resolution as that provided by optical microscopy. Therefore, the clear correlation between vibrational spectra and pollen grain morphology, biochemistry, and taxonomy is obtained, while successful pollen identification illustrates the practicability of such an approach in environmental studies.

  11. Wave propagation of spectral energy content in a granular chain

    Directory of Open Access Journals (Sweden)

    Shrivastava Rohit Kumar


    Full Text Available A mechanical wave is propagation of vibration with transfer of energy and momentum. Understanding the spectral energy characteristics of a propagating wave through disordered granular media can assist in understanding the overall properties of wave propagation through inhomogeneous materials like soil. The study of these properties is aimed at modeling wave propagation for oil, mineral or gas exploration (seismic prospecting or non-destructive testing of the internal structure of solids. The focus is on the total energy content of a pulse propagating through an idealized one-dimensional discrete particle system like a mass disordered granular chain, which allows understanding the energy attenuation due to disorder since it isolates the longitudinal P-wave from shear or rotational modes. It is observed from the signal that stronger disorder leads to faster attenuation of the signal. An ordered granular chain exhibits ballistic propagation of energy whereas, a disordered granular chain exhibits more diffusive like propagation, which eventually becomes localized at long time periods. For obtaining mean-field macroscopic/continuum properties, ensemble averaging has been used, however, such an ensemble averaged spectral energy response does not resolve multiple scattering, leading to loss of information, indicating the need for a different framework for micro-macro averaging.

  12. Spectral Predictors

    Energy Technology Data Exchange (ETDEWEB)

    Ibarria, L; Lindstrom, P; Rossignac, J


    Many scientific, imaging, and geospatial applications produce large high-precision scalar fields sampled on a regular grid. Lossless compression of such data is commonly done using predictive coding, in which weighted combinations of previously coded samples known to both encoder and decoder are used to predict subsequent nearby samples. In hierarchical, incremental, or selective transmission, the spatial pattern of the known neighbors is often irregular and varies from one sample to the next, which precludes prediction based on a single stencil and fixed set of weights. To handle such situations and make the best use of available neighboring samples, we propose a local spectral predictor that offers optimal prediction by tailoring the weights to each configuration of known nearby samples. These weights may be precomputed and stored in a small lookup table. We show that predictive coding using our spectral predictor improves compression for various sources of high-precision data.

  13. Localized Surface Plasmons in Vibrating Graphene Nanodisks

    DEFF Research Database (Denmark)

    Wang, Weihua; Li, Bo-Hong; Stassen, Erik


    in graphene disks have the additional benefit to be highly tunable via electrical stimulation. Mechanical vibrations create structural deformations in ways where the excitation of localized surface plasmons can be strongly modulated. We show that the spectral shift in such a scenario is determined...... by a complex interplay between the symmetry and shape of the modal vibrations and the plasmonic mode pattern. Tuning confined modes of light in graphene via acoustic excitations, paves new avenues in shaping the sensitivity of plasmonic detectors, and in the enhancement of the interaction with optical emitters...

  14. Methoxyethanol, Ethoxyethanol, and Spectral Complexity (United States)

    Westerfield, J. H.; Riffe, Erika; Phillips, Maria; Johnson, Erika; Shipman, Steven


    Over the last few years, we have been working to improve the AUTOFIT programpand extend it to work on more complex spectra, especially spectra collected near room temperature. In this talk, we will discuss the problem of spectral complexity and the challenges it poses for moving to increasingly complicated systems. This will be highlighted by the cases of methoxyethanol, in which AUTOFIT was able to easily extract contributions from the ground state and four vibrationally excited states, and ethoxyethanol, in which AUTOFIT had difficulty identifying more than the ground vibrational state without the assistance of additional double resonance measurements. Seifert, N.A., Finneran, I.A., Perez, C., Zaleski, D.P., Neill, J.L., Steber, A.L., Suenram, R.D., Lesarri, A., Shipman, S.T., Pate, B.H., J. Mol. Spec. 312, 13-21 (2015)

  15. Molecular conformational analysis, reactivity, vibrational spectral analysis and molecular dynamics and docking studies of 6-chloro-5-isopropylpyrimidine-2,4(1H,3H)-dione, a potential precursor to bioactive agent (United States)

    Al-Omary, Fatmah A. M.; Mary, Y. Sheena; Beegum, Shargina; Panicker, C. Yohannan; Al-Shehri, Mona M.; El-Emam, Ali A.; Armaković, Stevan; Armaković, Sanja J.; Van Alsenoy, C.


    FT-IR and FT-Raman spectra of 6-chloro-5-isopropylpyrimidine-2,4(1H,3H)-dione were recorded and analyzed. The vibrational wavenumbers were computed using DFT quantum chemical calculations and the data obtained from wavenumber calculations are used to assign the experimentally obtained bands. Potential energy distribution was done using GAR2PED software. The geometrical parameters of the title compound are in agreement with the XRD results. NBO analysis, frontier molecular orbital and first and second hyperpolarizability and molecular electrostatic potential results are also reported. The possible electrophile attacking sites of the title compound is identified using MEP surface plot study. Molecule sites prone to electrophilic attacks were identified using average local ionization energy surfaces, while further insight into the local reactivity properties of the title molecule has been gained by calculation of Fukui functions. Intra-molecular non-covalent interactions have been detected and visualized. Degradation properties based on autoxidation and hydrolysis have been investigated by calculation of bond dissociation energies and radial distribution functions, respectively. From the molecular docking study, the ligand binds at the active site of the substrate by weak non-covalent interactions and amino acids Leu89 forms alkyl interaction with the CH3 groups and Glu90 amino acid forms π-anion interaction with the pyrimidine ring and Thr369 and Ser366 amino acids form H-bond interaction with the Cdbnd O and NH group, respectively. From the conformational analysis, the calculated structures show that the C6C9C10 angle in the most stable form is about 8° smaller compared to the C8C9C10 angle, indicating a higher repulsive force between the (CH3)2HC- moiety and the chlorine atom due to the size of chlorine compared to oxygen atoms.

  16. Tunable Passive Vibration Suppressor (United States)

    Boechler, Nicholas (Inventor); Dillon, Robert Peter (Inventor); Daraio, Chiara (Inventor); Davis, Gregory L. (Inventor); Shapiro, Andrew A. (Inventor); Borgonia, John Paul C. (Inventor); Kahn, Daniel Louis (Inventor)


    An apparatus and method for vibration suppression using a granular particle chain. The granular particle chain is statically compressed and the end particles of the chain are attached to a payload and vibration source. The properties of the granular particles along with the amount of static compression are chosen to provide desired filtering of vibrations.

  17. Vibrations and Eigenvalues

    Indian Academy of Sciences (India)

    We make music by causing strings, membranes, or air columns to vibrate. Engineers design safe structures by control- ling vibrations. I will describe to you a very simple vibrating system and the mathematics needed to analyse it. The ideas were born in the work of Joseph-Louis Lagrange (1736–1813), and I begin by quot-.

  18. Vibration Analysis Of a Self-Excited Elastic Beam

    Directory of Open Access Journals (Sweden)

    M. A. Barrón-M


    Full Text Available The vibration behavior and the energy exchange among the normal modes of a clamped-free self-excited elasticbeam are analyzed in this work. To model this kind of beam, the damping term of a van der Pol oscillator is directlyadded to the equation of a linear elastic beam, yielding a single nonlinear partial differential equation. To solve thisequation, a spectral method is employed. Three vibration modes are considered in the analysis, and the values of theself-exciting constant are varied in order to cover from linear to nonlinear vibration behavior. Multiple frequencies ofthe nonlinear beam are determined through the power spectral density of the beam free-end time series. Given thatthis relatively simple model mimics at least in a qualitative way some key issues of the fluid-structure problem, it couldbe potentially useful for fatigue studies and vibration analysis of rotating blades in turbomachinery.

  19. Vibration of hydraulic machinery

    CERN Document Server

    Wu, Yulin; Liu, Shuhong; Dou, Hua-Shu; Qian, Zhongdong


    Vibration of Hydraulic Machinery deals with the vibration problem which has significant influence on the safety and reliable operation of hydraulic machinery. It provides new achievements and the latest developments in these areas, even in the basic areas of this subject. The present book covers the fundamentals of mechanical vibration and rotordynamics as well as their main numerical models and analysis methods for the vibration prediction. The mechanical and hydraulic excitations to the vibration are analyzed, and the pressure fluctuations induced by the unsteady turbulent flow is predicted in order to obtain the unsteady loads. This book also discusses the loads, constraint conditions and the elastic and damping characters of the mechanical system, the structure dynamic analysis, the rotor dynamic analysis and the system instability of hydraulic machines, including the illustration of monitoring system for the instability and the vibration in hydraulic units. All the problems are necessary for vibration pr...

  20. Near infrared spectral imaging of explosives using a tunable laser source

    Energy Technology Data Exchange (ETDEWEB)

    Klunder, G L; Margalith, E; Nguyen, L K


    Diffuse reflectance near infrared hyperspectral imaging is an important analytical tool for a wide variety of industries, including agriculture consumer products, chemical and pharmaceutical development and production. Using this technique as a method for the standoff detection of explosive particles is presented and discussed. The detection of the particles is based on the diffuse reflectance of light from the particle in the near infrared wavelength range where CH, NH, OH vibrational overtones and combination bands are prominent. The imaging system is a NIR focal plane array camera with a tunable OPO/laser system as the illumination source. The OPO is programmed to scan over a wide spectral range in the NIR and the camera is synchronized to record the light reflected from the target for each wavelength. The spectral resolution of this system is significantly higher than that of hyperspectral systems that incorporate filters or dispersive elements. The data acquisition is very fast and the entire hyperspectral cube can be collected in seconds. A comparison of data collected with the OPO system to data obtained with a broadband light source with LCTF filters is presented.

  1. Reconstruction of Input Excitation Acting on Vibration Isolation System

    Directory of Open Access Journals (Sweden)

    Pan Zhou


    Full Text Available Vibration isolation systems are widely employed in automotive, marine, aerospace, and other engineering fields. Accurate input forces are of great significance for mechanical design, vibration prediction, and structure modification and optimization. One-stage vibration isolation system including engine, vibration isolators, and flexible supporting structure is modeled theoretically in this paper. Input excitation acting on the vibration isolation system is reconstructed using dynamic responses measured on engine and supporting structure under in-suit condition. The reconstructed forces reveal that dynamic responses on rigid body are likely to provide more accurate estimation results. Moreover, in order to improve the accuracy of excitation reconstructed by dynamic responses on flexible supporting structure, auto/cross-power spectral density function is utilized to reduce measurement noise.

  2. Mid infrared upconversion spectroscopy using diffuse reflectance

    DEFF Research Database (Denmark)

    Sanders, Nicolai Højer; Kehlet, Louis M.; Dam, Jeppe Seidelin


    We present a novel approach for mid infrared (mid-IR) spectral analysis using upconversion technology applied in a diffuse reflectance setup. We demonstrate experimentally that mid-IR spectral features in the 2.6-4 μm range using different test samples (e.g. zeolites) can be obtained. The results...

  3. Vibration fatigue using modal decomposition (United States)

    Mršnik, Matjaž; Slavič, Janko; Boltežar, Miha


    Vibration-fatigue analysis deals with the material fatigue of flexible structures operating close to natural frequencies. Based on the uniaxial stress response, calculated in the frequency domain, the high-cycle fatigue model using the S-N curve material data and the Palmgren-Miner hypothesis of damage accumulation is applied. The multiaxial criterion is used to obtain the equivalent uniaxial stress response followed by the spectral moment approach to the cycle-amplitude probability density estimation. The vibration-fatigue analysis relates the fatigue analysis in the frequency domain to the structural dynamics. However, once the stress response within a node is obtained, the physical model of the structure dictating that response is discarded and does not propagate through the fatigue-analysis procedure. The structural model can be used to evaluate how specific dynamic properties (e.g., damping, modal shapes) affect the damage intensity. A new approach based on modal decomposition is presented in this research that directly links the fatigue-damage intensity with the dynamic properties of the system. It thus offers a valuable insight into how different modes of vibration contribute to the total damage to the material. A numerical study was performed showing good agreement between results obtained using the newly presented approach with those obtained using the classical method, especially with regards to the distribution of damage intensity and critical point location. The presented approach also offers orders of magnitude faster calculation in comparison with the conventional procedure. Furthermore, it can be applied in a straightforward way to strain experimental modal analysis results, taking advantage of experimentally measured strains.

  4. Stochastic models for surface diffusion of molecules

    Energy Technology Data Exchange (ETDEWEB)

    Shea, Patrick, E-mail:; Kreuzer, Hans Jürgen [Department of Physics and Atmospheric Science, Dalhousie University, Halifax, Nova Scotia B3H 3J5 (Canada)


    We derive a stochastic model for the surface diffusion of molecules, starting from the classical equations of motion for an N-atom molecule on a surface. The equation of motion becomes a generalized Langevin equation for the center of mass of the molecule, with a non-Markovian friction kernel. In the Markov approximation, a standard Langevin equation is recovered, and the effect of the molecular vibrations on the diffusion is seen to lead to an increase in the friction for center of mass motion. This effective friction has a simple form that depends on the curvature of the lowest energy diffusion path in the 3N-dimensional coordinate space. We also find that so long as the intramolecular forces are sufficiently strong, memory effects are usually not significant and the Markov approximation can be employed, resulting in a simple one-dimensional model that can account for the effect of the dynamics of the molecular vibrations on the diffusive motion.

  5. Spectral Imaging by Upconversion

    DEFF Research Database (Denmark)

    Dam, Jeppe Seidelin; Pedersen, Christian; Tidemand-Lichtenberg, Peter


    We present a method to obtain spectrally resolved images using upconversion. By this method an image is spectrally shifted from one spectral region to another wavelength. Since the process is spectrally sensitive it allows for a tailored spectral response. We believe this will allow standard...... silicon based cameras designed for visible/near infrared radiation to be used for spectral images in the mid infrared. This can lead to much lower costs for such imaging devices, and a better performance....

  6. Model Indepedent Vibration Control


    Yuan, Jing


    A NMIFC system is proposed for broadband vibration control. It has two important features. Feature F1 is that the NMIFC is stable without introducing any invasive effects, such as probing signals or controller perturbations, into the vibration system; feature F2 is

  7. Vibration Theory, Vol. 3

    DEFF Research Database (Denmark)

    Nielsen, Søren R. K.

    The present textbook has been written based on previous lecture notes for a course on stochastic vibration theory that is being given on the 9th semester at Aalborg University for M. Sc. students in structural engineering. The present 4th edition of this textbook on linear stochastic vibration...

  8. Vibration Theory, Vol. 3

    DEFF Research Database (Denmark)

    Nielsen, Søren R. K.

    The present textbook has been written based on previous lecture notes for a course on stochastic vibration theory that is being given on the 9th semester at Aalborg University for M. Sc. students in structural engineering. The present 2nd edition of this textbook on linear stochastic vibration...

  9. Hydroelastic Vibrations of Ships

    DEFF Research Database (Denmark)

    Jensen, Jørgen Juncher; Folsø, Rasmus


    A formula for the necessary hull girder bending stiffness required to avoid serious springing vibrations is derived. The expression takes into account the zero crossing period of the waves, the ship speed and main dimensions. For whipping vibrations the probability of exceedance for the combined...

  10. Gearbox vibration diagnostic analyzer (United States)


    This report describes the Gearbox Vibration Diagnostic Analyzer installed in the NASA Lewis Research Center's 500 HP Helicopter Transmission Test Stand to monitor gearbox testing. The vibration of the gearbox is analyzed using diagnostic algorithms to calculate a parameter indicating damaged components.

  11. Mechanical vibration and shock analysis, sinusoidal vibration

    CERN Document Server

    Lalanne, Christian


    Everything engineers need to know about mechanical vibration and one authoritative reference work! This fully updated and revised 3rd edition addresses the entire field of mechanical vibration and shock as one of the most important types of load and stress applied to structures, machines and components in the real world. Examples include everything from the regular and predictable loads applied to turbines, motors or helicopters by the spinning of their constituent parts to the ability of buildings to withstand damage from wind loads or explosions, and the need for cars to m

  12. Spectral Decomposition Algorithm (SDA) (United States)

    National Aeronautics and Space Administration — Spectral Decomposition Algorithm (SDA) is an unsupervised feature extraction technique similar to PCA that was developed to better distinguish spectral features in...

  13. Vibrations of rotating machinery

    CERN Document Server

    Matsushita, Osami; Kanki, Hiroshi; Kobayashi, Masao; Keogh, Patrick


    This book opens with an explanation of the vibrations of a single degree-of-freedom (dof) system for all beginners. Subsequently, vibration analysis of multi-dof systems is explained by modal analysis. Mode synthesis modeling is then introduced for system reduction, which aids understanding in a simplified manner of how complicated rotors behave. Rotor balancing techniques are offered for rigid and flexible rotors through several examples. Consideration of gyroscopic influences on the rotordynamics is then provided and vibration evaluation of a rotor-bearing system is emphasized in terms of forward and backward whirl rotor motions through eigenvalue (natural frequency and damping ratio) analysis. In addition to these rotordynamics concerning rotating shaft vibration measured in a stationary reference frame, blade vibrations are analyzed with Coriolis forces expressed in a rotating reference frame. Other phenomena that may be assessed in stationary and rotating reference frames include stability characteristic...

  14. Vibrational lineshapes of adsorbates on solid surfaces (United States)

    Ueba, H.

    A review is presented of the current activity in vibrational spectroscopy of adsorbates on metal surfaces. A brief introduction of the representative spectroscopies is given to demonstrate the rich information contained in vibrational spectra, which are characterized by their intensity, peak position and width. Analysis of vibrational spectra enables us to gain the deep insight into not only the local character of adsorption site or geometry, but also the dynamical interaction between the adsorbates or between the adsorbate and the substrate. Some recent instructive experimental results, mostly of a CO molecule adsorbed on various metal surfaces, are accompanied by the corresponding theoretical recipe for vibrational excitation mechanisms. Wide spread experimental results of the C-O stretching frequency of CO adsorbed on metal surfaces are discussed in terms of the chemical effect involving the static and dynamic charge transfers between the chemisorbed CO and metal, and also of the electrostatic dipole-dipole interaction between the molecules. The central subject of this review is directed to the linshapes characterized by the vibrational relaxation processes of adsorbates. A simple and transparent model is introduced to show that the characteristic decay time of the correlation function for the vibrational coordinates is the key quantity to determine the spectral lineshapes. Recent experimental results focused on a search for an intrinsic broadening mechanism are reviewed in the light of the so-called T1 (energy) and T2 (phase) relaxation processesof the vibrational excited states of adsorbates. Those are the vibrational energy dissipation into the elementary excitation, such as phonons or electron-hole pairs in the metal substrate, and pure dephasing due to the energy exchange with the sorroundings. The change of width and frequency by varying the experimental variables, such as temperature or isotope effect, provides indispensable knowledge for the dynamical

  15. Quantitative Analysis of Spectral Impacts on Silicon Photodiode Radiometers: Preprint

    Energy Technology Data Exchange (ETDEWEB)

    Myers, D. R.


    Inexpensive broadband pyranometers with silicon photodiode detectors have a non-uniform spectral response over the spectral range of 300-1100 nm. The response region includes only about 70% to 75% of the total energy in the terrestrial solar spectral distribution from 300 nm to 4000 nm. The solar spectrum constantly changes with solar position and atmospheric conditions. Relative spectral distributions of diffuse hemispherical irradiance sky radiation and total global hemispherical irradiance are drastically different. This analysis convolves a typical photodiode response with SMARTS 2.9.5 spectral model spectra for different sites and atmospheric conditions. Differences in solar component spectra lead to differences on the order of 2% in global hemispherical and 5% or more in diffuse hemispherical irradiances from silicon radiometers. The result is that errors of more than 7% can occur in the computation of direct normal irradiance from global hemispherical irradiance and diffuse hemispherical irradiance using these radiometers.

  16. Structural, vibrational, NMR, quantum chemical, DNA binding and ...

    Indian Academy of Sciences (India)

    Smith B C 1996 In Infrared Spectral Interpretation. (Boca Raton, FL: CRC Press). 31. Green J H S, Harrison D J and Kynaston W 1971. Spectrochim. Acta A 27 2199. 32. Varsanyi G 1974 In Assignments for Vibrational Spectra of Seven Hundred Benzene Derivatives. Vols. 1 and 2. (Budapest: Adam Hilger). 33. Lutz E T G ...

  17. Analysis of real-time vibration data (United States)

    Safak, E.


    In recent years, a few structures have been instrumented to provide continuous vibration data in real time, recording not only large-amplitude motions generated by extreme loads, but also small-amplitude motions generated by ambient loads. The main objective in continuous recording is to track any changes in structural characteristics, and to detect damage after an extreme event, such as an earthquake or explosion. The Fourier-based spectral analysis methods have been the primary tool to analyze vibration data from structures. In general, such methods do not work well for real-time data, because real-time data are mainly composed of ambient vibrations with very low amplitudes and signal-to-noise ratios. The long duration, linearity, and the stationarity of ambient data, however, allow us to utilize statistical signal processing tools, which can compensate for the adverse effects of low amplitudes and high noise. The analysis of real-time data requires tools and techniques that can be applied in real-time; i.e., data are processed and analyzed while being acquired. This paper presents some of the basic tools and techniques for processing and analyzing real-time vibration data. The topics discussed include utilization of running time windows, tracking mean and mean-square values, filtering, system identification, and damage detection.

  18. Structural and vibrational spectral studies on hydrogen bonded salts ...

    Indian Academy of Sciences (India)

    compounds were optimized with the Density Functional Theory (DFT) using B3LYP function and the Hartree-. Fock (HF) level with a6-311++G(d ... which have more importance in the areas of molecular recognition, crystal engineering ... acceptor sites, viz., nitrogen and chlorine atoms in the present case. The present work ...

  19. Structural Stability and Vibration

    DEFF Research Database (Denmark)

    Wiggers, Sine Leergaard; Pedersen, Pauli

    This book offers an integrated introduction to the topic of stability and vibration. Strikingly, it describes stability as a function of boundary conditions and eigenfrequency as a function of both boundary conditions and column force. Based on a post graduate course held by the author at the Uni......This book offers an integrated introduction to the topic of stability and vibration. Strikingly, it describes stability as a function of boundary conditions and eigenfrequency as a function of both boundary conditions and column force. Based on a post graduate course held by the author...... and their derivation, thus stimulating them to write interactive and dynamic programs to analyze instability and vibrational modes....

  20. 31P-edited diffusion-ordered 1H NMR spectroscopy for the spectral isolation and identification of organophosphorus compounds related to chemical weapons agents and their degradation products. (United States)

    Mayer, Brian P; Valdez, Carlos A; Hok, Saphon; Chinn, Sarah C; Hart, Bradley R


    Organophosphorus compounds represent a large class of molecules that include pesticides, flame-retardants, biologically relevant molecules, and chemical weapons agents (CWAs). The detection and identification of organophosphorus molecules, particularly in the cases of pesticides and CWAs, are paramount to the verification of international treaties by various organizations. To that end, novel analytical methodologies that can provide additional support to traditional analyses are important for unambiguous identification of these compounds. We have developed an NMR method that selectively edits for organophosphorus compounds via (31)P-(1)H heteronuclear single quantum correlation (HSQC) and provides an additional chromatographic-like separation based on self-diffusivities of the individual species via (1)H diffusion-ordered spectroscopy (DOSY): (1)H-(31)P HSQC-DOSY. The technique is first validated using the CWA VX (O-ethyl S-[2-(diisopropylamino)ethyl] methylphosphonothioate) by traditional two-dimensional DOSY spectra. We then extend this technique to a complex mixture of VX degradation products and identify all the main phosphorus-containing byproducts generated after exposure to a zinc-cyclen organometallic homogeneous catalyst.

  1. On the Spectral Singularities and Spectrality of the Hill Operator


    Veliev, O. A.


    First we study the spectral singularity at infinity and investigate the connections of the spectral singularities and the spectrality of the Hill operator. Then we consider the spectral expansion when there is not the spectral singularity at infinity.

  2. Vibration Analysis and the Accelerometer (United States)

    Hammer, Paul


    Have you ever put your hand on an electric motor or motor-driven electric appliance and felt it vibrate? Ever wonder why it vibrates? What is there about the operation of the motor, or the object to which it is attached, that causes the vibrations? Is there anything "regular" about the vibrations, or are they the result of random causes? In this…

  3. [Measurement and analysis of hand-transmitted vibration of vibration tools in workplace for automobile casting and assembly]. (United States)

    Xie, X S; Qi, C; Du, X Y; Shi, W W; Zhang, M


    To investigate the features of hand-transmitted vibration of common vibration tools in the workplace for automobile casting and assembly. From September to October, 2014, measurement and spectral analysis were performed for 16 typical hand tools(including percussion drill, pneumatic wrench, grinding machine, internal grinder, and arc welding machine) in 6 workplaces for automobile casting and assembly according to ISO 5349-1-2001 Mechanical vibration-Measurement and evaluation of human exposure to hand-transmitted vibration-part 1: General requirements and ISO 5349-2-2001 Mechanical vibration-Measurement and evaluation of human exposure to hand-transmitted vibration-Part 2: Practical guidance for measurement in the workplace. The vibration acceleration waveforms of shearing machine, arc welding machine, and pneumatic wrench were mainly impact wave and random wave, while those of internal grinder, angle grinder, percussion drill, and grinding machine were mainly long-and short-period waves. The daily exposure duration to vibration of electric wrench, pneumatic wrench, shearing machine, percussion drill, and internal grinder was about 150 minutes, while that of plasma cutting machine, angle grinder, grinding machine, bench grinder, and arc welding machine was about 400 minutes. The range of vibration total value(ahv) was as follows: pneumatic wrench 0.30~11.04 m/s(2), grinding wheel 1.61~8.97 m/s(2), internal grinder 1.46~8.70 m/s(2), percussion drill 11.10~14.50 m/s(2), and arc welding machine 0.21~2.18 m/s(2). The workers engaged in cleaning had the longest daily exposure duration to vibration, and the effective value of 8-hour energy-equivalent frequency-weighted acceleration for them[A(8)] was 8.03 m/s(2), while this value for workers engaged in assembly was 4.78 m/s(2). The frequency spectrogram with an 1/3-time frequency interval showed that grinding machine, angle grinder, and percussion drill had a high vibration acceleration, and the vibration limit curve

  4. Vibrations and Stability

    DEFF Research Database (Denmark)

    Thomsen, Jon Juel

    About this textbook An ideal text for students that ties together classical and modern topics of advanced vibration analysis in an interesting and lucid manner. It provides students with a background in elementary vibrations with the tools necessary for understanding and analyzing more complex...... dynamical phenomena that can be encountered in engineering and scientific practice. It progresses steadily from linear vibration theory over various levels of nonlinearity to bifurcation analysis, global dynamics and chaotic vibrations. It trains the student to analyze simple models, recognize nonlinear...... phenomena and work with advanced tools such as perturbation analysis and bifurcation analysis. Explaining theory in terms of relevant examples from real systems, this book is user-friendly and meets the increasing interest in non-linear dynamics in mechanical/structural engineering and applied mathematics...

  5. Remote identification of the vibration amplitude of ship hull

    Directory of Open Access Journals (Sweden)

    A. N. Pinchuk


    Full Text Available The aim is to develop the methodological support to determine vibration amplitude of the ship hull remotely using a coherent radar centimeter range based on the variation of the Doppler signal spectrum reflected from a vibrating surface.The paper presents a synthesized mathematical model of the radio signal reflected from the vibrating surface. It is the signal of coherent radar of continuous radiation with a known carrier frequency and the amplitude of the radiated signal. In the synthesis it was believed that the displacement in the radial direction with respect to the vibrating surface radar was sinusoidal.The dependences of the vibration amplitude on the value of the normalized Doppler radio signal spectrum at the second harmonic frequency are obtained. Cycle results of field experiments to study the variability of the sea surface, determining the level of its roughness, allows us to establish that the energy of surface waves of gravitational-capillary range has a high correlation with the wind speed. It is proved that the ratio of the spectral density levels at vibration frequency and its multiple frequencies is specified by the index of phase modulation linearly related to the amplitude of vibration of the ship hull.The results are significant for radar (radar detection of water targets using the coherent radar of centimeter range, ensuring the correct records of noise generated by the scattering of radio waves from the water surface.

  6. Instrument for monitoring spectral acceleration on response seismic ground motion

    Czech Academy of Sciences Publication Activity Database

    Buben, Jiří; Rudajev, Vladimír


    Roč. 3, č. 2 (2006), s. 31-38 ISSN 1214-9705 R&D Projects: GA AV ČR IBS3046201 Institutional research plan: CEZ:AV0Z30460519; CEZ:AV0Z30130516 Keywords : vibration acceleration * spectral response * seismic recorder Subject RIV: DC - Siesmology, Volcanology, Earth Structure

  7. Vibrational microspectroscopy analysis of human lenses (United States)

    Paluszkiewicz, C.; Piergies, N.; Sozańska, A.; Chaniecki, P.; Rękas, M.; Miszczyk, J.; Gajda, M.; Kwiatek, W. M.


    In this study we present vibrational analysis of healthy (non-affected by cataract) and cataractous human lenses by means of Raman and FTIR spectroscopy methods. The performed analysis provides complex information about the secondary structure of the proteins and conformational changes of the amino acid residues due to the formation of opacification of human lens. Briefly, the changes in the conformation of the Tyr and Trp residues and the protein secondary structure between the healthy and cataractous samples, were recognized. Moreover, the observed spectral pattern suggests that the process of cataract development does not occur uniformly over the entire volume of the lens.

  8. Super-multiplex vibrational imaging (United States)

    Wei, Lu; Chen, Zhixing; Shi, Lixue; Long, Rong; Anzalone, Andrew V.; Zhang, Luyuan; Hu, Fanghao; Yuste, Rafael; Cornish, Virginia W.; Min, Wei


    The ability to visualize directly a large number of distinct molecular species inside cells is increasingly essential for understanding complex systems and processes. Even though existing methods have successfully been used to explore structure-function relationships in nervous systems, to profile RNA in situ, to reveal the heterogeneity of tumour microenvironments and to study dynamic macromolecular assembly, it remains challenging to image many species with high selectivity and sensitivity under biological conditions. For instance, fluorescence microscopy faces a ‘colour barrier’, owing to the intrinsically broad (about 1,500 inverse centimetres) and featureless nature of fluorescence spectra that limits the number of resolvable colours to two to five (or seven to nine if using complicated instrumentation and analysis). Spontaneous Raman microscopy probes vibrational transitions with much narrower resonances (peak width of about 10 inverse centimetres) and so does not suffer from this problem, but weak signals make many bio-imaging applications impossible. Although surface-enhanced Raman scattering offers high sensitivity and multiplicity, it cannot be readily used to image specific molecular targets quantitatively inside live cells. Here we use stimulated Raman scattering under electronic pre-resonance conditions to image target molecules inside living cells with very high vibrational selectivity and sensitivity (down to 250 nanomolar with a time constant of 1 millisecond). We create a palette of triple-bond-conjugated near-infrared dyes that each displays a single peak in the cell-silent Raman spectral window; when combined with available fluorescent probes, this palette provides 24 resolvable colours, with the potential for further expansion. Proof-of-principle experiments on neuronal co-cultures and brain tissues reveal cell-type-dependent heterogeneities in DNA and protein metabolism under physiological and pathological conditions, underscoring the

  9. On spectral distribution of high dimensional covariation matrices

    DEFF Research Database (Denmark)

    Heinrich, Claudio; Podolskij, Mark

    In this paper we present the asymptotic theory for spectral distributions of high dimensional covariation matrices of Brownian diffusions. More specifically, we consider N-dimensional Itô integrals with time varying matrix-valued integrands. We observe n equidistant high frequency data points...... of the underlying Brownian diffusion and we assume that N/n -> c in (0,oo). We show that under a certain mixed spectral moment condition the spectral distribution of the empirical covariation matrix converges in distribution almost surely. Our proof relies on method of moments and applications of graph theory....

  10. Diffuse scattering

    Energy Technology Data Exchange (ETDEWEB)

    Kostorz, G. [Eidgenoessische Technische Hochschule, Angewandte Physik, Zurich (Switzerland)


    While Bragg scattering is characteristic for the average structure of crystals, static local deviations from the average lattice lead to diffuse elastic scattering around and between Bragg peaks. This scattering thus contains information on the occupation of lattice sites by different atomic species and on static local displacements, even in a macroscopically homogeneous crystalline sample. The various diffuse scattering effects, including those around the incident beam (small-angle scattering), are introduced and illustrated by typical results obtained for some Ni alloys. (author) 7 figs., 41 refs.

  11. Vibrational assignments for 7-methyl-4-bromomethylcoumarin, as aided by RHF and B3LYP/6-31G* calculations. (United States)

    Sortur, Veenasangeeta; Yenagi, Jayashree; Tonannavar, J; Jadhav, V B; Kulkarni, M V


    Infrared (4000-400 cm(-1)) and Raman (3500-50 cm(-1)) spectral measurements have been made for the solid sample of 7-methyl-4-bromomethylcoumarin. Electronic structure calculations at RHF/6-31G* and B3LYP/6-31G* levels of theory have been performed, giving equilibrium geometries, harmonic vibrational spectra and normal modes. Different orientations of bromomethyl group have yielded only two conformers, of which the most stable one lying lower from the other conformer by approximately 7.99 kJ/mol, is non-planar with no symmetry. A complete assignment of the vibrational modes, aided by the calculations, has been proposed. Coupled vibrations are manifest in many modes. Some spectral features, compared to 6-methyl-4-bromomethylcoumarin, show changes across both IR and Raman spectra, involving mainly skeletal vibrations, and to a lesser degree, methyl and bromomethyl vibrations. Low-frequency vibrations below 150 cm(-1) are assigned to lattice modes.

  12. Fast diffusion of water nanodroplets on graphene

    CERN Document Server

    Ma, Ming; Michaelides, Angelos; Aeppli, Gabriel


    Diffusion across surfaces generally involves motion on a vibrating but otherwise stationary substrate. Here, using molecular dynamics, we show that a layered material such as graphene opens up a new mechanism for surface diffusion whereby adsorbates are carried by propagating ripples via a motion similar to surfing. For water nanodroplets, we demonstrate that the mechanism leads to exceedingly fast diffusion that is 2-3 orders of magnitude faster than the self-diffusion of water molecules in liquid water. We also reveal the underlying principles that regulate this new mechanism for diffusion and show how it also applies to adsorbates other than water, thus opening up the prospect of achieving fast and controllable motion of adsorbates across material surfaces more generally.

  13. Multi-spectral imaging of oxygen saturation (United States)

    Savelieva, Tatiana A.; Stratonnikov, Aleksander A.; Loschenov, Victor B.


    The system of multi-spectral imaging of oxygen saturation is an instrument that can record both spectral and spatial information about a sample. In this project, the spectral imaging technique is used for monitoring of oxygen saturation of hemoglobin in human tissues. This system can be used for monitoring spatial distribution of oxygen saturation in photodynamic therapy, surgery or sports medicine. Diffuse reflectance spectroscopy in the visible range is an effective and extensively used technique for the non-invasive study and characterization of various biological tissues. In this article, a short review of modeling techniques being currently in use for diffuse reflection from semi-infinite turbid media is presented. A simple and practical model for use with a real-time imaging system is proposed. This model is based on linear approximation of the dependence of the diffuse reflectance coefficient on relation between absorbance and reduced scattering coefficient. This dependence was obtained with the Monte Carlo simulation of photon propagation in turbid media. Spectra of the oxygenated and deoxygenated forms of hemoglobin differ mostly in the red area (520 - 600 nm) and have several characteristic points there. Thus four band-pass filters were used for multi-spectral imaging. After having measured the reflectance, the data obtained are used for fitting the concentration of oxygenated and free hemoglobin, and hemoglobin oxygen saturation.

  14. The influence of vibrational state-resolved transport coefficients on the wave propagation in diatomic gases (United States)

    Kremer, Gilberto M.; Kunova, Olga V.; Kustova, Elena V.; Oblapenko, George P.


    A detailed kinetic-theory model for the vibrationally state-resolved transport coefficients is developed taking into account the dependence of the collision cross section on the size of vibrationally excited molecule. Algorithms for the calculation of shear and bulk viscosity, thermal conductivity, thermal diffusion and diffusion coefficients for vibrational states are proposed. The transport coefficients are evaluated for single-component diatomic gases N2, O2, NO, H2, Cl2 in the wide range of temperature, and the effects of molecular diameters and the number of accounted states are discussed. The developed model is applied to study wave propagation in diatomic gases. For the case of initial Boltzmann distribution, the influence of vibrational excitation on the phase velocity and attenuation coefficient is found to be weak. We expect more significant effect in the case of initial thermal non-equilibrium, for instance in gases with optically pumped selected vibrational states.

  15. Relativistic diffusion. (United States)

    Haba, Z


    We discuss relativistic diffusion in proper time in the approach of Schay (Ph.D. thesis, Princeton University, Princeton, NJ, 1961) and Dudley [Ark. Mat. 6, 241 (1965)]. We derive (Langevin) stochastic differential equations in various coordinates. We show that in some coordinates the stochastic differential equations become linear. We obtain momentum probability distribution in an explicit form. We discuss a relativistic particle diffusing in an external electromagnetic field. We solve the Langevin equations in the case of parallel electric and magnetic fields. We derive a kinetic equation for the evolution of the probability distribution. We discuss drag terms leading to an equilibrium distribution. The relativistic analog of the Ornstein-Uhlenbeck process is not unique. We show that if the drag comes from a diffusion approximation to the master equation then its form is strongly restricted. The drag leading to the Tsallis equilibrium distribution satisfies this restriction whereas the one of the Jüttner distribution does not. We show that any function of the relativistic energy can be the equilibrium distribution for a particle in a static electric field. A preliminary study of the time evolution with friction is presented. It is shown that the problem is equivalent to quantum mechanics of a particle moving on a hyperboloid with a potential determined by the drag. A relation to diffusions appearing in heavy ion collisions is briefly discussed.

  16. Analysis of the surface load and radiated sound of a vibrating airfoil with application to the experiment of Brooks (United States)

    Yates, J. E.


    A method is developed for calculating the surface load and radiated sound from a vibrating surface in a compressible viscous fluid. The method is applied to a thin two-dimensional elliptic cross-section. For large values of the viscous diffusion parameter, the surface load tends to an elliptic distribution in agreement with the results of inviscid theory when edge pressure continuity is enforced. For thin surfaces, the surface load is insensitive to variations in the thickness ratio. A three-dimensional spectral technique is developed to calculate the inviscid surface load and radiated sound from a thin vibrating airfoil. The inviscid theory predicts the correct form of the far field sound pressure and its phase. The actual levels are somewhat sensitive to the choice of theoretical spanwise surface pressure mode but are in better agreement with the experiment than the surface pressure. The comparison of theoretical and experimental surface pressure indicates that the viscous theory, used to validate the inviscid theory, is either inadequate or there is a source of experimental error.

  17. Bumblebee vibration activated foraging


    Su, Dan Kuan-Nien


    The ability use vibrational signals to activate nestmate foraging is found in the highly social bees, stingless bees and honey bees, and has been hypothesized to exist in the closely related, primitively eusocial bumble bees. We provide the first strong and direct evidence that this is correct. Inside the nest, bumble bee foragers produce brief bursts of vibration (foraging activation pulses) at 594.5 Hz for 63±26 ms (velocityRMS=0.46±0.02mm/s, forceRMS=0.8±0.2 mN. Production of these vibrati...

  18. Vibrations and waves

    CERN Document Server

    Kaliski, S


    This book gives a comprehensive overview of wave phenomena in different media with interacting mechanical, electromagnetic and other fields. Equations describing wave propagation in linear and non-linear elastic media are followed by equations of rheological models, models with internal rotational degrees of freedom and non-local interactions. Equations for coupled fields: thermal, elastic, electromagnetic, piezoelectric, and magneto-spin with adequate boundary conditions are also included. Together with its companion volume Vibrations and Waves. Part A: Vibrations this work provides a wealth

  19. Diffusers in silicon-photodiode radiometers. (United States)

    Boivin, L P


    The problems encountered when making radiometric measurements with silicon-photodiode radiometers not incorporating diffusers are discussed, with special attention given to the case where laser beams are involved. A diffuserless radiometer head design is presented which eliminates most of these problems. These problems can also be avoided by using a diffuser. A radiometer head incorporating a diffuser is described, and its properties are studied for three types of diffuser: flashed opal, type-2250 translucent Plexiglas, and a three-piece ground and etched quartz. Graphical data are given for the spatial uniformity, angular response variation, and spectral attenuation associated with radiometer heads incorporating these three types of diffuser. It is shown that, for a wide range of radiometric and photometric applications, the quartz diffuser is the most desirable, although its use results in a somewhat limited angular field of view.

  20. Detection of buckminsterfullerene emission in the diffuse interstellar medium (United States)

    Berné, O.; Cox, N. L. J.; Mulas, G.; Joblin, C.


    Emission of fullerenes in their infrared vibrational bands has been detected in space near hot stars. The proposed attribution of the diffuse interstellar bands at 9577 and 9632 Å to electronic transitions of the buckminsterfullerene cation (I.e. C) was recently supported by new laboratory data, confirming the presence of this species in the diffuse interstellar medium (ISM). In this Letter, we present the detection, also in the diffuse ISM, of the 17.4 and 18.9 μm emission bands commonly attributed to vibrational bands of neutral C60 . According to classical models that compute the charge state of large molecules in space, C60 is expected to be mostly neutral in the diffuse ISM. This is in agreement with the abundances of diffuse C60 we derive here from observations.

  1. Heterogeneous Dynamics of Coupled Vibrations

    NARCIS (Netherlands)

    Cringus, Dan; Jansen, Thomas I. C.; Pshenichnikov, Maxim S.; Schoenlein, RW; Corkum, P; DeSilvestri, S; Nelson, KA; Riedle, E


    Frequency-dependent dynamics of coupled stretch vibrations of a water molecule are revealed by 2D IR correlation spectroscopy. These are caused by non-Gaussian fluctuations of the environment around the individual OH stretch vibrations.

  2. Site Characterization in the Urban Area of Tijuana, B. C., Mexico by Means of: H/V Spectral Ratios, Spectral Analysis of Surface Waves, and Random Decrement Method (United States)

    Tapia-Herrera, R.; Huerta-Lopez, C. I.; Martinez-Cruzado, J. A.


    Results of site characterization for an experimental site in the metropolitan area of Tijuana, B. C., Mexico are presented as part of the on-going research in which time series of earthquakes, ambient noise, and induced vibrations were processed with three different methods: H/V spectral ratios, Spectral Analysis of Surface Waves (SASW), and the Random Decrement Method, (RDM). Forward modeling using the wave propagation stiffness matrix method (Roësset and Kausel, 1981) was used to compute the theoretical SH/P, SV/P spectral ratios, and the experimental H/V spectral ratios were computed following the conventional concepts of Fourier analysis. The modeling/comparison between the theoretical and experimental H/V spectral ratios was carried out. For the SASW method the theoretical dispersion curves were also computed and compared with the experimental one, and finally the theoretical free vibration decay curve was compared with the experimental one obtained with the RDM. All three methods were tested with ambient noise, induced vibrations, and earthquake signals. Both experimental spectral ratios obtained with ambient noise as well as earthquake signals agree quite well with the theoretical spectral ratios, particularly at the fundamental vibration frequency of the recording site. Differences between the fundamental vibration frequencies are evident for sites located at alluvial fill (~0.6 Hz) and at sites located at conglomerate/sandstones fill (0.75 Hz). Shear wave velocities for the soft soil layers of the 4-layer discrete soil model ranges as low as 100 m/s and up to 280 m/s. The results with the SASW provided information that allows to identify low velocity layers, not seen before with the traditional seismic methods. The damping estimations obtained with the RDM are within the expected values, and the dominant frequency of the system also obtained with the RDM correlates within the range of plus-minus 20 % with the one obtained by means of the H/V spectral

  3. Composite Struts Would Damp Vibrations (United States)

    Dolgin, Benjamin P.


    New design of composite-material (fiber/matrix laminate) struts increases damping of longitudinal vibrations without decreasing longitudinal stiffness or increasing weight significantly. Plies with opposing chevron patterns of fibers convert longitudinal vibrational stresses into shear stresses in intermediate viscoelastic layer, which dissipate vibrational energy. Composite strut stronger than aluminum strut of same weight and stiffness.

  4. Ship Vibration Design Guide (United States)


    Frachtschiffen," Werft Reederie Hafen, 1925. 4-21 Noonan, E. F. "Vibration Considerations for 120,000 CM LNG Ships," NKF: Preliminary Report No. 7107, 25...Ship Response to Ice - A Second Season by C. Daley, J. W. St. John, R. Brown, J. Meyer , and I. Glen 1990 SSC-340 Ice Forces and Ship Response to Ice

  5. Compact Vibration Damper (United States)

    Ivanco, Thomas G. (Inventor)


    A vibration damper includes a rigid base with a mass coupled thereto for linear movement thereon. Springs coupled to the mass compress in response to the linear movement along either of two opposing directions. A converter coupled to the mass converts the linear movement to a corresponding rotational movement. A rotary damper coupled to the converter damps the rotational movement.

  6. Vibrations and Eigenvalues

    Indian Academy of Sciences (India)

    The vibrating string problem is the source of much mathematicsand physics. This article describes Lagrange's formulationof a discretised version of the problem and its solution.This is also the first instance of an eigenvalue problem. Author Affiliations. Rajendra Bhatia1. Ashoka University, Rai, Haryana 131 029, India.

  7. Blade Vibration Measurement System (United States)

    Platt, Michael J.


    The Phase I project successfully demonstrated that an advanced noncontacting stress measurement system (NSMS) could improve classification of blade vibration response in terms of mistuning and closely spaced modes. The Phase II work confirmed the microwave sensor design process, modified the sensor so it is compatible as an upgrade to existing NSMS, and improved and finalized the NSMS software. The result will be stand-alone radar/tip timing radar signal conditioning for current conventional NSMS users (as an upgrade) and new users. The hybrid system will use frequency data and relative mode vibration levels from the radar sensor to provide substantially superior capabilities over current blade-vibration measurement technology. This frequency data, coupled with a reduced number of tip timing probes, will result in a system capable of detecting complex blade vibrations that would confound traditional NSMS systems. The hardware and software package was validated on a compressor rig at Mechanical Solutions, Inc. (MSI). Finally, the hybrid radar/tip timing NSMS software package and associated sensor hardware will be installed for use in the NASA Glenn spin pit test facility.

  8. Vibration Sensitive Keystroke Analysis

    NARCIS (Netherlands)

    Lopatka, M.; Peetz, M.-H.; van Erp, M.; Stehouwer, H.; van Zaanen, M.


    We present a novel method for performing non-invasive biometric analysis on habitual keystroke patterns using a vibration-based feature space. With the increasing availability of 3-D accelerometer chips in laptop computers, conventional methods using time vectors may be augmented using a distinct

  9. PASCAL - Planetary Atmospheres Spectral Catalog (United States)

    Rothman, Laurence; Gordon, Iouli


    , covering a wide spectral range from the microwave through ultraviolet. The data are frequently from multiple sources and must be merged, with special attention to the unique quantum identification of each transition. The resultant line lists are then validated and incorporated into a structured database that is easily employed by modelers. Partition sums that are necessary for applications at a wide range of temperature will also be generated. For molecules with dense spectra, especially molecules with many low-lying fundamental vibrations, the approach is to cast them into sets of pressure-temperature absorption cross-section files. In this case, we will acquire the best laboratory measurements of these gases and transform them into the standard reference files for use in the radiative-transfer codes. This effort is supported by the NASA Planetary Atmospheres program, under the grant NNX10AB94G.

  10. Prediction and mitigation analysis of ground vibration caused by running high-speed trains on rigid-frame viaducts (United States)

    Sun, Liangming; Xie, Weiping; He, Xingwen; Hayashikawa, Toshiro


    In this study a 3D numerical analysis approach is developed to predict the ground vibration around rigid-frame viaducts induced by running high-speed trains. The train-bridge-ground interaction system is divided into two subsystems: the train-bridge interaction and the soil-structure interaction. First, the analytical program to simulate bridge vibration with consideration of train-bridge interaction is developed to obtain the vibration reaction forces at the pier bottoms. The highspeed train is described by a multi-DOFs vibration system and the rigid-frame viaduct is modeled with 3D beam elements. Second, applying these vibration reaction forces as input external excitations, the ground vibration is simulated by using a general-purpose program that includes soil-structure interaction effects. The validity of the analytical procedure is confirmed by comparing analytical and experimental results. The characteristics of high-speed train-induced vibrations, including the location of predominant vibration, are clarified. Based on this information a proposed vibration countermeasure using steel strut and new barrier is found effective in reducing train-induced vibrations and it satisfies environmental vibration requirements. The vibration screening efficiency is evaluated by reduction VAL based on 1/3 octave band spectral analysis.


    Directory of Open Access Journals (Sweden)

    S. T. Antipov


    Full Text Available The currently used system of preventive maintenance is not effective enough. Vibration diagnostics is one of the modern methods of non-destructive testing equipment components, allowing to define the appearance of defects in the early stages. The paper identifies the main areas of research, as well as selected research object, selected non-destructive testing method for efficiently determining the actual state of dynamically operating equipment. Is a schematic of vibration sensors. Measuring point vibration parameters were determined experimentally based on the conditions for obtaining the most informative vibroacoustic signal. Determine the behavior of the cutter under which minimizes the occurrence of a wide range of fluctuations that affects the accuracy of the measurements. For vibration analysis method was chosen direct spectral analysis, which involves the detection of repetitive vibrations. Presented graphically vibration spectra and spectra of vibration signals. Analysis of a wide range of vibration spectrum allowed to allocate land on which showed a significant increase in the values of vibration. Processing of the selected portion of the spectrum has led to the conclusion that in the bearing, shock pulses are in contact with each rolling body shell, and as a result, a number of harmonics in the individual frequencies. Was made a comparative analysis of the spectra of working with a defective bearing bearing on the same frequencies and determine the average increase in the values of vibration. Spectral analysis is an effective method to determine not only the extent of the defect and its location, but also allows you to effectively predict its development. The results may be useful for specialists involved in vibration diagnostics, calculation and design of rotary machines.

  12. Compressive Spectral Renormalization Method

    CERN Document Server

    Bayindir, Cihan


    In this paper a novel numerical scheme for finding the sparse self-localized states of a nonlinear system of equations with missing spectral data is introduced. As in the Petviashivili's and the spectral renormalization method, the governing equation is transformed into Fourier domain, but the iterations are performed for far fewer number of spectral components (M) than classical versions of the these methods with higher number of spectral components (N). After the converge criteria is achieved for M components, N component signal is reconstructed from M components by using the l1 minimization technique of the compressive sampling. This method can be named as compressive spectral renormalization (CSRM) method. The main advantage of the CSRM is that, it is capable of finding the sparse self-localized states of the evolution equation(s) with many spectral data missing.

  13. Fractional calculus with applications in mechanics vibrations and diffusion processes

    CERN Document Server

    Atanackovic, T; Stankovic, Bogoljub; Zorica , Dusan


    This book contains mathematical preliminaries in which basic definitions of fractional derivatives and spaces are presented. The central part of the book contains various applications in classical mechanics including fields such as: viscoelasticity, heat conduction, wave propagation and variational Hamilton-type principles. Mathematical rigor will be observed in the applications. The authors provide some problems formulated in the classical setting and some in the distributional setting. The solutions to these problems are presented in analytical form and these solutions are then analyzed num

  14. Spectral/hp element methods for CFD

    CERN Document Server

    Karniadakis, George Em


    Traditionally spectral methods in fluid dynamics were used in direct and large eddy simulations of turbulent flow in simply connected computational domains. The methods are now being applied to more complex geometries, and the spectral/hp element method, which incorporates both multi-domain spectral methods and high-order finite element methods, has been particularly successful. This book provides a comprehensive introduction to these methods. Written by leaders in the field, the book begins with a full explanation of fundamental concepts and implementation issues. It then illustrates how these methods can be applied to advection-diffusion and to incompressible and compressible Navier-Stokes equations. Drawing on both published and unpublished material, the book is an important resource for experienced researchers and for those new to the field.

  15. A Comparison of PSD Enveloping Methods for Nonstationary Vibration (United States)

    Irvine, Tom


    There is a need to derive a power spectral density (PSD) envelope for nonstationary acceleration time histories, including launch vehicle data, so that components can be designed and tested accordingly. This paper presents the results of the three methods for an actual flight accelerometer record. Guidelines are given for the application of each method to nonstationary data. The method can be extended to other scenarios, including transportation vibration.

  16. Vibrations in glasses and Euclidean random matrix theory

    Energy Technology Data Exchange (ETDEWEB)

    Grigera, T.S.; Martin-Mayor, V.; Parisi, G. [Dipartimento di Fisica, Universita di Roma ' La Sapienza' , Rome (Italy); INFN Sezione di Roma - INFM Unita di Roma, Rome (Italy); Verrocchio, P. [Dipartimento di Fisica, Universita di Trento, Povo, Trento (Italy); INFM Unita di Trento, Trento (Italy)


    We study numerically and analytically a simple off-lattice model of scalar harmonic vibrations by means of Euclidean random matrix theory. Since the spectrum of this model shares the most puzzling spectral features with the high-frequency domain of glasses (non-Rayleigh broadening of the Brillouin peak, boson peak and secondary peak), Euclidean random matrix theory provides a single and fairly simple theoretical framework for their explanation. (author)

  17. Fundamental vibrational mode in a highly inhomogeneous star


    Bastrukov, S. I.; Chang, H. -K.; Wu, E. -H.; Molodtsova, I. V.


    The eigenfrequency problem of fundamental vibrational mode in a highly inhomogeneous star, modeled by self-gravitating mass of viscous liquid with singular density at the center, is considered in juxtaposition with that for Kelvin fundamental mode in the liquid star model with uniform density. Particular attention is given to the difference between spectral equations for the frequency and lifetime of f-mode in the singular and homogeneous star models. The newly obtained results are discussed ...

  18. Drug–excipient interactions in ketoprofen: A vibrational spectroscopy study


    Carvalho, L. A. E. Batista de; Marques, M. Paula M.; Tomkinson, John


    Ketoprofen (3-benzoyl-alpha-methylbenzeneacetic acid) is a widely used nonsteroidal anti-inflammatory drug (NSAID), always administered in the form of drug-excipient physical mixtures (PMs). The occurrence of possible interactions between ketoprofen and two commonly used excipients - lactose (LAC) and polyvinylpyrrolidone (PVP) - was evaluated, through vibrational spectroscopy techniques [both Raman and Inelastic Neutron Scattering (INS)]. Spectral evidence of drug:excipient close contacts, w...

  19. Animal Communications Through Seismic Vibrations

    Energy Technology Data Exchange (ETDEWEB)

    Hill, Peggy (University of Tulsa)


    Substrate vibration has been important to animals as a channel of communication for millions of years, but our literature on vibration in this context of biologically relevant information is only decades old. The jaw mechanism of the earliest land vertebrates allowed them to perceive substrate vibrations as their heads lay on the ground long before airborne sounds could be heard. Although the exact mechanism of vibration production and the precise nature of the wave produced are not always understood, recent development of affordable instrumentation to detect and measure vibrations has allowed researchers to answer increasingly sophisticated questions about how animals send and receive vibration signals. We now know that vibration provides information used in predator defense, prey detection, recruitment to food, mate choice, intrasexual competition, and maternal/brood social interactions in a variety of insect orders, spiders, crabs, scorpions, chameleons, frogs, golden moles, mole rats, kangaroos rats, wallabies, elephants and bison.

  20. Photochromism of Composite Organometallic Nanostructures Based on Diarylethenes. II. Vibrational Spectroscopy and Quantum Chemistry Studies (United States)

    Vasilyuk, G. T.; Askirka, V. F.; Lavysh, A. V.; Kurguzenkov, S. A.; Yasinskii, V. M.; Kobeleva, O. I.; Valova, T. M.; Ayt, A. O.; Barachevsky, V. A.; Yarovenko, V. N.; Krayushkin, M. M.; Maskevich, S. A.


    The structure and photochromic transformations of nanostructured organometallic composites consisting of Ag nanoparticles with shells of photochromic diarylethenes (DAEs) deposited from various solutions onto the nanoparticles were studied using infrared absorption and surface enhanced Raman scattering (SERS) vibrational spectroscopy and quantum chemistry. The studied nanostructures exhibited photochromic properties manifested as reversible photoinduced changes of the relative intensities of SERS bands related to vibrations of bonds participating in the reversible photoisomerization. Spectral manifestations of chemical interaction between metal nanoparticles and DAE molecules were detected.

  1. Modeling the vibrational spectrum of 4,4'-diphenylmethane- bis(methyl)carbamate (United States)

    Shundalau, M. B.; Pitsevich, G. A.; Ksenofontov, M. A.; Umreiko, D. S.


    We present results of ab initio calculations of the structure and vibrational IR spectrum for 4,4'-diphenylmethane-bis(methyl)carbamate (DPMC). Calculations were carried out in the HF/6-311G approximation with subsequent force-field scaling. The calculated characteristics of the vibrational spectrum of DPMC show satisfactory agreement with experimental values, which permits them to be used in spectral and structural analysis

  2. Vibration Attenuation of Plate Using Multiple Vibration Absorbers

    Directory of Open Access Journals (Sweden)

    Zaman Izzuddin


    Full Text Available Vibrations are undesired phenomenon and it can cause harm, distress and unsettling influence to the systems or structures, for example, aircraft, automobile, machinery and building. One of the approach to limit this vibration by introducing passive vibration absorber attached to the structure. In this paper, the adequacy of utilizing passive vibration absorbers are investigated. The vibration absorber system is designed to minimize the vibration of a thin plate fixed along edges. The plate’s vibration characteristics, such as, natural frequency and mode shape are determined using three techniques: theoretical equations, finite element (FE analysis and experiment. The results demonstrate that the first four natural frequencies of fixed-fixed ends plate are 48, 121, 193 and 242 Hz, and these results are corroborated well with theoretical, FE simulation and experiment. The experiment work is further carried out with attached single and multiple vibration absorbers onto plate by tuning the absorber’s frequency to match with the excitation frequency. The outcomes depict that multiple vibration absorbers are more viable in lessening the global structural vibration.

  3. Vibration Analysis of the Space Shuttle External Tank Cable Tray Flight Data With and Without PAL Ramp (United States)

    Walker, Bruce E.; Panda, Jayanta; Sutliff, Daniel L.


    External Tank Cable Tray vibration data for three successive Space Shuttle flights were analyzed to assess response to buffet and the effect of removal of the Protuberance Air Loads (PAL) ramp. Waveform integration, spectral analysis, cross-correlation analysis and wavelet analysis were employed to estimate vibration modes and temporal development of vibration motion from a sparse array of accelerometers and an on-board system that acquired 16 channels of data for approximately the first 2 min of each flight. The flight data indicated that PAL ramp removal had minimal effect on the fluctuating loads on the cable tray. The measured vibration frequencies and modes agreed well with predicted structural response.

  4. Good vibrations. [Hydraulic turbines

    Energy Technology Data Exchange (ETDEWEB)

    Reynolds, P.


    The latest developments in the Voith Turbine Control and Automation System (VTLS), which couples digital control technology to hydropower plant equipment, are described. Prominent among these is the vibration diagnostics module for hydraulic turbines. It provides machine-specific diagnostic logic for a vibration monitoring and analysis system. Of the two other VTLS modules described, the operation module optimizes the control of a power plant with three or more turbines by considering the individual properties of each in turn, recommending which should be run, and how, in order to partition the load for a required power output. The cavitation module is a diagnostic system which enables the limits of operation of the turbines to be extended to bands just outside those determined by cavitation calculations. (3 figures). (UK)

  5. Pickin’ up good vibrations

    CERN Multimedia

    Katarina Anthony


    In preparation for the civil engineering work on the HL-LHC, vibration measurements were carried out at the LHC’s Point 1 last month. These measurements will help evaluate how civil engineering work could impact the beam, and will provide crucial details about the site’s geological make-up before construction begins.   A seismic truck at Point 1 generated wave-like vibrations measured by EN/MME. From carrying out R&D to produce state-of-the-art magnets to developing innovative, robust materials capable of withstanding beam impact, the HL-LHC is a multi-faceted project involving many groups and teams across CERN’s departments. It was in this framework that the project management mandated CERN's Mechanical and Materials Engineering (EN/MME) group to measure the propagation of vibrations around Point 1. Their question: can civil engineering work for the HL-LHC – the bulk of which is scheduled for LS2 – begin while the LHC is running? Alth...

  6. Vibrational stability of graphene

    Directory of Open Access Journals (Sweden)

    Yangfan Hu


    Full Text Available The mechanical stability of graphene as temperature rises is analyzed based on three different self-consistent phonon (SCP models. Compared with three-dimensional (3-D materials, the critical temperature Ti at which instability occurs for graphene is much closer to its melting temperature Tm obtained from Monte Carlo simulation (Ti ≃ 2Tm, K. V. Zakharchenko, A. Fasolino, J. H. Los, and M. I. Katsnelson, J. Phys. Condens. Matter 23, 202202. This suggests that thermal vibration plays a significant role in melting of graphene while melting for 3-D materials is often dominated by topologic defects. This peculiar property of graphene derives from its high structural anisotropy, which is characterized by the vibrational anisotropic coefficient (VAC, defined upon its Lindermann ratios in different directions. For any carbon based material with a graphene-like structure, the VAC value must be smaller than 5.4 to maintain its stability. It is also found that the high VAC value of graphene is responsible for its negative thermal expansion coefficient at low temperature range. We believe that the VAC can be regarded as a new criterion concerning the vibrational stability of any low-dimensional (low-D materials.

  7. Adaptive Spectral Doppler Estimation

    DEFF Research Database (Denmark)

    Gran, Fredrik; Jakobsson, Andreas; Jensen, Jørgen Arendt


    In this paper, 2 adaptive spectral estimation techniques are analyzed for spectral Doppler ultrasound. The purpose is to minimize the observation window needed to estimate the spectrogram to provide a better temporal resolution and gain more flexibility when designing the data acquisition sequence...

  8. Hydrocarbon Spectral Database (United States)

    SRD 115 Hydrocarbon Spectral Database (Web, free access)   All of the rotational spectral lines observed and reported in the open literature for 91 hydrocarbon molecules have been tabulated. The isotopic molecular species, assigned quantum numbers, observed frequency, estimated measurement uncertainty and reference are given for each transition reported.

  9. On Longitudinal Spectral Coherence

    DEFF Research Database (Denmark)

    Kristensen, Leif


    It is demonstrated that the longitudinal spectral coherence differs significantly from the transversal spectral coherence in its dependence on displacement and frequency. An expression for the longitudinal coherence is derived and it is shown how the scale of turbulence, the displacement between ...... observation sites and the turbulence intensity influence the results. The limitations of the theory are discussed....

  10. Effects of vibrational motion on core-level spectra of prototype organic molecules

    Energy Technology Data Exchange (ETDEWEB)

    Uejio, Janel S.; Schwartz, Craig P.; Saykally, Richard J.; Prendergast, David


    A computational approach is presented for prediction and interpretation of core-level spectra of complex molecules. Applications are presented for several isolated organic molecules, sampling a range of chemical bonding and structural motifs. Comparison with gas phase measurements indicate that spectral lineshapes are accurately reproduced both above and below the ionization potential, without resort to ad hoc broadening. Agreement with experiment is significantly improved upon inclusion of vibrations via molecular dynamics sampling. We isolate and characterize spectral features due to particular electronic transitions enabled by vibrations, noting that even zero-point motion is sufficient in some cases.

  11. Understanding Soliton Spectral Tunneling as a Spectral Coupling Effect

    DEFF Research Database (Denmark)

    Guo, Hairun; Wang, Shaofei; Zeng, Xianglong


    between channels, here we suggest that the soliton spectral tunneling effect can be understood supported by a spectral phase coupler. The dispersive wave number in the spectral domain must have a coupler-like symmetric profile for soliton spectral tunneling to occur. We show that such a spectral coupler...

  12. Surface diffusion control of the photocatalytic oxidation in air/TiO2 heterogeneous reactors

    CERN Document Server

    Tsekov, R


    The diffusion of superoxide radical anions on the surface of TiO2 catalysts is theoretically considered as an important step in the kinetics of photocatalytic oxidation of toxic pollutants. A detailed analysis is performed to discriminate the effects of rotation, anion and adsorption bonds vibrations on the diffusion coefficient. A resonant dependence of the diffusivity on the lattice parameters of the TiO2 surface is discovered showing that the most rapid diffusion takes place when the lattice parameters are twice larger than the bond length of the superoxide radical anions. Whereas the rotation and vibrations normal to the catalyst surface are important, the anion bond vibrations do not affect the diffusivity due to their low amplitudes as compared to the lattice parameters.

  13. Road simulation for four-wheel vehicle whole input power spectral density (United States)

    Wang, Jiangbo; Qiang, Baomin


    As the vibration of running vehicle mainly comes from road and influence vehicle ride performance. So the road roughness power spectral density simulation has great significance to analyze automobile suspension vibration system parameters and evaluate ride comfort. Firstly, this paper based on the mathematical model of road roughness power spectral density, established the integral white noise road random method. Then in the MATLAB/Simulink environment, according to the research method of automobile suspension frame from simple two degree of freedom single-wheel vehicle model to complex multiple degrees of freedom vehicle model, this paper built the simple single incentive input simulation model. Finally the spectrum matrix was used to build whole vehicle incentive input simulation model. This simulation method based on reliable and accurate mathematical theory and can be applied to the random road simulation of any specified spectral which provides pavement incentive model and foundation to vehicle ride performance research and vibration simulation.

  14. The Shock and Vibration Digest, Volume 17, Number 10 (United States)


    integration schemes for COSMIC/NASTRAN, MSC/NAS- TRAN, EASE2, STARDYNE, ANSYS, ABAQUS , ADINA, and MARC. is finite elements in biomechanics. re- *.1 view of 36...Shock Excitation ............. 62 Roads and Tracks ............ 42 Vibration Excitation ......... 63 - VEHICLE SYSTEMS ................ 42 MECHANICAL...tangular structural slab -joints for the diffuse Ground-Shock Applications incidence of sound. Some parts of the L. Whitman structure-borne sound energy are


    Directory of Open Access Journals (Sweden)

    Smirnov Vladimir Alexandrovich


    Full Text Available The article deals with the probability analysis for a vibration isolation system of high-precision equipment, which is extremely sensitive to low-frequency oscillations even of submicron amplitude. The external sources of low-frequency vibrations may include the natural city background or internal low-frequency sources inside buildings (pedestrian activity, HVAC. Taking Gauss distribution into account, the author estimates the probability of the relative displacement of the isolated mass being still lower than the vibration criteria. This problem is being solved in the three dimensional space, evolved by the system parameters, including damping and natural frequency. According to this probability distribution, the chance of exceeding the vibration criteria for a vibration isolation system is evaluated. Optimal system parameters - damping and natural frequency - are being developed, thus the possibility of exceeding vibration criteria VC-E and VC-D is assumed to be less than 0.04.

  16. Random vibrations theory and practice

    CERN Document Server

    Wirsching, Paul H; Ortiz, Keith


    Random Vibrations: Theory and Practice covers the theory and analysis of mechanical and structural systems undergoing random oscillations due to any number of phenomena— from engine noise, turbulent flow, and acoustic noise to wind, ocean waves, earthquakes, and rough pavement. For systems operating in such environments, a random vibration analysis is essential to the safety and reliability of the system. By far the most comprehensive text available on random vibrations, Random Vibrations: Theory and Practice is designed for readers who are new to the subject as well as those who are familiar with the fundamentals and wish to study a particular topic or use the text as an authoritative reference. It is divided into three major sections: fundamental background, random vibration development and applications to design, and random signal analysis. Introductory chapters cover topics in probability, statistics, and random processes that prepare the reader for the development of the theory of random vibrations a...

  17. Flow patterns generated by vibrations in weightlessness in binary mixture with Soret effect. (United States)

    Shevtsova, Valentina; Melnikov, Denis; Gaponenko, Yuri; Lyubimova, Tatyana; Mialdun, Aliaksandr; Sechenyh, Vitaliy


    Vibrational convection refers to the specific flows that appear when a fluid with density gradient is subjected to external vibration. The density gradient may result from the inhomogeneity of temperature or composition. The study of vibrational impact on fluids has fundamental and applied importance. In weightlessness, vibrational convection is an additional way of transporting heat and matter similar to thermo- and solutocapillary convection. The response of the fluid to external forcing depends on the frequency of vibration. The case of small amplitude and high frequency vibration (when the period is much smaller than the characteristic viscous and heat (mass) diffusion times) is of special interest. In this case, the mean flow can be observed in the system, which describes the non-linear response of the fluid to a periodic excitation. The mean flow is most pronounced in the absence of other external forces (in particular, absence of static gravity). The experiment IVIDIL (Influence of Vibration on Diffusion in Liquids) has been conducted on the ISS during more than 3 months in 2009-2010. In the experimental liquids the density changes due to both the temperature and composition. 55 experimental runs of IVIDIL provided rich variety of valuable information about behavior of the liquid in weightlessness which is released with time, [1-3]. The current results provide experimental and numerical evidence of richness of flow patterns and their classification. References: 1. Shevtsova V., Mialdun A., Melnikov D., Ryzhkov I., Gaponenko Y., Saghir Z., Lyubimova T., Legros J.C., IVIDIL experiment onboard ISS: thermodiffusion in presence of controlled vibrations, Comptes Rendus Mecanique, 2011, 339, 310-317 2. Shevtsova V., Lyubimova T., Saghir Z. , Melnikov D., Gaponenko Y. , Sechenyh V. , Legros J.C. , Mialdun A., IVIDIL: on-board g-jitters and diffusion controlled phenomena; Journal of Physics: Conference Series, 2011, 327, 012031 3. Mazzoni S., Shevtsova V., Mialdun A

  18. Applying horizontal diffusion on pressure surface to mesoscale models on terrain-following coordinates (United States)

    Hann-Ming Henry Juang; Ching-Teng Lee; Yongxin Zhang; Yucheng Song; Ming-Chin Wu; Yi-Leng Chen; Kevin Kodama; Shyh-Chin Chen


    The National Centers for Environmental Prediction regional spectral model and mesoscale spectral model (NCEP RSM/MSM) use a spectral computation on perturbation. The perturbation is defined as a deviation between RSM/MSM forecast value and their outer model or analysis value on model sigma-coordinate surfaces. The horizontal diffusion used in the models applies...

  19. Chaotic vortex induced vibrations

    Energy Technology Data Exchange (ETDEWEB)

    Zhao, J.; Sheridan, J. [Fluids Laboratory for Aeronautical and Industrial Research (FLAIR), Department of Mechanical and Aerospace Engineering, Monash University, Melbourne, Victoria 3800 (Australia); Leontini, J. S. [Department of Mechanical and Product Design Engineering, Swinburne University of Technology, Hawthorn, Victoria 3122 (Australia); Lo Jacono, D. [Institut de Mécanique des Fluides de Toulouse (IMFT), CNRS, UPS and Université de Toulouse, 31400 Toulouse (France)


    This study investigates the nature of the dynamic response of an elastically mounted cylinder immersed in a free stream. A novel method is utilized, where the motion of the body during a free vibration experiment is accurately recorded, and then a second experiment is conducted where the cylinder is externally forced to follow this recorded trajectory. Generally, the flow response during both experiments is identical. However, particular regimes exist where the flow response is significantly different. This is taken as evidence of chaos in these regimes.

  20. Lattice Vibrations in Chlorobenzenes:

    DEFF Research Database (Denmark)

    Reynolds, P. A.; Kjems, Jørgen; White, J. W.


    Lattice vibrational dispersion curves for the ``intermolecular'' modes in the triclinic, one molecule per unit cell β phase of p‐C6D4Cl2 and p‐C6H4Cl2 have been obtained by inelastic neutron scattering. The deuterated sample was investigated at 295 and at 90°K and a linear extrapolation to 0°K...... was applied in order to correct for anharmonic effects. Calculations based on the atom‐atom model for van der Waals' interaction and on general potential parameters for the aromatic compounds agree reasonably well with the experimental observations. There is no substantial improvement in fit obtained either...

  1. Diffusion archeology for diffusion progression history reconstruction. (United States)

    Sefer, Emre; Kingsford, Carl


    Diffusion through graphs can be used to model many real-world processes, such as the spread of diseases, social network memes, computer viruses, or water contaminants. Often, a real-world diffusion cannot be directly observed while it is occurring - perhaps it is not noticed until some time has passed, continuous monitoring is too costly, or privacy concerns limit data access. This leads to the need to reconstruct how the present state of the diffusion came to be from partial diffusion data. Here, we tackle the problem of reconstructing a diffusion history from one or more snapshots of the diffusion state. This ability can be invaluable to learn when certain computer nodes are infected or which people are the initial disease spreaders to control future diffusions. We formulate this problem over discrete-time SEIRS-type diffusion models in terms of maximum likelihood. We design methods that are based on submodularity and a novel prize-collecting dominating-set vertex cover (PCDSVC) relaxation that can identify likely diffusion steps with some provable performance guarantees. Our methods are the first to be able to reconstruct complete diffusion histories accurately in real and simulated situations. As a special case, they can also identify the initial spreaders better than the existing methods for that problem. Our results for both meme and contaminant diffusion show that the partial diffusion data problem can be overcome with proper modeling and methods, and that hidden temporal characteristics of diffusion can be predicted from limited data.

  2. Diffusion archeology for diffusion progression history reconstruction (United States)

    Sefer, Emre; Kingsford, Carl


    Diffusion through graphs can be used to model many real-world processes, such as the spread of diseases, social network memes, computer viruses, or water contaminants. Often, a real-world diffusion cannot be directly observed while it is occurring — perhaps it is not noticed until some time has passed, continuous monitoring is too costly, or privacy concerns limit data access. This leads to the need to reconstruct how the present state of the diffusion came to be from partial diffusion data. Here, we tackle the problem of reconstructing a diffusion history from one or more snapshots of the diffusion state. This ability can be invaluable to learn when certain computer nodes are infected or which people are the initial disease spreaders to control future diffusions. We formulate this problem over discrete-time SEIRS-type diffusion models in terms of maximum likelihood. We design methods that are based on submodularity and a novel prize-collecting dominating-set vertex cover (PCDSVC) relaxation that can identify likely diffusion steps with some provable performance guarantees. Our methods are the first to be able to reconstruct complete diffusion histories accurately in real and simulated situations. As a special case, they can also identify the initial spreaders better than the existing methods for that problem. Our results for both meme and contaminant diffusion show that the partial diffusion data problem can be overcome with proper modeling and methods, and that hidden temporal characteristics of diffusion can be predicted from limited data. PMID:27821901

  3. Research on intelligent fault diagnosis of gears using EMD, spectral features and data mining techniques (United States)

    Sagar, M.; Vivekkumar, G.; Reddy, Mallikarjuna; Devendiran, S.; Amarnath, M.


    In this present work aims to formulate an automated prediction model using vibration signals of various gear operating conditions by using EMD (empirical mode decomposition) and spectral features and different classification algorithms. In this present work empirical mode decomposition (EMD) is a signal processing technique used to extract more useful fault information from the vibration signals. The proposed method described in following parts gear test rig, data acquisition system, signal processing, feature extraction and classification algorithms and finally identification. Meanwhile, in order to remove the redundant and irrelevant spectral features and classification algorithms, data mining is implemented and it showed promising prediction results.

  4. Quantum dynamics of vibrational excitations and vibrational charge ...

    Indian Academy of Sciences (India)

    Quantum dynamics of vibrational excitations and vibrational charge transfer processes in H+ + O2 collisions at collision energy 23 eV ... The Fritz Haber Research Centre and The Department of Physical Chemisry, Hebrew University of Jerusalem, Jerusalem, Israel 91904; Department of Chemistry, Indian Institute of ...

  5. Vibrational and theoretical study of selected diacetylenes. (United States)

    Roman, Maciej; Baranska, Malgorzata


    Six commonly used disubstituted diacetylenes with short side-chains (RCCCCR, where R=CH2OH, CH2OPh, C(CH3)2OH, C(CH3)3, Si(CH3)3, and Ph) were analyzed using vibrational spectroscopy and quantum-chemical calculations to shed new light on structural and spectroscopic properties of these compounds. Prior to that the conformational analysis of diacetylenes was performed to search the Potential Energy Surface for low-energy minima. Theoretical investigations were followed by the potential energy distribution (PED) analysis to gain deeper insight into FT-Raman and FT-IR spectra that, in some cases, were recorded for the first time for the studied compounds. The analysis was focused mainly on spectral features of the diacetylene system sensitive to the substitution. Shifts of the characteristic bands and changes in bond lengths were observed when changing the substituent. Furthermore, Fermi resonance was observed in the vibrational spectra of some diacetylenes. FT-IR spectra were measured by using two methods, i.e. transmission (with KBr substrate) and Attenuated Total Reflection (ATR), showing the latter adequate and fast tool for IR measurements of diacetylenes. Additionally, Surface Enhanced Raman Spectroscopy (SERS) was applied for phenyl derivative for the first time to study its interaction with metallic nanoparticles that seems to be perpendicular. Copyright © 2013 Elsevier B.V. All rights reserved.

  6. Vowel Inherent Spectral Change

    CERN Document Server

    Assmann, Peter


    It has been traditional in phonetic research to characterize monophthongs using a set of static formant frequencies, i.e., formant frequencies taken from a single time-point in the vowel or averaged over the time-course of the vowel. However, over the last twenty years a growing body of research has demonstrated that, at least for a number of dialects of North American English, vowels which are traditionally described as monophthongs often have substantial spectral change. Vowel Inherent Spectral Change has been observed in speakers’ productions, and has also been found to have a substantial effect on listeners’ perception. In terms of acoustics, the traditional categorical distinction between monophthongs and diphthongs can be replaced by a gradient description of dynamic spectral patterns. This book includes chapters addressing various aspects of vowel inherent spectral change (VISC), including theoretical and experimental studies of the perceptually relevant aspects of VISC, the relationship between ar...

  7. Spectral transmittance reference standards

    Energy Technology Data Exchange (ETDEWEB)

    Kruglyakova, M.A.; Belyaeva, O.N.; Nikitin, M.V.


    This paper presents spectral transmittance reference standards for UV and IR spectrophotometers, developed, studied, and certified by a precision spectrophotometry laboratory (the RSP Complex). 8 refs., 3 figs., 3 tabs.

  8. Precise acquisition and unsupervised segmentation of multi-spectral images

    DEFF Research Database (Denmark)

    Gomez, David Delgado; Clemmensen, Line Katrine Harder; Ersbøll, Bjarne Kjær


    In this work, an integrated imaging system to obtain accurate and reproducible multi-spectral images and a novel multi-spectral image segmentation algorithm are proposed. The system collects up to 20 different spectral bands within a range that vary from 395 nm to 970 nm. The system is designed...... to acquire geometrically and chromatically corrected images in homogeneous and diffuse illumination, so images can be compared over time. The proposed segmentation algorithm combines the information provided by all the spectral bands to segment the different regions of interest. Three experiments...... are conducted to show the ability of the system to acquire highly precise, reproducible and standardized multi-spectral images and to show its applicabilities in different situations....

  9. Thermophotovoltaic Spectral Control

    Energy Technology Data Exchange (ETDEWEB)

    DM DePoy; PM Fourspring; PF Baldasaro; JF Beausang; EJ Brown; MW Dashiel; KD Rahner; TD Rahmlow; JE Lazo-Wasem; EJ Gratrix; B Wemsman


    Spectral control is a key technology for thermophotovoltaic (TPV) direct energy conversion systems because only a fraction (typically less than 25%) of the incident thermal radiation has energy exceeding the diode bandgap energy, E{sub g}, and can thus be converted to electricity. The goal for TPV spectral control in most applications is twofold: (1) Maximize TPV efficiency by minimizing transfer of low energy, below bandgap photons from the radiator to the TPV diode. (2) Maximize TPV surface power density by maximizing transfer of high energy, above bandgap photons from the radiator to the TPV diode. TPV spectral control options include: front surface filters (e.g. interference filters, plasma filters, interference/plasma tandem filters, and frequency selective surfaces), back surface reflectors, and wavelength selective radiators. System analysis shows that spectral performance dominates diode performance in any practical TPV system, and that low bandgap diodes enable both higher efficiency and power density when spectral control limitations are considered. Lockheed Martin has focused its efforts on front surface tandem filters which have achieved spectral efficiencies of {approx}83% for E{sub g} = 0.52 eV and {approx}76% for E{sub g} = 0.60 eV for a 950 C radiator temperature.

  10. Spectrally selective glazings

    Energy Technology Data Exchange (ETDEWEB)



    Spectrally selective glazing is window glass that permits some portions of the solar spectrum to enter a building while blocking others. This high-performance glazing admits as much daylight as possible while preventing transmission of as much solar heat as possible. By controlling solar heat gains in summer, preventing loss of interior heat in winter, and allowing occupants to reduce electric lighting use by making maximum use of daylight, spectrally selective glazing significantly reduces building energy consumption and peak demand. Because new spectrally selective glazings can have a virtually clear appearance, they admit more daylight and permit much brighter, more open views to the outside while still providing the solar control of the dark, reflective energy-efficient glass of the past. This Federal Technology Alert provides detailed information and procedures for Federal energy managers to consider spectrally selective glazings. The principle of spectrally selective glazings is explained. Benefits related to energy efficiency and other architectural criteria are delineated. Guidelines are provided for appropriate application of spectrally selective glazing, and step-by-step instructions are given for estimating energy savings. Case studies are also presented to illustrate actual costs and energy savings. Current manufacturers, technology users, and references for further reading are included for users who have questions not fully addressed here.

  11. A First-Principles Molecular Dynamics Study of the Solvation Shell Structure, Vibrational Spectra, Polarity, and Dynamics around a Nitrate Ion in Aqueous Solution. (United States)

    Yadav, Sushma; Choudhary, Ashu; Chandra, Amalendu


    A first-principles molecular dynamics study is presented for the structural, dynamical, vibrational, and dipolar properties of the solvation shell of a nitrate ion in deuterated water. A detailed description of the anisotropic structure of the solvation shell is presented through calculations of various structural distributions in different conical shells around the perpendicular axis of the ion. The nitrate ion-water dimer potential energies are also calculated for many different orientations of water. The average vibrational stretch frequency of OD modes in the solvation shell is found to be higher than that of other OD modes in the bulk, which signifies a weakening of hydrogen bonds in the hydration shell. A splitting of the NO stretch frequencies and an associated fast spectral diffusion of the solute are also observed in the current study. The dynamics of rotation and hydrogen bond relaxation are found to be faster in the hydration shell than that in the bulk water. The residence time of water in the hydration shell is, however, found to be rather long. The nitrate ion is found to have a dipole moment of 0.9 D in water which can be attributed to its fluctuating interactions with the surrounding water.

  12. Literature survey on anti-vibration gloves

    CSIR Research Space (South Africa)

    Sampson, E


    Full Text Available ............................................................................................................... 1 2. HAND ARM VIBRATION SYNDROME (HAVS).......................................................... 2 2.1 Hand-arm vibration................................................. Error! Bookmark not defined. 2.2 Human Response to vibration...

  13. Adaptive spectral window sizes for feature extraction from optical spectra (United States)

    Kan, Chih-Wen; Lee, Andy Y.; Pham, Nhi; Nieman, Linda T.; Sokolov, Konstantin; Markey, Mia K.


    We propose an approach to adaptively adjust the spectral window size used to extract features from optical spectra. Previous studies have employed spectral features extracted by dividing the spectra into several spectral windows of a fixed width. However, the choice of spectral window size was arbitrary. We hypothesize that by adaptively adjusting the spectral window sizes, the trends in the data will be captured more accurately. Our method was tested on a diffuse reflectance spectroscopy dataset obtained in a study of oblique polarization reflectance spectroscopy of oral mucosa lesions. The diagnostic task is to classify lesions into one of four histopathology groups: normal, benign, mild dysplasia, or severe dysplasia (including carcinoma). Nine features were extracted from each of the spectral windows. We computed the area (AUC) under Receiver Operating Characteristic curve to select the most discriminatory wavelength intervals. We performed pairwise classifications using Linear Discriminant Analysis (LDA) with leave-one-out cross validation. The results showed that for discriminating benign lesions from mild or severe dysplasia, the adaptive spectral window size features achieved AUC of 0.84, while a fixed spectral window size of 20 nm had AUC of 0.71, and an AUC of 0.64 is achieved with a large window size containing all wavelengths. The AUCs of all feature combinations were also calculated. These results suggest that the new adaptive spectral window size method effectively extracts features that enable accurate classification of oral mucosa lesions.

  14. Robust diffusion imaging framework for clinical studies

    CERN Document Server

    Maximov, Ivan I; Neuner, Irene; Shah, N Jon


    Clinical diffusion imaging requires short acquisition times and good image quality to permit its use in various medical applications. In turn, these demands require the development of a robust and efficient post-processing framework in order to guarantee useful and reliable results. However, multiple artefacts abound in in vivo measurements; from either subject such as cardiac pulsation, bulk head motion, respiratory motion and involuntary tics and tremor, or imaging hardware related problems, such as table vibrations, etc. These artefacts can severely degrade the resulting images and render diffusion analysis difficult or impossible. In order to overcome these problems, we developed a robust and efficient framework enabling the use of initially corrupted images from a clinical study. At the heart of this framework is an improved least trimmed squares diffusion tensor estimation algorithm that works well with severely degraded datasets with low signal-to-noise ratio. This approach has been compared with other...

  15. Vibrational Sensing in Marine Invertebrates (United States)


    VIBRATIONAL SENSING IN MARINE INVERTEBRATES Peter A. Jumars School of Oceanography University of Washington Box 357940 Seattle, WA 98195-7940 (206...DATES COVERED 00-00-1997 to 00-00-1997 4. TITLE AND SUBTITLE Vibrational Sensing in Marine Invertebrates 5a. CONTRACT NUMBER 5b. GRANT NUMBER

  16. Vibrations and Stability: Solved Problems

    DEFF Research Database (Denmark)

    Thomsen, Jon Juel

    Worked out solutions for exercise problems in J. J. Thomsen 'Vibrations and Stability: Advanced Theory, Analysis, and Tools', Springer, Berlin - Heidelberg, 2003.......Worked out solutions for exercise problems in J. J. Thomsen 'Vibrations and Stability: Advanced Theory, Analysis, and Tools', Springer, Berlin - Heidelberg, 2003....

  17. Multigrid treatment of implicit continuum diffusion (United States)

    Francisquez, Manaure; Zhu, Ben; Rogers, Barrett


    Implicit treatment of diffusive terms of various differential orders common in continuum mechanics modeling, such as computational fluid dynamics, is investigated with spectral and multigrid algorithms in non-periodic 2D domains. In doubly periodic time dependent problems these terms can be efficiently and implicitly handled by spectral methods, but in non-periodic systems solved with distributed memory parallel computing and 2D domain decomposition, this efficiency is lost for large numbers of processors. We built and present here a multigrid algorithm for these types of problems which outperforms a spectral solution that employs the highly optimized FFTW library. This multigrid algorithm is not only suitable for high performance computing but may also be able to efficiently treat implicit diffusion of arbitrary order by introducing auxiliary equations of lower order. We test these solvers for fourth and sixth order diffusion with idealized harmonic test functions as well as a turbulent 2D magnetohydrodynamic simulation. It is also shown that an anisotropic operator without cross-terms can improve model accuracy and speed, and we examine the impact that the various diffusion operators have on the energy, the enstrophy, and the qualitative aspect of a simulation. This work was supported by DOE-SC-0010508. This research used resources of the National Energy Research Scientific Computing Center (NERSC).

  18. Hydrogen rotational and translational diffusion in calcium borohydride from quasielastic neutron scattering and DFT

    DEFF Research Database (Denmark)

    Blanchard, Didier; Riktor, M.D.; Maronsson, Jon Bergmann


    Hydrogen dynamics in crystalline calcium borohydride can be initiated by long-range diffusion or localized motion such as rotations, librations, and vibrations. Herein, the rotational and translational diffusion were studied by quasielastic neutron scattering (QENS) by using two instruments with ...

  19. The origins of vibration theory (United States)

    Dimarogonas, A. D.


    The Ionian School of natural philosophy introduced the scientific method of dealing with natural phenomena and the rigorous proofs for abstract propositions. Vibration theory was initiated by the Pythagoreans in the fifth century BC, in association with the theory of music and the theory of acoustics. They observed the natural frequency of vibrating systems and proved that it is a system property and that it does not depend on the excitation. Pythagoreans determined the fundamental natural frequencies of several simple systems, such as vibrating strings, pipes, vessels and circular plates. Aristoteles and the Peripatetic School founded mechanics and developed a fundamental understanding of statics and dynamics. In Alexandrian times there were substantial engineering developments in the field of vibration. The pendulum as a vibration, and probably time, measuring device was known in antiquity, and was further developed by the end of the first millennium AD.

  20. The apparent mass and mechanical impedance of the hand and the transmission of vibration to the fingers, hand, and arm (United States)

    Concettoni, Enrico; Griffin, Michael


    Although hand-transmitted vibration causes injury and disease, most often evident in the fingers, the biodynamic responses of the fingers, hand, and arm are not yet well understood. A method of investigating the motion of the entire finger-hand-arm system, based on the simultaneous measurement of the biodynamic response at the driving point and the transmissibility to many points on the finger-hand-arm system, is illustrated. Fourteen male subjects participated in an experiment in which they pushed down on a vertically vibrating metal plate with their right forearm pronated and their elbow bent at 90°. The apparent mass and mechanical impedance of the finger-hand-arm system were measured for each of seven different contact conditions between the plate and the fingers and hand. Simultaneously, the vibration of the fingers, hand, and arm was measured at 41 locations using a scanning laser Doppler vibrometer. Transmissibilities showed how the vibration was transmitted along the arm and allowed the construction of spectral operating deflection shapes showing the vibration pattern of the fingers, hand, and arm for each of the seven contact conditions. The vibration patterns at critical frequencies for each contact condition have been used to explain features in the driving point biodynamic responses and the vibration behaviour of the hand-arm system. Spectral operating deflection shapes for the upper limb assist the interpretation of driving point biodynamic responses and help to advance understanding required to predict, explain, and control the various effects of hand-transmitted vibration.

  1. Force Limited Random Vibration Test of TESS Camera Mass Model (United States)

    Karlicek, Alexandra; Hwang, James Ho-Jin; Rey, Justin J.


    The Transiting Exoplanet Survey Satellite (TESS) is a spaceborne instrument consisting of four wide field-of-view-CCD cameras dedicated to the discovery of exoplanets around the brightest stars. As part of the environmental testing campaign, force limiting was used to simulate a realistic random vibration launch environment. While the force limit vibration test method is a standard approach used at multiple institutions including Jet Propulsion Laboratory (JPL), NASA Goddard Space Flight Center (GSFC), European Space Research and Technology Center (ESTEC), and Japan Aerospace Exploration Agency (JAXA), it is still difficult to find an actual implementation process in the literature. This paper describes the step-by-step process on how the force limit method was developed and applied on the TESS camera mass model. The process description includes the design of special fixtures to mount the test article for properly installing force transducers, development of the force spectral density using the semi-empirical method, estimation of the fuzzy factor (C2) based on the mass ratio between the supporting structure and the test article, subsequent validating of the C2 factor during the vibration test, and calculation of the C.G. accelerations using the Root Mean Square (RMS) reaction force in the spectral domain and the peak reaction force in the time domain.

  2. Vibration spectra of single atomic nanocontacts

    Energy Technology Data Exchange (ETDEWEB)

    Bourahla, B [Laboratoire de Physique et Chimie Quantique, Departement de Physique, Faculte des Sciences, Universite Mouloud Mammeri de Tizi-Ouzou, 15000 Tizi-Ouzou (Algeria); Khater, A [Laboratoire de Physique de l' Etat Condense UMR 6087, Universite du Maine, 72085 Le Mans (France); Rafil, O [Laboratoire de Physique de l' Etat Condense UMR 6087, Universite du Maine, 72085 Le Mans (France); Tigrine, R [Laboratoire de Physique et Chimie Quantique, Departement de Physique, Faculte des Sciences, Universite Mouloud Mammeri de Tizi-Ouzou, 15000 Tizi-Ouzou (Algeria)


    This paper introduces a simple model for an atomic nanocontact, where its mechanical properties are analysed by calculating numerically the local spectral properties at the contact atom and the nearby atoms. The standard methodology for calculating phonon spectral densities is extended to enable the calculation of localized contact modes and local density of states (DOS). The model system considered for the nanocontact consists of two sets of triple parallel semi-infinite atomic chains joined by a single atom in between. The matching method is used, in the harmonic approximation, to calculate the local Green's functions for the irreducible set of sites that constitute the inhomogeneous nanocontact domain. The Green's functions yield the vibration spectra and the DOS for the atomic sites. These are numerically calculated for different cases of elastic hardening and softening of the nanocontact domain. The purpose is to investigate how the local dynamics respond to local changes in the elastic environment. The analysis of the spectra and of the DOS identifies characteristic features and demonstrates the central role of a core subset of these sites for the dynamics of the nanocontact. The system models a situation which may be appropriate for contact atomic force microscopy.

  3. Ambient Vibration Test on Reinforced Concrete Bridges

    Directory of Open Access Journals (Sweden)

    Idris Nurul Shazwin


    Full Text Available An investigation was carried out to determine dynamic characteristic of reinforced concrete (RC bridges by using ambient vibration test (AVT. The ambient vibration sources on bridges may come from traffic, wind, wave motion and seismic events. AVT describes the dynamic characteristics of the bridge and ground by measuring the natural frequencies using highly sensitive seismometer sensor. This test is beneficial due to light weight equipment and smaller number of operator required, cheap and easy to be handled. It is able to give a true picture of the bridge dynamic behavior without any artificial force excitation when vibration data is recorded. A three-span reinforced concrete bridge located in Sri Medan, Batu Pahat, Johor was measured by using microtremor equipment consist of three units of 1 Hz eigenfrequency passive sensors used in this test was performed in normal operating condition without excitation required from any active sources or short period noise perturbations. Ten measurements were conducted on the bridge deck and ten measurements on the ground surface in order to identify the natural frequencies of the bridge. Several peak frequencies were identified from three components of Fourier Amplitude Spectra (FAS in transverse (North-South, longitudinal (East-West and vertical (Up-Down direction as well as squared average Horizontal to Vertical Spectral Ratio (HVSR of ground response, computed by using Geopsy software. From the result, it was expected the bridge have five vibration modes frequencies in the range of 1.0 Hz and 7.0 Hz with the first two modes in the transverse and longitudinal direction having a frequency 1.0 Hz, the third mode is 2.2 Hz in transverse direction, fourth and fifth mode is 5.8 Hz and 7.0 Hz. For ground natural frequencies are in range 1.0 Hz to 1.3 Hz for North-South direction and 1.0 Hz to 1.6 Hz for East-West direction. Finally the results are compared with several empirical formulas for simple

  4. Spectral theory and nonlinear functional analysis

    CERN Document Server

    Lopez-Gomez, Julian


    This Research Note addresses several pivotal problems in spectral theory and nonlinear functional analysis in connection with the analysis of the structure of the set of zeroes of a general class of nonlinear operators. It features the construction of an optimal algebraic/analytic invariant for calculating the Leray-Schauder degree, new methods for solving nonlinear equations in Banach spaces, and general properties of components of solutions sets presented with minimal use of topological tools. The author also gives several applications of the abstract theory to reaction diffusion equations and systems.The results presented cover a thirty-year period and include recent, unpublished findings of the author and his coworkers. Appealing to a broad audience, Spectral Theory and Nonlinear Functional Analysis contains many important contributions to linear algebra, linear and nonlinear functional analysis, and topology and opens the door for further advances.

  5. Parametric Explosion Spectral Model

    Energy Technology Data Exchange (ETDEWEB)

    Ford, S R; Walter, W R


    Small underground nuclear explosions need to be confidently detected, identified, and characterized in regions of the world where they have never before occurred. We develop a parametric model of the nuclear explosion seismic source spectrum derived from regional phases that is compatible with earthquake-based geometrical spreading and attenuation. Earthquake spectra are fit with a generalized version of the Brune spectrum, which is a three-parameter model that describes the long-period level, corner-frequency, and spectral slope at high-frequencies. Explosion spectra can be fit with similar spectral models whose parameters are then correlated with near-source geology and containment conditions. We observe a correlation of high gas-porosity (low-strength) with increased spectral slope. The relationship between the parametric equations and the geologic and containment conditions will assist in our physical understanding of the nuclear explosion source.

  6. Photovoltaic spectral responsivity measurements

    Energy Technology Data Exchange (ETDEWEB)

    Emery, K.; Dunlavy, D.; Field, H.; Moriarty, T. [National Renewable Energy Lab., Golden, CO (United States)


    This paper discusses the various elemental random and nonrandom error sources in typical spectral responsivity measurement systems. The authors focus specifically on the filter and grating monochrometer-based spectral responsivity measurement systems used by the Photovoltaic (PV) performance characterization team at NREL. A variety of subtle measurement errors can occur that arise from a finite photo-current response time, bandwidth of the monochromatic light, waveform of the monochromatic light, and spatial uniformity of the monochromatic and bias lights; the errors depend on the light source, PV technology, and measurement system. The quantum efficiency can be a function of he voltage bias, light bias level, and, for some structures, the spectral content of the bias light or location on the PV device. This paper compares the advantages and problems associated with semiconductor-detector-based calibrations and pyroelectric-detector-based calibrations. Different current-to-voltage conversion and ac photo-current detection strategies employed at NREL are compared and contrasted.

  7. Spectrally resolved visualization of fluorescent dyes permeating into skin (United States)

    Maeder, Ulf; Bergmann, Thorsten; Beer, Sebastian; Burg, Jan Michael; Schmidts, Thomas; Runkel, Frank; Fiebich, Martin


    We present a spectrally resolved confocal imaging approach to qualitatively asses the overall uptake and the penetration depth of fluorescent dyes into biological tissue. We use a confocal microscope with a spectral resolution of 5 nm to measure porcine skin tissue after performing a Franz-Diffusion experiment with a submicron emulsion enriched with the fluorescent dye Nile Red. The evaluation uses linear unmixing of the dye and the tissue autofluorescence spectra. The results are combined with a manual segmentation of the skin's epidermis and dermis layers to assess the penetration behavior additionally to the overall uptake. The diffusion experiments, performed for 3h and 24h, show a 3-fold increased dye uptake in the epidermis and dermis for the 24h samples. As the method is based on spectral information it does not face the problem of superimposed dye and tissue spectra and therefore is more precise compared to intensity based evaluation methods.

  8. Accurate Lineshapes from Sub-1 cm-1 Resolution Sum Frequency Generation Vibrational Spectroscopy of α-Pinene at Room Temperature

    Energy Technology Data Exchange (ETDEWEB)

    Mifflin, Amanda L.; Velarde Ruiz Esparza, Luis A.; Ho, Junming; Psciuk, Brian; Negre, Christian; Ebben, Carlena J.; Upshur, Mary Alice; Lu, Zhou; Strick, Benjamin; Thomson, Regan; Batista, Victor; Wang, Hongfei; Geiger, Franz M.


    Room temperature sub-wavenumber high-resolution broadband sum frequency generation (HR-BB-SFG) spectra of the common terpene (+)-α-pinene reveal ten peaks in the C–H stretching region. The spectral resolution exceeds that of Fourier transform infrared, femtosecond stimulated Raman, and traditional BB-SFG and scanning SFG spectroscopy of the same molecule. Experiment and simulation show the spectral lineshapes to be accurate. Homogeneous vibrational decoherence lifetimes of up to 1.7 psec are assigned to specific oscillators and compare favorably to lifetimes computed from density functional tight binding molecular dynamics calculations, while phase-resolved spectra yield orientation information for them. We propose the new spectroscopy as an attractive alternative to time-resolved vibrational spectroscopy or heterodyne-detection schemes for studying vibrational energy relaxation and vibrational coherences in molecules.

  9. Vibration response of misaligned rotors (United States)

    Patel, Tejas H.; Darpe, Ashish K.


    Misalignment is one of the common faults observed in rotors. Effect of misalignment on vibration response of coupled rotors is investigated in the present study. The coupled rotor system is modelled using Timoshenko beam elements with all six dof. An experimental approach is proposed for the first time for determination of magnitude and harmonic nature of the misalignment excitation. Misalignment effect at coupling location of rotor FE model is simulated using nodal force vector. The force vector is found using misalignment coupling stiffness matrix, derived from experimental data and applied misalignment between the two rotors. Steady-state vibration response is studied for sub-critical speeds. Effect of the types of misalignment (parallel and angular) on the vibration behaviour of the coupled rotor is examined. Along with lateral vibrations, axial and torsional vibrations are also investigated and nature of the vibration response is also examined. It has been found that the misalignment couples vibrations in bending, longitudinal and torsional modes. Some diagnostic features in the fast Fourier transform (FFT) of torsional and longitudinal response related to parallel and angular misalignment have been revealed. Full spectra and orbit plots are effectively used to reveal the unique nature of misalignment fault leading to reliable misalignment diagnostic information, not clearly brought out by earlier studies.

  10. Hydrogen Bonding and Vibrational Spectroscopy: A Theoretical Study (United States)

    Chaban, Galina M.


    Effects of hydrogen bonding on vibrational spectra are studied for several hydrogen-bonded complexes, in which hydrogen bonding ranges from weak (25 kcal/mol). The systems studied include complexes of inorganic acids and salts with water and ammonia, as well as complexes of several organic molecules (nitriles and amino acids) with water. Since anharmonic effects are very strong in hydrogen-bonded systems, anharmonic vibrational frequencies and infrared intensities are computed using the correlation-corrected vibrational self-consistent field (CC-VSCF) method with ab initio potential surfaces at the MP2 and CCSD(T) levels. The most common spectral effects induced by hydrogen bonding are red shifts of stretching vibrational frequencies ranging from approx.200/cm to over 2000/cm and significant increases of infrared intensities for those bonds that participate in hydrogen bonding. However, some systems (e.g. nitrile-water complexes) exhibit shifts in the opposite direction (to the blue) upon formation of hydrogen bonds.

  11. Beyond local group modes in vibrational sum frequency generation. (United States)

    Chase, Hilary M; Psciuk, Brian T; Strick, Benjamin L; Thomson, Regan J; Batista, Victor S; Geiger, Franz M


    We combine deuterium labeling, density functional theory calculations, and experimental vibrational sum frequency generation spectroscopy into a form of "counterfactual-enabled molecular spectroscopy" for producing reliable vibrational mode assignments in situations where local group mode approximations are insufficient for spectral interpretation and vibrational mode assignments. We demonstrate the method using trans-β-isoprene epoxydiol (trans-β-IEPOX), a first-generation product of isoprene relevant to atmospheric aerosol formation, and one of its deuterium-labeled isotopologues at the vapor/silica interface. We use our method to determine that the SFG responses that we obtain from trans-β-IEPOX are almost exclusively due to nonlocal modes involving multiple C-H groups oscillating at the same frequency as one vibrational mode. We verify our assignments using deuterium labeling and use DFT calculations to predict SFG spectra of additional isotopologues that have not yet been synthesized. Finally, we use our new insight to provide a viable alternative to molecular orientation analysis methods that rely on local mode approximations in cases where the local mode approximation is not applicable.

  12. Vibration Analysis for Steam Dryer of APR1400 Steam Generator

    Energy Technology Data Exchange (ETDEWEB)

    Han, Sung-heum; Ko, Doyoung [KHNP CRI, Daejeon (Korea, Republic of); Cho, Minki [Doosan Heavy Industry, Changwon (Korea, Republic of)


    This paper is related to comprehensive vibration assessment program for APR1400 steam generator internals. According to U.S. Nuclear Regulatory Commission, Regulatory Guide 1.20 (Rev.3, March 2007), we conducted vibration analysis for a steam dryer as the second steam separator of steam generator internals. The vibration analysis was performed at the 100 % power operating condition as the normal operation condition. The random hydraulic loads were calculated by the computational fluid dynamics and the structural responses were predicted by power spectral density analysis for the probabilistic method. In order to meet the recently revised U.S. NRC RG 1.20 Rev.3, the CVAP against the potential adverse flow effects in APR1400 SG internals should be performed. This study conducted the vibration response analysis for the SG steam dryer as the second moisture separator at the 100% power condition, and evaluated the structural integrity. The predicted alternating stress intensities were evaluated to have more than 17.78 times fatigue margin compared to the endurance limit.

  13. Tissue vibration in prolonged running. (United States)

    Friesenbichler, Bernd; Stirling, Lisa M; Federolf, Peter; Nigg, Benno M


    The impact force in heel-toe running initiates vibrations of soft-tissue compartments of the leg that are heavily dampened by muscle activity. This study investigated if the damping and frequency of these soft-tissue vibrations are affected by fatigue, which was categorized by the time into an exhaustive exercise. The hypotheses were tested that (H1) the vibration intensity of the triceps surae increases with increasing fatigue and (H2) the vibration frequency of the triceps surae decreases with increasing fatigue. Tissue vibrations of the triceps surae were measured with tri-axial accelerometers in 10 subjects during a run towards exhaustion. The frequency content was quantified with power spectra and wavelet analysis. Maxima of local vibration intensities were compared between the non-fatigued and fatigued states of all subjects. In axial (i.e. parallel to the tibia) and medio-lateral direction, most local maxima increased with fatigue (supporting the first hypothesis). In anterior-posterior direction no systematic changes were found. Vibration frequency was minimally affected by fatigue and frequency changes did not occur systematically, which requires the rejection of the second hypothesis. Relative to heel-strike, the maximum vibration intensity occurred significantly later in the fatigued condition in all three directions. With fatigue, the soft tissue of the triceps surae oscillated for an extended duration at increased vibration magnitudes, possibly due to the effects of fatigue on type II muscle fibers. Thus, the protective mechanism of muscle tuning seems to be reduced in a fatigued muscle and the risk of potential harm to the tissue may increase. Copyright © 2010 Elsevier Ltd. All rights reserved.

  14. ADE spectral networks (United States)

    Longhi, Pietro; Park, Chan Y.


    We introduce a new perspective and a generalization of spectral networks for 4d {N} = 2 theories of class S associated to Lie algebras {g} = A n , D n , E6, and E7. Spectral networks directly compute the BPS spectra of 2d theories on surface defects coupled to the 4d theories. A Lie algebraic interpretation of these spectra emerges naturally from our construction, leading to a new description of 2d-4d wall-crossing phenomena. Our construction also provides an efficient framework for the study of BPS spectra of the 4d theories. In addition, we consider novel types of surface defects associated with minuscule ccrepresentations of {g}.

  15. Molecular vibrations the theory of infrared and Raman vibrational spectra

    CERN Document Server

    Wilson, E Bright; Cross, Paul C


    Pedagogical classic and essential reference focuses on mathematics of detailed vibrational analyses of polyatomic molecules, advancing from application of wave mechanics to potential functions and methods of solving secular determinant.

  16. Avoid heat transfer equipment vibration

    Energy Technology Data Exchange (ETDEWEB)

    Ganapathy, V.


    Tube bundles in heat exchangers, boilers, superheaters and heaters are often subject to vibration and noise problems. Vibration can lead to tube thinning and wear, resulting in tube failures. Excessive noise can be a problem to plant operating personnel. Large gas pressure drop across the equipment is also a side effect, which results in large operating costs. With the design checks presented in this paper, one can predict during design if problems associated with noise and vibration are likely to occur in petroleum refineries.

  17. Vibrational relaxation of the bending mode of HDO in liquid D2O. (United States)

    Bodis, Pavol; Larsen, Olaf F A; Woutersen, Sander


    The vibrational relaxation of the bending mode of HDO in liquid D2O has been studied using time-resolved mid-infrared pump-probe spectroscopy. At short delays, the transient spectrum clearly shows the v = 1 --> 2 induced absorption and v = 1 --> 0 bleaching and stimulated emission, whereas at long delays, the transient spectrum is dominated by the spectral changes caused by the temperature increase in the sample after vibrational relaxation. From the decay of the v = 1 --> 2 induced absorption, we obtain an estimate of 390 +/- 50 fs for the vibrational lifetime, in surprisingly good agreement with recent theoretical predictions. In the v = 0 --> 1 frequency region, the decay of the absorption change involves a second, slower component, which suggests that after vibrational relaxation the system is not yet in thermal equilibrium.

  18. Modeling of structures and calculation of IR vibrational spectra of N,N-dimethylformamide dimers by density functional theory (United States)

    Shundalau, M. B.; Chybirai, P. S.; Komyak, A. I.; Zazhogin, A. P.; Ksenofontov, M. A.; Umreiko, D. S.


    We present results of ab initio and DFT calculations of the structure and IR vibrational spectra of the monomer and dimers of N,N-dimethylformamide (DMF). The calculations were carried out in the B3LYP/cc-pVDZ approximation with subsequent force-field scaling. The calculated characteristics of the vibrational spectra of DMF show satisfactory agreement with experimental values, allowing them to be used in spectral and structural analysis.

  19. 14 CFR 33.63 - Vibration. (United States)


    ... 14 Aeronautics and Space 1 2010-01-01 2010-01-01 false Vibration. 33.63 Section 33.63 Aeronautics... STANDARDS: AIRCRAFT ENGINES Design and Construction; Turbine Aircraft Engines § 33.63 Vibration. Each engine... because of vibration and without imparting excessive vibration forces to the aircraft structure. ...

  20. 14 CFR 33.83 - Vibration test. (United States)


    ... 14 Aeronautics and Space 1 2010-01-01 2010-01-01 false Vibration test. 33.83 Section 33.83... STANDARDS: AIRCRAFT ENGINES Block Tests; Turbine Aircraft Engines § 33.83 Vibration test. (a) Each engine must undergo vibration surveys to establish that the vibration characteristics of those components that...

  1. 14 CFR 33.33 - Vibration. (United States)


    ... 14 Aeronautics and Space 1 2010-01-01 2010-01-01 false Vibration. 33.33 Section 33.33 Aeronautics... STANDARDS: AIRCRAFT ENGINES Design and Construction; Reciprocating Aircraft Engines § 33.33 Vibration. The... vibration and without imparting excessive vibration forces to the aircraft structure. ...

  2. 14 CFR 33.43 - Vibration test. (United States)


    ... 14 Aeronautics and Space 1 2010-01-01 2010-01-01 false Vibration test. 33.43 Section 33.43... STANDARDS: AIRCRAFT ENGINES Block Tests; Reciprocating Aircraft Engines § 33.43 Vibration test. (a) Each engine must undergo a vibration survey to establish the torsional and bending vibration characteristics...

  3. 49 CFR 178.819 - Vibration test. (United States)


    ... 49 Transportation 2 2010-10-01 2010-10-01 false Vibration test. 178.819 Section 178.819... Testing of IBCs § 178.819 Vibration test. (a) General. The vibration test must be conducted for the... vibration test. (b) Test method. (1) A sample IBC, selected at random, must be filled and closed as for...

  4. Rectangular Parallelepiped Vibration in Plane Strain State


    Hanckowiak, Jerzy


    In this paper we present a vibration spectrum of a homogenous parallelepiped (HP) under the action of volume and surface forces resulting from the exponent displacements entering the Fourier transforms. Vibration under the action of axial surface tractions and the free vibration are described separately. A relationship between the high frequency vibration and boundary conditions (BC) is also considered.

  5. Riesz spectral systems

    NARCIS (Netherlands)

    Guo, B.Z.; Zwart, Heiko J.


    In this paper we study systems in which the system operator, $A$, has a Riesz basis of (generalized) eigenvectors. We show that this class is subset of the class of spectral operators as studied by Dunford and Schwartz. For these systems we investigate several system theoretic properties, like


    African Journals Online (AJOL)

    Preferred Customer

    60.55) 4.46 ..... The carbon atom C5, bonded to the chlorine atom, appears at ca. 124 ppm in all of the compounds [63, 70]. Table 6. 13C-NMR spectral (APT) data of the compounds (δC, as ppm, in DMSO-d6). Chloro-hydroxyphenyl carbons.

  7. Temperature and chain length dependence of ultrafast vibrational dynamics of thiocyanate in alkylimidazolium ionic liquids: A random walk on a rugged energy landscape (United States)

    Brinzer, Thomas; Garrett-Roe, Sean


    Ultrafast two-dimensional infrared spectroscopy of a thiocyanate vibrational probe (SCN-) was used to investigate local dynamics in alkylimidazolium bis-[trifluoromethylsulfonyl]imide ionic liquids ([Imn,1][Tf2N], n = 2, 4, 6) at temperatures from 5 to 80 °C. The rate of frequency fluctuations reported by SCN- increases with increasing temperature and decreasing alkyl chain length. Temperature-dependent correlation times scale proportionally to temperature-dependent bulk viscosities of each ionic liquid studied. A multimode Brownian oscillator model demonstrates that very low frequency (modes primarily drive the observed spectral diffusion and that these modes broaden and blue shift on average with increasing temperature. An Arrhenius analysis shows activation barriers for local motions around the probe between 5.5 and 6.5 kcal/mol that are very similar to those for translational diffusion of ions. [Im6,1][Tf2N] shows an unexpected decrease in activation energy compared to [Im4,1][Tf2N] that may be related to mesoscopically ordered polar and nonpolar domains. A model of dynamics on a rugged potential energy landscape provides a unifying description of the observed Arrhenius behavior and the Brownian oscillator model of the low frequency modes.

  8. Vibration measurement with nonlinear converter in the presence of noise (United States)

    Mozuras, Almantas


    Conventional vibration measurement methods use the linear properties of physical converters. These methods are strongly influenced by nonlinear distortions, because ideal linear converters are not available. Practically, any converter can be considered as a linear one, when an output signal is very small. However, the influence of noise increases significantly and signal-to-noise ratio decreases at lower signals. When the output signal is increasing, the nonlinear distortions are also augmenting. If the wide spectrum vibration is measured, conventional methods face a harmonic distortion as well as intermodulation effects. Purpose of this research is to develop a measurement method of wide spectrum vibration by using a converter described by a nonlinear function of type f(x), where x =x(t) denotes the dependence of coordinate x on time t due to the vibration. Parameter x(t) describing the vibration is expressed as Fourier series. The spectral components of the converter output f(x(t)) are determined by using Fourier transform. The obtained system of nonlinear equations is solved using the least squares technique that permits to find x(t) in the presence of noise. This method allows one to carry out the absolute or relative vibration measurements. High resistance to noise is typical for the absolute vibration measurement, but it is necessary to know the Taylor expansion coefficients of the function f(x). If the Taylor expansion is not known, the relative measurement of vibration parameters is also possible, but with lower resistance to noise. This method allows one to eliminate the influence of nonlinear distortions to the measurement results, and consequently to eliminate harmonic distortion and intermodulation effects. The use of nonlinear properties of the converter for measurement gives some advantages related to an increased frequency range of the output signal (consequently increasing the number of equations) that allows one to decrease the noise influence on

  9. A new compound control method for sine-on-random mixed vibration test (United States)

    Zhang, Buyun; Wang, Ruochen; Zeng, Falin


    Vibration environmental test (VET) is one of the important and effective methods to provide supports for the strength design, reliability and durability test of mechanical products. A new separation control strategy was proposed to apply in multiple-input multiple-output (MIMO) sine on random (SOR) mixed mode vibration test, which is the advanced and intensive test type of VET. As the key problem of the strategy, correlation integral method was applied to separate the mixed signals which included random and sinusoidal components. The feedback control formula of MIMO linear random vibration system was systematically deduced in frequency domain, and Jacobi control algorithm was proposed in view of the elements, such as self-spectrum, coherence, and phase of power spectral density (PSD) matrix. Based on the excessive correction of excitation in sine vibration test, compression factor was introduced to reduce the excitation correction, avoiding the destruction to vibration table or other devices. The two methods were synthesized to be applied in MIMO SOR vibration test system. In the final, verification test system with the vibration of a cantilever beam as the control object was established to verify the reliability and effectiveness of the methods proposed in the paper. The test results show that the exceeding values can be controlled in the tolerance range of references accurately, and the method can supply theory and application supports for mechanical engineering.

  10. Vibrational Damping of Composite Materials


    Biggerstaff, Janet M.


    The purpose of this research was to develop new methods of vibrational damping in polymeric composite materials along with expanding the knowledge of currently used vibrational damping methods. A new barrier layer technique that dramatically increased damping in viscoelastic damping materials that interacted with the composite resin was created. A method for testing the shear strength of damping materials cocured in composites was developed. Directional damping materials, where the loss facto...

  11. Vibration Theory, Vol. 1B

    DEFF Research Database (Denmark)

    Asmussen, J. C.; Nielsen, Søren R. K.

    The present collection of MATLAB exercises has been published as a supplement to the textbook, Svingningsteori, Bind 1 and the collection of exercises in Vibration theory, Vol. 1A, Solved Problems. Throughout the exercise references are made to these books. The purpose of the MATLAB exercises...... is to give a better understanding of the physical problems in linear vibration theory and to surpress the mathematical analysis used to solve the problems. For this purpose the MATLAB environment is excellent....

  12. Harmonic vibrations of multispan beams

    DEFF Research Database (Denmark)

    Dyrbye, Claes


    Free and forced harmonic vibrations of multispan beams are determined by a method which implies 1 equation regardless of the configuration. The necessary formulas are given in the paper. For beams with simple supports and the same length of all (n) spans, there is a rather big difference between...... the n´th and the (n+1)´th eigenfrequency. The reason for this phenomenon is explained.Keywords: Vibrations, Eigenfrequencies, Beams....

  13. Smart accelerometer. [vibration damage detection (United States)

    Bozeman, Richard J., Jr. (Inventor)


    The invention discloses methods and apparatus for detecting vibrations from machines which indicate an impending malfunction for the purpose of preventing additional damage and allowing for an orderly shutdown or a change in mode of operation. The method and apparatus is especially suited for reliable operation in providing thruster control data concerning unstable vibration in an electrical environment which is typically noisy and in which unrecognized ground loops may exist.

  14. Improved Predictions for Geotechnical Vibrations


    Macijauskas, Darius


    In urban areas where the infrastructure is dense and construction of new structures is near existing and sensitive buildings, frequently vibrations, caused by human activities, occur. Generated waves in the soil may adversely affect surrounding buildings. These vibrations have to be predicted a priori by using currently available knowledge of the soil dynamics. Current research, conducted by Deltares research institute, showed that the reliability of methods for prediction of m...

  15. Stress analysis of vibrating pipelines (United States)

    Zachwieja, Janusz


    The pipelines are subject to various constraints variable in time. Those vibrations, if not monitored for amplitude and frequency, may result in both the fatigue damage in the pipeline profile at high stress concentration and the damage to the pipeline supports. If the constraint forces are known, the system response may be determined with high accuracy using analytical or numerical methods. In most cases, it may be difficult to determine the constraint parameters, since the industrial pipeline vibrations occur due to the dynamic effects of the medium in the pipeline. In that case, a vibration analysis is a suitable alternative method to determine the stress strain state in the pipeline profile. Monitoring the pipeline vibration levels involves a comparison between the measured vibration parameters and the permissible values as depicted in the graphs for a specific pipeline type. Unfortunately, in most cases, the studies relate to the petrochemical industry and thus large diameter, long and straight pipelines. For a pipeline section supported on both ends, the response in any profile at the entire section length can be determined by measuring the vibration parameters at two different profiles between the pipeline supports. For a straight pipeline section, the bending moments, variable in time, at the ends of the analysed section are a source of the pipe excitation. If a straight pipe section supported on both ends is excited by the bending moments in the support profile, the starting point for the stress analysis are the strains, determined from the Euler-Bernoulli equation. In practice, it is easier to determine the displacement using the experimental methods, since the factors causing vibrations are unknown. The industrial system pipelines, unlike the transfer pipelines, are straight sections at some points only, which makes it more difficult to formulate the equation of motion. In those cases, numerical methods can be used to determine stresses using the

  16. Bond-selective photoacoustic imaging by converting molecular vibration into acoustic waves

    Directory of Open Access Journals (Sweden)

    Jie Hui


    Full Text Available The quantized vibration of chemical bonds provides a way of detecting specific molecules in a complex tissue environment. Unlike pure optical methods, for which imaging depth is limited to a few hundred micrometers by significant optical scattering, photoacoustic detection of vibrational absorption breaks through the optical diffusion limit by taking advantage of diffused photons and weak acoustic scattering. Key features of this method include both high scalability of imaging depth from a few millimeters to a few centimeters and chemical bond selectivity as a novel contrast mechanism for photoacoustic imaging. Its biomedical applications spans detection of white matter loss and regeneration, assessment of breast tumor margins, and diagnosis of vulnerable atherosclerotic plaques. This review provides an overview of the recent advances made in vibration-based photoacoustic imaging and various biomedical applications enabled by this new technology.

  17. Vibrational modes of nanolines (United States)

    Heyliger, Paul R.; Flannery, Colm M.; Johnson, Ward L.


    Brillouin-light-scattering spectra previously have been shown to provide information on acoustic modes of polymeric lines fabricated by nanoimprint lithography. Finite-element methods for modeling such modes are presented here. These methods provide a theoretical framework for determining elastic constants and dimensions of nanolines from measured spectra in the low gigahertz range. To make the calculations feasible for future incorporation in inversion algorithms, two approximations of the boundary conditions are employed in the calculations: the rigidity of the nanoline/substrate interface and sinusoidal variation of displacements along the nanoline length. The accuracy of these approximations is evaluated as a function of wavenumber and frequency. The great advantage of finite-element methods over other methods previously employed for nanolines is the ability to model any cross-sectional geometry. Dispersion curves and displacement patterns are calculated for modes of polymethyl methacrylate nanolines with cross-sectional dimensions of 65 nm × 140 nm and rectangular or semicircular tops. The vibrational displacements and dispersion curves are qualitatively similar for the two geometries and include a series of flexural, Rayleigh-like, and Sezawa-like modes. This paper is a contribution of the National Institute of Standards and Technology and is not subject to copyright in the United States.

  18. Generating light with a specified spectral power distribution (United States)

    Farup, Ivar; Wold, Jan Henrik; Seim, Thorstein; Søndrol, Torkjel


    A particular version of a spectral integrator has been designed. It consists of a xenon lamp whose light is dispersed into a color spectrum by dispersing prisms. Using a transmissive LCD panel controlled by a computer, certain fractions of the light in different parts of the spectrum are masked out. The remaining transmitted light is integrated and projected onto a translucent diffusing plate. A spectroradiometer that measures the generated light is also attached to the computer, thus making the spectral integrator a closed-loop system. An algorithm for generating the light of a specified spectral power distribution has been developed. The resulting measured spectra differ from the specified ones with relative rms errors in the range of 1%-20% depending on the shape of the spectral power distribution.

  19. Wavelength conversion based spectral imaging

    DEFF Research Database (Denmark)

    Dam, Jeppe Seidelin

    There has been a strong, application driven development of Si-based cameras and spectrometers for imaging and spectral analysis of light in the visible and near infrared spectral range. This has resulted in very efficient devices, with high quantum efficiency, good signal to noise ratio and high...... resolution for this spectral region. Today, an increasing number of applications exists outside the spectral region covered by Si-based devices, e.g. within cleantech, medical or food imaging. We present a technology based on wavelength conversion which will extend the spectral coverage of state of the art...... visible or near infrared cameras and spectrometers to include other spectral regions of interest....

  20. Random Vibration of Space Shuttle Weather Protection Systems

    Directory of Open Access Journals (Sweden)

    Isaac Elishakoff


    Full Text Available The article deals with random vibrations of the space shuttle weather protection systems. The excitation model represents a fit to the measured experimental data. The cross-spectral density is given as a convex combination of three exponential functions. It is shown that for the type of loading considered, the Bernoulli-Euler theory cannot be used as a simplified approach, and the structure will be more properly modeled as a Timoshenko beam. Use of the simple Bernoulli-Euler theory may result in an error of about 50% in determining the mean-square value of the bending moment in the weather protection system.

  1. Effect of combining traction and vibration on back muscles, heart rate and blood pressure. (United States)

    Wang, Lizhen; Zhao, Meiya; Ma, Jian; Tian, Shan; Xiang, Pin; Yao, Wei; Fan, Yubo


    Eighty-five percent of the population has experienced low back pain (LBP), which may result in decreasing muscle strength and endurance, functional capacity of the spine, and so on. Traction and vibration are commonly used to relieve the low back pain. The effect of the combing traction and vibration on back muscles, heart rate (HR) and blood pressure (BP) was investigated in this study. Thirty healthy subjects participated in 12 trials lying supine on the spine-combing bed with different tilt angle (0°, 10°, 20° and 30°) and vibration modes (along with the sagittal and coronal axis with 0 Hz, 2 Hz and 12 Hz separately). EMG was recorded during each trial. Power spectral frequency analysis was applied to evaluate muscle fatigue by the shift of median power frequency (MPF). Pulse pressure (PP) was calculated from BP. HR and PP were used to estimate the effect of the combination of traction and vibration on the cardio-vascular system. It was shown that vibration could increase HR and decrease PP. The combination of traction and vibration (2 Hz vibration along Z-axis and 12 Hz vibration along Y-axis) had no significant effect on the cardio-vascular system. The MPF of lumbar erector spinae (LES) and upper trapezius (UT) decreased significantly when the angle reached 20° under the condition of 2 Hz vibration along Z-axis compared with it of 0°. Furthermore, the MPF also decreased significantly compared with it of static mode at 20° for LES and at 30° for UT. However at 12 Hz vibration along Y-axis, the MPF had significant increase when the angle reached 20° in LES and 30° in UT compared to 0°. For LES, the MPF also had significant difference when the angle was increased from 10° to 20°. Therefore, combining 2 Hz vibration along Z-axis and traction (tilt angles that less than 20°) may to reduce muscle fatigue both for LES and UT compared with either vibration or traction alone. The combination of 12 Hz vibration along Y-axis and traction (tilt angles

  2. Effects of g-Jitter on Diffusion in Binary Liquids (United States)

    Duval, Walter M. B.


    The microgravity environment offers the potential to measure the binary diffusion coefficients in liquids without the masking effects introduced by buoyancy-induced flows due to Earth s gravity. However, the background g-jitter (vibrations from the shuttle, onboard machinery, and crew) normally encountered in many shuttle experiments may alter the benefits of the microgravity environment and introduce vibrations that could offset its intrinsic advantages. An experiment during STS-85 (August 1997) used the Microgravity Vibration Isolation Mount (MIM) to isolate and introduce controlled vibrations to two miscible liquids inside a cavity to study the effects of g-jitter on liquid diffusion. Diffusion in a nonhomogeneous liquid system is caused by a nonequilibrium condition that results in the transport of mass (dispersion of the different kinds of liquid molecules) to approach equilibrium. The dynamic state of the system tends toward equilibrium such that the system becomes homogeneous. An everyday example is the mixing of cream and coffee (a nonhomogeneous system) via stirring. The cream diffuses into the coffee, thus forming a homogeneous system. At equilibrium the system is said to be mixed. However, during stirring, simple observations show complex flow field dynamics-stretching and folding of material interfaces, thinning of striation thickness, self-similar patterns, and so on. This example illustrates that, even though mixing occurs via mass diffusion, stirring to enhance transport plays a major role. Stirring can be induced either by mechanical means (spoon or plastic stirrer) or via buoyancy-induced forces caused by Earth s gravity. Accurate measurements of binary diffusion coefficients are often inhibited by buoyancy-induced flows. The microgravity environment minimizes the effect of buoyancy-induced flows and allows the true diffusion limit to be achieved. One goal of this experiment was to show that the microgravity environment suppresses buoyancy

  3. The influence of vibrations of polyatomic molecules on dipole moment and static dipole polarizability: theoretical study (United States)

    Sharipov, Alexander S.; Loukhovitski, Boris I.; Starik, Alexander M.


    Dipole moment and static dipole polarizability surfaces for 50 polyatomic molecules, that are important for material science, combustion, and atmospheric chemistry, are explored in the vicinity of their equilibrium nuclear configurations by using density functional theory. The effective values of dipole moment and static polarizability of these molecules in individual vibrational states are determined using the calculated data on the electric properties and potential energy surfaces. Special attention is paid to the effect of the zero-point vibrations on the electric properties. The simple approximation scheme, allowing low-cost estimation of the zero-point vibrational corrections to polarizability, applicable for wide range of polyatomic compounds, are developed on the basis of the obtained data. The influence of the excitation of vibrational states on the dipole moment and dipole polarizability of polyatomic molecules are discussed with respect to the possible change of some important properties of molecular gases, such as refractive index, diffusion coefficients, and rates of chemical reactions.

  4. Spin-diffusions and diffusive molecular dynamics (United States)

    Farmer, Brittan; Luskin, Mitchell; Plecháč, Petr; Simpson, Gideon


    Metastable configurations in condensed matter typically fluctuate about local energy minima at the femtosecond time scale before transitioning between local minima after nanoseconds or microseconds. This vast scale separation limits the applicability of classical molecular dynamics (MD) methods and has spurned the development of a host of approximate algorithms. One recently proposed method is diffusive MD which aims at integrating a system of ordinary differential equations describing the likelihood of occupancy by one of two species, in the case of a binary alloy, while quasistatically evolving the locations of the atoms. While diffusive MD has shown itself to be efficient and provide agreement with observations, it is fundamentally a model, with unclear connections to classical MD. In this work, we formulate a spin-diffusion stochastic process and show how it can be connected to diffusive MD. The spin-diffusion model couples a classical overdamped Langevin equation to a kinetic Monte Carlo model for exchange amongst the species of a binary alloy. Under suitable assumptions and approximations, spin-diffusion can be shown to lead to diffusive MD type models. The key assumptions and approximations include a well-defined time scale separation, a choice of spin-exchange rates, a low temperature approximation, and a mean field type approximation. We derive several models from different assumptions and show their relationship to diffusive MD. Differences and similarities amongst the models are explored in a simple test problem.

  5. Non-equilibrium Casimir force between vibrating plates.

    Directory of Open Access Journals (Sweden)

    Andreas Hanke

    Full Text Available We study the fluctuation-induced, time-dependent force between two plates confining a correlated fluid which is driven out of equilibrium mechanically by harmonic vibrations of one of the plates. For a purely relaxational dynamics of the fluid we calculate the fluctuation-induced force generated by the vibrating plate on the plate at rest. The time-dependence of this force is characterized by a positive lag time with respect to the driving. We obtain two distinctive contributions to the force, one generated by diffusion of stress in the fluid and another related to resonant dissipation in the cavity. The relation to the dynamic Casimir effect of the electromagnetic field and possible experiments to measure the time-dependent Casimir force are discussed.

  6. Advances in molecular vibrations and collision dynamics molecular clusters

    CERN Document Server

    Bacic, Zatko


    This volume focuses on molecular clusters, bound by van der Waals interactions and hydrogen bonds. Twelve chapters review a wide range of recent theoretical and experimental advances in the areas of cluster vibrations, spectroscopy, and reaction dynamics. The authors are leading experts, who have made significant contributions to these topics.The first chapter describes exciting results and new insights in the solvent effects on the short-time photo fragmentation dynamics of small molecules, obtained by combining heteroclusters with femtosecond laser excitation. The second is on theoretical work on effects of single solvent (argon) atom on the photodissociation dynamics of the solute H2O molecule. The next two chapters cover experimental and theoretical aspects of the energetics and vibrations of small clusters. Chapter 5 describes diffusion quantum Monte Carlo calculations and non additive three-body potential terms in molecular clusters. The next six chapters deal with hydrogen-bonded clusters, refle...

  7. Detection of Buckminsterfullerene emission in the diffuse interstellar medium. (United States)

    Berné, O; Cox, N L J; Mulas, G; Joblin, C


    Emission of fullerenes in their infrared vibrational bands has been detected in space near hot stars. The proposed attribution of the diffuse interstellar bands at 9577 and 9632 Å to electronic transitions of the buckminsterfullerene cation (i.e. [Formula: see text]) was recently supported by new laboratory data, confirming the presence of this species in the diffuse interstellar medium (ISM). In this letter, we present the detection, also in the diffuse ISM, of the 17.4 and 18.9 μm emission bands commonly attributed to vibrational bands of neutral C60. According to classical models that compute the charge state of large molecules in space, C60 is expected to be mostly neutral in the diffuse ISM. This is in agreement with the abundances of diffuse C60 we derive here from observations. We also find that C60 is less abundant in the diffuse ISM than in star-forming regions, supporting the theory that C60 can be formed in these regions.

  8. Snapshot Spectral and Color Imaging Using a Regular Digital Camera with a Monochromatic Image Sensor (United States)

    Hauser, J.; Zheludev, V. A.; Golub, M. A.; Averbuch, A.; Nathan, M.; Inbar, O.; Neittaanmäki, P.; Pölönen, I.


    Spectral imaging (SI) refers to the acquisition of the three-dimensional (3D) spectral cube of spatial and spectral data of a source object at a limited number of wavelengths in a given wavelength range. Snapshot spectral imaging (SSI) refers to the instantaneous acquisition (in a single shot) of the spectral cube, a process suitable for fast changing objects. Known SSI devices exhibit large total track length (TTL), weight and production costs and relatively low optical throughput. We present a simple SSI camera based on a regular digital camera with (i) an added diffusing and dispersing phase-only static optical element at the entrance pupil (diffuser) and (ii) tailored compressed sensing (CS) methods for digital processing of the diffused and dispersed (DD) image recorded on the image sensor. The diffuser is designed to mix the spectral cube data spectrally and spatially and thus to enable convergence in its reconstruction by CS-based algorithms. In addition to performing SSI, this SSI camera is capable to perform color imaging using a monochromatic or gray-scale image sensor without color filter arrays.


    Directory of Open Access Journals (Sweden)

    J. Hauser


    Full Text Available Spectral imaging (SI refers to the acquisition of the three-dimensional (3D spectral cube of spatial and spectral data of a source object at a limited number of wavelengths in a given wavelength range. Snapshot spectral imaging (SSI refers to the instantaneous acquisition (in a single shot of the spectral cube, a process suitable for fast changing objects. Known SSI devices exhibit large total track length (TTL, weight and production costs and relatively low optical throughput. We present a simple SSI camera based on a regular digital camera with (i an added diffusing and dispersing phase-only static optical element at the entrance pupil (diffuser and (ii tailored compressed sensing (CS methods for digital processing of the diffused and dispersed (DD image recorded on the image sensor. The diffuser is designed to mix the spectral cube data spectrally and spatially and thus to enable convergence in its reconstruction by CS-based algorithms. In addition to performing SSI, this SSI camera is capable to perform color imaging using a monochromatic or gray-scale image sensor without color filter arrays.

  10. Hybrid spectral CT reconstruction (United States)

    Clark, Darin P.


    Current photon counting x-ray detector (PCD) technology faces limitations associated with spectral fidelity and photon starvation. One strategy for addressing these limitations is to supplement PCD data with high-resolution, low-noise data acquired with an energy-integrating detector (EID). In this work, we propose an iterative, hybrid reconstruction technique which combines the spectral properties of PCD data with the resolution and signal-to-noise characteristics of EID data. Our hybrid reconstruction technique is based on an algebraic model of data fidelity which substitutes the EID data into the data fidelity term associated with the PCD reconstruction, resulting in a joint reconstruction problem. Within the split Bregman framework, these data fidelity constraints are minimized subject to additional constraints on spectral rank and on joint intensity-gradient sparsity measured between the reconstructions of the EID and PCD data. Following a derivation of the proposed technique, we apply it to the reconstruction of a digital phantom which contains realistic concentrations of iodine, barium, and calcium encountered in small-animal micro-CT. The results of this experiment suggest reliable separation and detection of iodine at concentrations ≥ 5 mg/ml and barium at concentrations ≥ 10 mg/ml in 2-mm features for EID and PCD data reconstructed with inherent spatial resolutions of 176 μm and 254 μm, respectively (point spread function, FWHM). Furthermore, hybrid reconstruction is demonstrated to enhance spatial resolution within material decomposition results and to improve low-contrast detectability by as much as 2.6 times relative to reconstruction with PCD data only. The parameters of the simulation experiment are based on an in vivo micro-CT experiment conducted in a mouse model of soft-tissue sarcoma. Material decomposition results produced from this in vivo data demonstrate the feasibility of distinguishing two K-edge contrast agents with a spectral

  11. Hybrid spectral CT reconstruction.

    Directory of Open Access Journals (Sweden)

    Darin P Clark

    Full Text Available Current photon counting x-ray detector (PCD technology faces limitations associated with spectral fidelity and photon starvation. One strategy for addressing these limitations is to supplement PCD data with high-resolution, low-noise data acquired with an energy-integrating detector (EID. In this work, we propose an iterative, hybrid reconstruction technique which combines the spectral properties of PCD data with the resolution and signal-to-noise characteristics of EID data. Our hybrid reconstruction technique is based on an algebraic model of data fidelity which substitutes the EID data into the data fidelity term associated with the PCD reconstruction, resulting in a joint reconstruction problem. Within the split Bregman framework, these data fidelity constraints are minimized subject to additional constraints on spectral rank and on joint intensity-gradient sparsity measured between the reconstructions of the EID and PCD data. Following a derivation of the proposed technique, we apply it to the reconstruction of a digital phantom which contains realistic concentrations of iodine, barium, and calcium encountered in small-animal micro-CT. The results of this experiment suggest reliable separation and detection of iodine at concentrations ≥ 5 mg/ml and barium at concentrations ≥ 10 mg/ml in 2-mm features for EID and PCD data reconstructed with inherent spatial resolutions of 176 μm and 254 μm, respectively (point spread function, FWHM. Furthermore, hybrid reconstruction is demonstrated to enhance spatial resolution within material decomposition results and to improve low-contrast detectability by as much as 2.6 times relative to reconstruction with PCD data only. The parameters of the simulation experiment are based on an in vivo micro-CT experiment conducted in a mouse model of soft-tissue sarcoma. Material decomposition results produced from this in vivo data demonstrate the feasibility of distinguishing two K-edge contrast agents with

  12. Hybrid spectral CT reconstruction. (United States)

    Clark, Darin P; Badea, Cristian T


    Current photon counting x-ray detector (PCD) technology faces limitations associated with spectral fidelity and photon starvation. One strategy for addressing these limitations is to supplement PCD data with high-resolution, low-noise data acquired with an energy-integrating detector (EID). In this work, we propose an iterative, hybrid reconstruction technique which combines the spectral properties of PCD data with the resolution and signal-to-noise characteristics of EID data. Our hybrid reconstruction technique is based on an algebraic model of data fidelity which substitutes the EID data into the data fidelity term associated with the PCD reconstruction, resulting in a joint reconstruction problem. Within the split Bregman framework, these data fidelity constraints are minimized subject to additional constraints on spectral rank and on joint intensity-gradient sparsity measured between the reconstructions of the EID and PCD data. Following a derivation of the proposed technique, we apply it to the reconstruction of a digital phantom which contains realistic concentrations of iodine, barium, and calcium encountered in small-animal micro-CT. The results of this experiment suggest reliable separation and detection of iodine at concentrations ≥ 5 mg/ml and barium at concentrations ≥ 10 mg/ml in 2-mm features for EID and PCD data reconstructed with inherent spatial resolutions of 176 μm and 254 μm, respectively (point spread function, FWHM). Furthermore, hybrid reconstruction is demonstrated to enhance spatial resolution within material decomposition results and to improve low-contrast detectability by as much as 2.6 times relative to reconstruction with PCD data only. The parameters of the simulation experiment are based on an in vivo micro-CT experiment conducted in a mouse model of soft-tissue sarcoma. Material decomposition results produced from this in vivo data demonstrate the feasibility of distinguishing two K-edge contrast agents with a spectral

  13. Evaluation of hand-arm vibration reducing effect of anti-vibration glove


    樹野, 淳也; 前田, 節雄; 横田, 和樹; 平, 雄一郎


    Many kinds of the anti-vibration glove have been developed for reducing hand-arm vibration during the operation with vibration tools. International standard ISO 10819 evaluates the physical effect of gloves' vibration transmissibility but not evaluates the physiological effect of human hands. Thus, in this paper, we proposed the evaluation using the temporary threshold shift of vibrotactile perception threshold to evaluate the hand-arm vibration reducing effect of anti-vibration glove. We per...

  14. Spectral Anonymization of Data. (United States)

    Lasko, Thomas A; Vinterbo, Staal A


    The goal of data anonymization is to allow the release of scientifically useful data in a form that protects the privacy of its subjects. This requires more than simply removing personal identifiers from the data, because an attacker can still use auxiliary information to infer sensitive individual information. Additional perturbation is necessary to prevent these inferences, and the challenge is to perturb the data in a way that preserves its analytic utility.No existing anonymization algorithm provides both perfect privacy protection and perfect analytic utility. We make the new observation that anonymization algorithms are not required to operate in the original vector-space basis of the data, and many algorithms can be improved by operating in a judiciously chosen alternate basis. A spectral basis derived from the data's eigenvectors is one that can provide substantial improvement. We introduce the term spectral anonymization to refer to an algorithm that uses a spectral basis for anonymization, and we give two illustrative examples.We also propose new measures of privacy protection that are more general and more informative than existing measures, and a principled reference standard with which to define adequate privacy protection.

  15. The influence of state-to-state kinetics on diffusion and heat transfer behind shock waves

    Energy Technology Data Exchange (ETDEWEB)

    Kunova, O.; Kustova, E.; Mekhonoshina, M.; Nagnibeda, E. [Saint Petersburg State University, 198504, Universitetskiy pr., 28, Saint Petersburg (Russian Federation)


    In the paper, the influence of vibrational and chemical kinetics on heat transfer and diffusion in hypersonic flows of N{sub 2}/N mixture in the relaxation zone behind shock waves is studied on the basis of the state-to-state kinetic theory approach. The results of calculations of vibrational level populations ni, gas temperature T, total energy flux q, diffusion velocities of molecules at different vibrational states V{sub i} and atoms V{sub a} in the relaxation zone behind a shock front are presented for the free stream Mach number M = 10, 15. The contribution of different dissipative processes to the total energy flux is estimated for various flow conditions. The impact of non-equilibrium vibrational distributions in the free stream on molecular level populations and transport properties in the relaxation zone is shown.

  16. Vibrational relaxation pathways of AI and AII modes in N-methylacetamide clusters. (United States)

    Piatkowski, L; Bakker, H J


    We studied the pathways of vibrational energy relaxation of the amide I (~1660 cm⁻¹) and amide II (~1560 cm⁻¹) vibrational modes of N-methylacetamide (NMA) in CCl₄ solution using two-color femtosecond vibrational spectroscopy. We measured the transient spectral dynamics upon excitation of each of these amide modes. The results show that there is no energy transfer between the amide I (AI) and amide II (AII) modes. Instead we find that the vibrational energy is transferred on a picosecond time scale to a common combination tone of lower-frequency modes. By use of polarization-resolved femtosecond pump-probe measurements we also study the reorientation dynamics of the NMA molecules and the relative angle between the transition dipole moments of the AI and AII vibrations. The spectral dynamics at later times after the excitation (>40 ps) reveal the presence of a dissociation process of the NMA aggregates, trimers, and higher order structures into dimers and monomers. By measuring the dissociation kinetics at different temperatures, we determined the activation energy of this dissociation E(a) = 35 ± 3 kJ mol⁻¹.

  17. Creatinine Diffusion Modeling in Capacitive Sensors (United States)

    Mohabbati-Kalejahi, Elham; Azimirad, Vahid; Bahrami, Manouchehr


    In this paper, creatinine diffusion in capacitive sensors is discussed. The factors influencing the response time of creatinine biosensors are mathematically formulated and then three novel approaches for decreasing the response time are presented. At first, a piezoelectric actuator is used to vibrate the microtube that contains the blood sample, in order to reduce the viscosity of blood, and thus to increase the coefficient of diffusion. Then, the blood sample is assumed to be pushed through a porous medium, and the relevant conditions are investigated. Finally, the effect of the dentate shape of dielectric on response time is studied. The algorithms and the mathematical models are presented and discussed, and the results of simulations are illustrated. The response times for the first, second and third method are 60, 0.036 and about 31 s, respectively. It is also found that pumping results in very fast responses.

  18. Lung diffusion testing (United States)

    ... Lung diffusion testing To use the sharing features on this page, please enable JavaScript. Lung diffusion testing measures how well the lungs exchange gases. This ...

  19. Light diffusion in quenched disorder: Role of step correlations (United States)

    Svensson, Tomas; Vynck, Kevin; Adolfsson, Erik; Farina, Andrea; Pifferi, Antonio; Wiersma, Diederik S.


    We present a theoretical and experimental study of light transport in disordered media with strongly heterogeneous distribution of scatterers formed via nonscattering regions. Step correlations induced by quenched disorder are found to prevent diffusivity from diverging with increasing heterogeneity scale, contrary to expectations from annealed models. Spectral diffusivity is measured for a porous ceramic where nanopores act as scatterers and macropores render their distribution heterogeneous. Results agree well with Monte Carlo simulations and a proposed analytical model.

  20. Multitask Diffusion Adaptation Over Networks (United States)

    Chen, Jie; Richard, Cedric; Sayed, Ali H.


    Adaptive networks are suitable for decentralized inference tasks, e.g., to monitor complex natural phenomena. Recent research works have intensively studied distributed optimization problems in the case where the nodes have to estimate a single optimum parameter vector collaboratively. However, there are many important applications that are multitask-oriented in the sense that there are multiple optimum parameter vectors to be inferred simultaneously, in a collaborative manner, over the area covered by the network. In this paper, we employ diffusion strategies to develop distributed algorithms that address multitask problems by minimizing an appropriate mean-square error criterion with $\\ell_2$-regularization. The stability and convergence of the algorithm in the mean and in the mean-square sense is analyzed. Simulations are conducted to verify the theoretical findings, and to illustrate how the distributed strategy can be used in several useful applications related to spectral sensing, target localization, and hyperspectral data unmixing.

  1. A Student Diffusion Activity (United States)

    Kutzner, Mickey; Pearson, Bryan


    Diffusion is a truly interdisciplinary topic bridging all areas of STEM education. When biomolecules are not being moved through the body by fluid flow through the circulatory system or by molecular motors, diffusion is the primary mode of transport over short distances. The direction of the diffusive flow of particles is from high concentration…

  2. Handbook on atmospheric diffusion

    Energy Technology Data Exchange (ETDEWEB)

    Hanna, S.R.; Briggs, G.A.; Hosker, R.P. Jr.


    Basic meteorological concepts are covered as well as plume rise, source effects, and diffusion models. Chapters are included on cooling tower plumes and urban diffusion. Suggestions are given for calculating diffusion in special situations, such as for instantaneous releases over complex terrain, over long distances, and during times when chemical reactions or dry or wet deposition are important. (PSB)


    Energy Technology Data Exchange (ETDEWEB)



    The authors study experimentally statistical properties of the opening times of knots in vertically vibrated granular chains. Our measurements are in good qualitative and quantitative agreement with a theoretical model involving three random walks interacting via hard core exclusion in one spatial dimension. In particular, the knot survival probability follows a universal scaling function which is independent of the chain length, with a corresponding diffusive characteristic time scale. Both the large-exit-time and the small-exit-time tails of the distribution are suppressed exponentially, and the corresponding decay coefficients are in excellent agreement with the theoretical values.

  4. Ultrasonic metal welding with a vibration source using longitudinal and torsional vibration transducers (United States)

    Asami, Takuya; Tamada, Yosuke; Higuchi, Yusuke; Miura, Hikaru


    Conventional ultrasonic metal welding for joining dissimilar metals uses a linear vibration locus, although this method suffers from problems such as low overall weld strength. Our previous studies have shown that ultrasonic welding with a planar vibration locus improves the weld strength. However, the vibration source in our previous studies had problems in longitudinal-torsional vibration controllability and small welding tip. Therefore, the study of the optimal shape of the vibration locus was difficult. Furthermore, improvement of weld strength cannot be expected. We have developed a new ultrasonic vibration source that can control the longitudinal-torsional vibration and can connect to a large welding tip. In this study, we clarified the longitudinal-torsional vibration controllability of the developed ultrasonic vibration source. Moreover, we clarified that using the planar locus of the developed vibration source produced a higher weld strength than our previous studies, and clarified the optimal shape of the vibration locus.

  5. Fractional diffusion equations and anomalous diffusion

    CERN Document Server

    Evangelista, Luiz Roberto


    Anomalous diffusion has been detected in a wide variety of scenarios, from fractal media, systems with memory, transport processes in porous media, to fluctuations of financial markets, tumour growth, and complex fluids. Providing a contemporary treatment of this process, this book examines the recent literature on anomalous diffusion and covers a rich class of problems in which surface effects are important, offering detailed mathematical tools of usual and fractional calculus for a wide audience of scientists and graduate students in physics, mathematics, chemistry and engineering. Including the basic mathematical tools needed to understand the rules for operating with the fractional derivatives and fractional differential equations, this self-contained text presents the possibility of using fractional diffusion equations with anomalous diffusion phenomena to propose powerful mathematical models for a large variety of fundamental and practical problems in a fast-growing field of research.

  6. Mechanical Vibrations Modeling and Measurement

    CERN Document Server

    Schmitz, Tony L


    Mechanical Vibrations:Modeling and Measurement describes essential concepts in vibration analysis of mechanical systems. It incorporates the required mathematics, experimental techniques, fundamentals of modal analysis, and beam theory into a unified framework that is written to be accessible to undergraduate students,researchers, and practicing engineers. To unify the various concepts, a single experimental platform is used throughout the text to provide experimental data and evaluation. Engineering drawings for the platform are included in an appendix. Additionally, MATLAB programming solutions are integrated into the content throughout the text. This book also: Discusses model development using frequency response function measurements Presents a clear connection between continuous beam models and finite degree of freedom models Includes MATLAB code to support numerical examples that are integrated into the text narrative Uses mathematics to support vibrations theory and emphasizes the practical significanc...

  7. Accuracy in mineral identification: image spectral and spatial resolutions and mineral spectral properties

    Directory of Open Access Journals (Sweden)

    L. Pompilio


    Full Text Available Problems related to airborne hyperspectral image data are reviewed and the requirements for data analysis applied to mineralogical (rocks and soils interpretation are discussed. The variability of mineral spectral features, including absorption position, shape and depth is considered and interpreted as due to chemical composition, grain size effects and mineral association. It is also shown how this variability can be related to well defined geologic processes. The influence of sensor noise and diffuse atmospheric radiance in classification accuracy is also analyzed.


    Energy Technology Data Exchange (ETDEWEB)

    Martin E. Cobern


    The deep hard rock drilling environment induces severe vibrations into the drillstring, which can cause reduced rates of penetration (ROP) and premature failure of the equipment. The only current means of controlling vibration under varying conditions is to change either the rotary speed or the weight-on-bit (WOB). These changes often reduce drilling efficiency. Conventional shock subs are useful in some situations, but often exacerbate the problems. The objective of this project is development of a unique system to monitor and control drilling vibrations in a ''smart'' drilling system. This system has two primary elements: (1) The first is an active vibration damper (AVD) to minimize harmful axial, lateral and torsional vibrations. The hardness of this damper will be continuously adjusted using a robust, fast-acting and reliable unique technology. (2) The second is a real-time system to monitor drillstring vibration, and related parameters. This monitor adjusts the damper according to local conditions. In some configurations, it may also send diagnostic information to the surface via real-time telemetry. The AVD is implemented in a configuration using magnetorheological (MR) fluid. By applying a current to the magnetic coils in the damper, the viscosity of the fluid can be changed rapidly, thereby altering the damping coefficient in response to the measured motion of the tool. Phase I of this program entailed modeling and design of the necessary subsystems and design, manufacture and test of a full laboratory prototype. Phase I of the project was completed by the revised end date of May 31, 2004. The objectives of this phase were met, and all prerequisites for Phase II have been completed.


    Energy Technology Data Exchange (ETDEWEB)

    Martin E. Cobern


    The deep hard rock drilling environment induces severe vibrations into the drillstring, which can cause reduced rates of penetration (ROP) and premature failure of the equipment. The only current means of controlling vibration under varying conditions is to change either the rotary speed or the weight-on-bit (WOB). These changes often reduce drilling efficiency. Conventional shock subs are useful in some situations, but often exacerbate the problems. The objective of this project is development of a unique system to monitor and control drilling vibrations in a ''smart'' drilling system. This system has two primary elements: (1) The first is an active vibration damper (AVD) to minimize harmful axial, lateral and torsional vibrations. The hardness of this damper will be continuously adjusted using a robust, fast-acting and reliable unique technology. (2) The second is a real-time system to monitor drillstring vibration, and related parameters. This monitor adjusts the damper according to local conditions. In some configurations, it may also send diagnostic information to the surface via real-time telemetry. The AVD is implemented in a configuration using magnetorheological (MR) fluid. By applying a current to the magnetic coils in the damper, the viscosity of the fluid can be changed rapidly, thereby altering the damping coefficient in response to the measured motion of the tool. Phase I of this program entailed modeling and design of the necessary subsystems and design, manufacture and test of a full laboratory prototype. Phase I of the project was completed by the revised end date of May 31, 2004. The objectives of this phase were met, and all prerequisites for Phase II have been completed. The month of June, 2004 was primarily occupied with the writing of the Phase I Final Report, the sole deliverable of Phase I, which will be submitted in the next quarter. Redesign of the laboratory prototype and design of the downhole (Phase II) prototype was

  10. Spectral signatures of chirality

    DEFF Research Database (Denmark)

    Pedersen, Jesper Goor; Mortensen, Asger


    We present a new way of measuring chirality, via the spectral shift of photonic band gaps in one-dimensional structures. We derive an explicit mapping of the problem of oblique incidence of circularly polarized light on a chiral one-dimensional photonic crystal with negligible index contrast...... to the formally equivalent problem of linearly polarized light incident on-axis on a non-chiral structure with index contrast. We derive analytical expressions for the first-order shifts of the band gaps for negligible index contrast. These are modified to give good approximations to the band gap shifts also...

  11. Spectral tripartitioning of networks


    Richardson, Thomas; Mucha, Peter J; Porter, Mason A.


    We formulate a spectral graph-partitioning algorithm that uses the two leading eigenvectors of the matrix corresponding to a selected quality function to split a network into three communities in a single step. In so doing, we extend the recursive bipartitioning methods developed by Newman [Proc. Nat. Acad. Sci. 103, 8577 (2006); Phys. Rev. E 74, 036104 (2006)] to allow one to consider the best available two-way and three-way divisions at each recursive step. We illustrate the method using si...

  12. Inverse boundary spectral problems

    CERN Document Server

    Kachalov, Alexander; Lassas, Matti


    Inverse boundary problems are a rapidly developing area of applied mathematics with applications throughout physics and the engineering sciences. However, the mathematical theory of inverse problems remains incomplete and needs further development to aid in the solution of many important practical problems.Inverse Boundary Spectral Problems develop a rigorous theory for solving several types of inverse problems exactly. In it, the authors consider the following: ""Can the unknown coefficients of an elliptic partial differential equation be determined from the eigenvalues and the boundary value

  13. QCD spectral sum rules

    CERN Document Server

    Narison, Stéphan

    The aim of the book is to give an introduction to the method of QCD Spectral Sum Rules and to review its developments. After some general introductory remarks, Chiral Symmetry, the Historical Developments of the Sum Rules and the necessary materials for perturbative QCD including the MS regularization and renormalization schemes are discussed. The book also gives a critical review and some improvements of the wide uses of the QSSR in Hadron Physics and QSSR beyond the Standard Hadron Phenomenology. The author has participated actively in this field since 1978 just before the expanding success

  14. Eddy diffusivity in the ocean surface (United States)

    Redondo, Jose M.; Castilla, Robert; Platonov, Alexei


    In order to measure eddy diffusivity in the ocean using a scaling that includes the thickness of the surf zone as well as the depth and the wave period[1,2]. Measurements in the Mediterranean are almost two orders of magnitude smaller than in the Pacific coast. On a larger scale, and further away from the coast the relevant eddy diffusivities are much larger, because large eddies often scale on the Rossby deformation radius, LR. Direct measurements of the diffusion and the horizontal velocity field were performed at several sites in the coastal areas of Spain. The diffusion coeficients were calculated by evaluation from video images of the area of milk and fluoresceine blobs released at different positions and with different wave heights, wind speeds and tidal induced currents[1-3]. There are instances with either low hipo-diffusivity or high hyper-diffusivity and local measurements in both cases indicate that spectra deviate strongly from an equilibrium spectrum. A generalized Richardson law [3,4] deduced from Kinematic Simulation (KS) numerical models may be applied also to coastal diffusion[5]. The eddy viscosity values show a complex behaviour that depends on wind friction, wave induced Reynolds number and flow topology. The results of more than 100 experiments show that there is a dependence of the maximum diffusivity on a Reynolds number derived from the wave height[1]. The increase of diffusivity with wave height only occurs for large enough wave Reynolds numbers. Other important factors are wind speed and tidal currents. The horizontal diffusivity shows also a marked anisotropy and spectral dependence [4,6]. [1] M. Diez, M. O. Bezerra, C. Mosso, R. Castilla and J. M. Redondo,Experimental measurements and diffusion in harbor and coastal zones. Il Nuovo Cimento Vol. 31 C, N. 5-6 Settembre-Dicembre (2008), 843. [2] Carrillo A., Sanchez M. A., Platonov A. and Redondo J. M., Phys. Chem. Earth B, 26. 4 (2001) 305. [3] Redondo J. M., Sanchez M. A. and Castilla R

  15. Anisotropy in "isotropic diffusion" measurements due to nongaussian diffusion

    DEFF Research Database (Denmark)

    Jespersen, Sune Nørhøj; Olesen, Jonas Lynge; Ianuş, Andrada


    model-free decomposition of diffusion signal kurtosis into terms originating from either ensemble variance of isotropic diffusivity or microscopic diffusion anisotropy. This ability rests on the assumption that diffusion can be described as a sum of multiple Gaussian compartments, but this is often...... dependence of the diffusion tensors, which causes the measured isotropic diffusivity to depend on gradient frame orientation. In turn, this conflates orientation dispersion with ensemble variance in isotropic diffusivity. Second, additional contributions to the apparent variance in isotropic diffusivity...

  16. Stroboscopic shearography for vibration analysis (United States)

    Steinchen, Wolfgang; Kupfer, Gerhard; Maeckel, Peter; Voessing, Frank


    Digital Shearography, a laser interferometric technique in conjunction with the digital image processing, has the potential for vibration analysis due to its simple optical system and insensitivity against small rigid body motions. This paper will focus on its recent developments for vibration analysis and for nondestructive testing (NDT) by dynamic (harmonical) excitation. With the introduction of real time observation using automatically refreshing reference frame, both small and large rigid body motions are greatly suppressed. The development of a smaller and more mobile measuring device in conjunction with a user guided comfortable program Shearwin enables the digital shearography to be applied easily as an industrial online testing tool.

  17. Vibrational Collapse of Hexapod Packings (United States)

    Zhao, Yuchen; Ding, Jingqiu; Barés, Jonathan; Zheng, Hu; Dierichs, Karola; Menges, Achim; Behringer, Robert


    Columns made of convex noncohesive grains like sand collapse after being released from a confining container. However, structures built from non-convex grains can be stable without external support. In the current experiments, we investigate the effect of vibration on destroying such columns. The change of column height during vertical vibration, can be well characterized by stretched exponential relaxation when the column is short, which is in agreement with previous work, while a faster collapse happens when the column is tall. We investigate the collapse after the fast process including its dependence on column geometry, and on interparticle and basal friction.

  18. Innovative Techniques Simplify Vibration Analysis (United States)


    In the early years of development, Marshall Space Flight Center engineers encountered challenges related to components in the space shuttle main engine. To assess the problems, they evaluated the effects of vibration and oscillation. To enhance the method of vibration signal analysis, Marshall awarded Small Business Innovation Research (SBIR) contracts to AI Signal Research, Inc. (ASRI), in Huntsville, Alabama. ASRI developed a software package called PC-SIGNAL that NASA now employs on a daily basis, and in 2009, the PKP-Module won Marshall s Software of the Year award. The technology is also used in many industries: aircraft and helicopter, rocket engine manufacturing, transportation, and nuclear power."

  19. Jahn-Teller Spectral Fingerprint in Molecular Photoemission: C60


    Manini, Nicola; Gattari, Paolo; Tosatti, Erio


    The h_u hole spectral intensity for C60 -> C60+ molecular photoemission is calculated at finite temperature by a parameter-free Lanczos diagonalization of the electron-vibration Hamiltonian, including the full 8 H_g, 6 G_g, and 2 A_g mode couplings. The computed spectrum at 800 K is in striking agreement with gas-phase data. The energy separation of the first main shoulder from the main photoemission peak, 230 meV in C60, is shown to measure directly and rather generally the strength of the f...

  20. Jahn-Teller spectral fingerprint in molecular photoemission: c60. (United States)

    Manini, Nicola; Gattari, Paolo; Tosatti, Erio


    The h(u) hole spectral intensity for C60-->C+60 molecular photoemission is calculated at finite temperature by a parameter-free Lanczos diagonalization of the electron-vibration Hamiltonian, including the full 8 H(g), 6 G(g), and 2 A(g) mode couplings. The computed spectrum at 800 K is in striking agreement with gas-phase data. The energy separation of the first main shoulder from the main photoemission peak, 230 meV in C60, is shown to measure directly and rather generally the strength of the final-state Jahn-Teller coupling.

  1. Li diffusion in zircon (United States)

    Cherniak, D. J.; Watson, E. B.


    Diffusion of Li under anhydrous conditions at 1 atm and under fluid-present elevated pressure (1.0-1.2 GPa) conditions has been measured in natural zircon. The source of diffusant for 1-atm experiments was ground natural spodumene, which was sealed under vacuum in silica glass capsules with polished slabs of zircon. An experiment using a Dy-bearing source was also conducted to evaluate possible rate-limiting effects on Li diffusion of slow-diffusing REE+3 that might provide charge balance. Diffusion experiments performed in the presence of H2O-CO2 fluid were run in a piston-cylinder apparatus, using a source consisting of a powdered mixture of spodumene, quartz and zircon with oxalic acid added to produce H2O-CO2 fluid. Nuclear reaction analysis (NRA) with the resonant nuclear reaction 7Li(p,γ)8Be was used to measure diffusion profiles for the experiments. The following Arrhenius parameters were obtained for Li diffusion normal to the c-axis over the temperature range 703-1.151°C at 1 atm for experiments run with the spodumene source: D_{text{Li}} = 7.17 × 10^{ - 7} { exp }( - 275 ± 11 {text{kJmol}}^{ - 1} /{text{RT}}){text{m}}2 {text{s}}^{ - 1}. Diffusivities are similar for transport parallel to the c-axis, indicating little anisotropy for Li diffusion in zircon. Similar Li diffusivities were also found for experiments run under fluid-present conditions and for the experiment run with the Dy-bearing source. Li diffusion is considerably faster than diffusion of other cations in zircon, with a smaller activation energy for diffusion. Although Li diffusion in zircon is comparatively rapid, zircons will be moderately retentive of Li signatures at mid-crustal metamorphic temperatures, but they are unlikely to retain this information for geologically significant times under high-grade metamorphism.

  2. Secondary flows enhance mixing in a model of vibration-assisted dialysis (United States)

    Pitre, John; Mueller, Bruce; Lewis, Susan; Bull, Joseph


    Hemodialysis is an integral part of treatment for patients with end stage renal disease. While hemodialysis has traditionally been described as a diffusion-dominated process, recent in vitro work has shown that vibration of the dialyzer can enhance the clearance of certain solutes during treatment. We hypothesize that the addition of vibration generates secondary flows in the dialysate compartment. These flows, perpendicular to the longitudinal axis of the dialysis fibers, advect solute away from the fiber walls, thus maintaining a larger concentration gradient and enhancing diffusion. Using the finite element method, we simulated the flow of dialysate through a hexagonally-packed array of cylinders and the transport of solute away from the cylinder walls. The addition of vibration was modeled using sinusoidal body forces of various frequencies and amplitudes. Using the variance of the concentration field as a metric, we found that vibration improves mixing according to a power law dependency on frequency. We will discuss the implications of these computational results on our understanding of the in vitro experiments and propose optimal vibration patterns for improving clearance in dialysis treatments. This work was supported by the Michigan Institute for Clinical and Health Research and NIH Grant UL1TR000433.

  3. A data driven control method for structure vibration suppression (United States)

    Xie, Yangmin; Wang, Chao; Shi, Hang; Shi, Junwei


    High radio-frequency space applications have motivated continuous research on vibration suppression of large space structures both in academia and industry. This paper introduces a novel data driven control method to suppress vibrations of flexible structures and experimentally validates the suppression performance. Unlike model-based control approaches, the data driven control method designs a controller directly from the input-output test data of the structure, without requiring parametric dynamics and hence free of system modeling. It utilizes the discrete frequency response via spectral analysis technique and formulates a non-convex optimization problem to obtain optimized controller parameters with a predefined controller structure. Such approach is then experimentally applied on an end-driving flexible beam-mass structure. The experiment results show that the presented method can achieve competitive disturbance rejections compared to a model-based mixed sensitivity controller under the same design criterion but with much less orders and design efforts, demonstrating the proposed data driven control is an effective approach for vibration suppression of flexible structures.

  4. Numerical investigation on vibration and noise induced by unsteady flow in an axial-flow pump

    Energy Technology Data Exchange (ETDEWEB)

    Chen, Eryun; Ma, Zui Ling; Yang, Ai Ling; Nan, Guo Fang [School of Energy and Power Engineering, University of Shanghai for Science and Technology, Shanghai (China); Zhao, Gai Ping [School of Medical Instruments and Food Engineering, University of Shanghai for Science and Technology, Shanghai (China); Li, Guo Ping [Shanghai Marine Equipment Research Institute, Shanghai (China)


    Full-scale structural vibration and noise induced by flow in an axial-flow pump was simulated by a hybrid numerical method. An unsteady flow field was solved by a large eddy simulation-based computational fluid dynamics commercial code, Fluent. An experimental validation on pressure fluctuations was performed to impose an appropriate vibration exciting source. The consistency between the computed results and experimental tests were interesting. The modes of the axial-flow pump were computed by the finite element method. After that, the pump vibration and sound field were solved using a coupled vibro-acoustic model. The numerical results indicated that the the blade-passing frequency was the dominant frequency of the vibration acceleration of the pump. This result was consistent with frequency spectral characteristics of unsteady pressure fluctuation. Finally, comparisons of the vibration acceleration between the computed results and the experimental test were conducted. These comparisons validated the computed results. This study shows that using the hybrid numerical method to evaluate the flow-induced vibration and noise generated in an axial-flow pump is feasible.

  5. Energetics, structures, vibrational frequencies, vibrational absorption, vibrational circular dichroism and Raman intensities of Leu-enkephalin

    DEFF Research Database (Denmark)

    Jalkanen, Karl J.


    Here we present several low energy conformers of Leu-enkephalin (LeuE) calculated with the density functional theory using the Becke 3LYP hybrid functional and the 6-31G* basis set. The structures, conformational energies, vibrational frequencies, vibrational absorption (VA) intensities......, vibrational circular dichroism (VCD) intensities and Raman scattering intensities are reported for the conformers of LeuE which are expected to be populated at room temperature. The species of LeuE-present in non-polar solvents is the neutral non-ionic species with the NH2 and CO2H groups, in contrast...... to the zwitterionic neutral species with the NH3+ and CO2- groups which predominates in aqueous solution and in the crystal. All of our attempts to find the zwitterionic species in the isolated state failed, with the result that a hydrogen atom from the positively charged N-terminus ammonium group transferred either...

  6. Resonant vibration control of rotating beams

    DEFF Research Database (Denmark)

    Svendsen, Martin Nymann; Krenk, Steen; Høgsberg, Jan Becker


    Rotatingstructures,like e.g.wind turbine blades, may be prone to vibrations associated with particular modes of vibration. It is demonstrated, how this type of vibrations can be reduced by using a collocated sensor–actuator system, governed by a resonant controller. The theory is here demonstrated...... modal connectivity, only very limited modal spill-over is generated. The controller acts by resonance and therefore has only a moderate energy consumption, and successfully reduces modal vibrations at the resonance frequency....

  7. Whole-Body Vibration in Farming: Background Document for Creating a Simplified Procedure to Determine Agricultural Tractor Vibration Comfort

    Directory of Open Access Journals (Sweden)

    Maurizio Cutini


    Full Text Available Operator exposure to high levels of whole-body vibration (WBV presents risks to health and safety and it is reported to worsen or even cause back injuries. Work activities resulting in operator exposure to whole-body vibration have a common onset in off-road work such as farming. Despite the wide variability of agricultural surface profiles, studies have shown that with changing soil profile and tractor speed, the accelerations resulting from ground input present similar spectral trends. While on the one hand such studies confirmed that tractor WBV emission levels are very dependent upon the nature of the operation performed, on the other, irrespective of the wide range of conditions characterizing agricultural operations, they led researchers to set up a possible and realistic simplification and standardization of tractor driver comfort testing activities. The studies presented herewith indicate the usefulness, and the possibility, of developing simplified procedures to determine agricultural tractor vibration comfort. The results obtained could be used effectively to compare tractors of the same category or a given tractor when equipped with different seats, suspension, tyres, etc.

  8. Laboratory spectroscopic study and astronomical detection of vibrationally excited n-propyl cyanide (United States)

    Müller, Holger S. P.; Walters, Adam; Wehres, Nadine; Belloche, Arnaud; Wilkins, Olivia H.; Liu, Delong; Vicente, Rémi; Garrod, Robin T.; Menten, Karl M.; Lewen, Frank; Schlemmer, Stephan


    Context. We performed a spectral line survey called Exploring Molecular Complexity with ALMA (EMoCA) toward Sagittarius B2(N) between 84.1 and 114.4 GHz with the Atacama Large Millimeter/submillimeter Array (ALMA) in its Cycles 0 and 1. We determined line intensities of n-propyl cyanide in the ground vibrational states of its gauche and anti conformers toward the hot molecular core Sagittarius B2(N2) which suggest that we should also be able to detect transitions pertaining to excited vibrational states. Aims: We wanted to determine spectroscopic parameters of low-lying vibrational states of both conformers of n-propyl cyanide to search for them in our ALMA data. Methods: We recorded laboratory rotational spectra of n-propyl cyanide in two spectral windows between 36 and 127 GHz. We searched for emission lines produced by these states in the ALMA spectrum of Sagittarius B2(N2). We modeled their emission and the emission of the ground vibrational states assuming local thermodynamic equilibrium (LTE). Results: We have made extensive assignments of a- and b-type transitions of the four lowest vibrational states of the gauche conformer which reach J and Ka quantum numbers of 65 and 20, respectively. We assigned mostly a-type transitions for the anti conformer with J and Ka quantum numbers up to 48 and 24, respectively. Rotational and Fermi perturbations between two anti states allowed us to determine their energy difference. The resulting spectroscopic parameters enabled us to identify transitions of all four vibrational states of each conformer in our ALMA data. The emission features of all states, including the ground vibrational state, are well-reproduced with the same LTE modeling parameters, which gives us confidence in the reliability of the identifications, even for the states with only one clearly detected line. Conclusions: Emission features pertaining to the highest excited vibrational states of n-propyl cyanide reported in this work have been identified just

  9. Modeling the Vibrational Dynamics and Nonlinear Infrared Spectra of Coupled Amide I and II Modes in Peptides

    NARCIS (Netherlands)

    Dijkstra, Arend G.; Jansen, Thomas la Cour; Knoester, Jasper


    The amide vibrational modes play an important role in energy transport and relaxation in polypeptides and proteins and provide us with spectral markers for structure and structural dynamics of these macromolecules. Here, we present a detailed model to describe the dynamic properties of the amide I

  10. Low-energy isovector quadrupole vibrations

    Energy Technology Data Exchange (ETDEWEB)

    Faessler, A.; Nojarov, R.


    The low-lying isovector quadrupole vibrations are described by an extension of the vibrational model allowing independent proton and neutron vibrations coupled by the symmetry energy. The recently detected low-lying isovector states in nearly spherical nuclei with N=84 are described well concerning their energies and E2/M1 mixing ratios. (orig.).

  11. Ground Vibration Measurements at LHC Point 4

    Energy Technology Data Exchange (ETDEWEB)

    Bertsche, Kirk; /SLAC; Gaddi, Andrea; /CERN


    Ground vibration was measured at Large Hadron Collider (LHC) Point 4 during the winter shutdown in February 2012. This report contains the results, including power and coherence spectra. We plan to collect and analyze vibration data from representative collider halls to inform specifications for future linear colliders, such as ILC and CLIC. We are especially interested in vibration correlations between final focus lens locations.

  12. Rotor Vibration Reduction via Active Hybrid Bearings

    DEFF Research Database (Denmark)

    Nicoletti, Rodrigo; Santos, Ilmar


    The use of fluid power to reduce and control rotor vibration in rotating machines is investigated. An active hybrid bearing is studied, whose main objective is to reduce wear and vibration between rotating and stationary machinery parts. By injecting pressurised oil into the oil film, through...... with experiment, and simulations show the feasibility of controlling shaft vibration through this active device....

  13. 33 CFR 159.103 - Vibration test. (United States)


    ... 33 Navigation and Navigable Waters 2 2010-07-01 2010-07-01 false Vibration test. 159.103 Section...) POLLUTION MARINE SANITATION DEVICES Design, Construction, and Testing § 159.103 Vibration test. The device... subjected to a sinusoidal vibration for a period of 12 hours, 4 hours in each of the x, y, and z planes, at...

  14. 14 CFR 27.907 - Engine vibration. (United States)


    ... 14 Aeronautics and Space 1 2010-01-01 2010-01-01 false Engine vibration. 27.907 Section 27.907... STANDARDS: NORMAL CATEGORY ROTORCRAFT Powerplant General § 27.907 Engine vibration. (a) Each engine must be installed to prevent the harmful vibration of any part of the engine or rotorcraft. (b) The addition of the...

  15. 14 CFR 29.251 - Vibration. (United States)


    ... 14 Aeronautics and Space 1 2010-01-01 2010-01-01 false Vibration. 29.251 Section 29.251... STANDARDS: TRANSPORT CATEGORY ROTORCRAFT Flight Miscellaneous Flight Requirements § 29.251 Vibration. Each part of the rotorcraft must be free from excessive vibration under each appropriate speed and power...

  16. 14 CFR 29.907 - Engine vibration. (United States)


    ... 14 Aeronautics and Space 1 2010-01-01 2010-01-01 false Engine vibration. 29.907 Section 29.907... STANDARDS: TRANSPORT CATEGORY ROTORCRAFT Powerplant General § 29.907 Engine vibration. (a) Each engine must be installed to prevent the harmful vibration of any part of the engine or rotorcraft. (b) The...

  17. 14 CFR 27.251 - Vibration. (United States)


    ... 14 Aeronautics and Space 1 2010-01-01 2010-01-01 false Vibration. 27.251 Section 27.251... STANDARDS: NORMAL CATEGORY ROTORCRAFT Flight Miscellaneous Flight Requirements § 27.251 Vibration. Each part of the rotorcraft must be free from excessive vibration under each appropriate speed and power...

  18. 49 CFR 178.608 - Vibration standard. (United States)


    ... 49 Transportation 2 2010-10-01 2010-10-01 false Vibration standard. 178.608 Section 178.608... Testing of Non-bulk Packagings and Packages § 178.608 Vibration standard. (a) Each packaging must be capable of withstanding, without rupture or leakage, the vibration test procedure outlined in this section...

  19. 49 CFR 178.985 - Vibration test. (United States)


    ... 49 Transportation 2 2010-10-01 2010-10-01 false Vibration test. 178.985 Section 178.985... Testing of Large Packagings § 178.985 Vibration test. (a) General. All rigid Large Packaging and flexible Large Packaging design types must be capable of withstanding the vibration test. (b) Test method. (1) A...

  20. Vibration measurements on timber frame floors

    NARCIS (Netherlands)

    Kuilen, J.W.G. van de; Oosterhout, G.P.C. van; Donkervoort, R.


    In the design of lightweight floors vibrational aspects become more and more important. With the foreseen introduction of Eurocode 5 the vibration of timber floors becomes a part of the design for serviceability. Design rules for the vibrational behaviour are given in Eurocode 5. The first rule is

  1. Vibrations in a moving flexible robot arm (United States)

    Wang, P. K. C.; Wei, Jin-Duo


    The vibration in a flexible robot arm modeled by a moving slender prismatic beam is considered. It is found that the extending and contracting motions have destabilizing and stabilizing effects on the vibratory motions, respectively. The vibration analysis is based on a Galerkin approximation with time-dependent basis functions. Typical numerical results are presented to illustrate the qualitative features of vibrations.

  2. Comparative Study of Time-Frequency Decomposition Techniques for Fault Detection in Induction Motors Using Vibration Analysis during Startup Transient

    Directory of Open Access Journals (Sweden)

    Paulo Antonio Delgado-Arredondo


    Full Text Available Induction motors are critical components for most industries and the condition monitoring has become necessary to detect faults. There are several techniques for fault diagnosis of induction motors and analyzing the startup transient vibration signals is not as widely used as other techniques like motor current signature analysis. Vibration analysis gives a fault diagnosis focused on the location of spectral components associated with faults. Therefore, this paper presents a comparative study of different time-frequency analysis methodologies that can be used for detecting faults in induction motors analyzing vibration signals during the startup transient. The studied methodologies are the time-frequency distribution of Gabor (TFDG, the time-frequency Morlet scalogram (TFMS, multiple signal classification (MUSIC, and fast Fourier transform (FFT. The analyzed vibration signals are one broken rotor bar, two broken bars, unbalance, and bearing defects. The obtained results have shown the feasibility of detecting faults in induction motors using the time-frequency spectral analysis applied to vibration signals, and the proposed methodology is applicable when it does not have current signals and only has vibration signals. Also, the methodology has applications in motors that are not fed directly to the supply line, in such cases the analysis of current signals is not recommended due to poor current signal quality.

  3. Vibration Theory, Vol. 1A

    DEFF Research Database (Denmark)

    Nielsen, Søren R. K.

    The present collection of solved problems has been published as a supplement to the textbook Svingningsteori. Bind 1. Lineær svingningsteori,Aalborg tekniske Universitetsforlag, 1991, whicj is used in the introductory course on linear vibration theory that is being given on th e8th semester...

  4. Vibration Damping Circuit Card Assembly (United States)

    Hunt, Ronald Allen (Inventor)


    A vibration damping circuit card assembly includes a populated circuit card having a mass M. A closed metal container is coupled to a surface of the populated circuit card at approximately a geometric center of the populated circuit card. Tungsten balls fill approximately 90% of the metal container with a collective mass of the tungsten balls being approximately (0.07) M.

  5. Wideband Piezomagnetoelastic Vibration Energy Harvesting

    DEFF Research Database (Denmark)

    Lei, Anders; Thomsen, Erik Vilain


    This work presents a small-scale wideband piezomagnetoelastic vibration energy harvester (VEH) aimed for operation at frequencies of a few hundred Hz. The VEH consists of a tape-casted PZT cantilever with thin sheets of iron foil attached on each side of the free tip. The wideband operation...

  6. Ultrafast vibrations of gold nanorings

    DEFF Research Database (Denmark)

    Kelf, T; Tanaka, Y; Matsuda, O


    We investigate the vibrational modes of gold nanorings on a silica substrate with an ultrafast optical technique. By comparison with numerical simulations, we identify several resonances in the gigahertz range associated with axially symmetric deformations of the nanoring and substrate. We...

  7. Effect of shelf aging on vibration transmissibility of anti-vibration gloves. (United States)

    Shibata, Nobuyuki


    Anti-vibration gloves have been used in real workplaces to reduce vibration transmitted through hand-held power tools to the hand. Generally materials used for vibration attenuation in gloves are resilient materials composed of certain synthetic and/or composite polymers. The mechanical characteristics of the resilient materials used in anti-vibration gloves are prone to be influenced by environmental conditions such as temperature, humidity, and photo-irradiation, which cause material degradation and aging. This study focused on the influence of shelf aging on the vibration attenuation performance of air-packaged anti-vibration gloves following 2 years of shelf aging. Effects of shelf aging on the vibration attenuation performance of anti-vibration gloves were examined according to the Japan industrial standard JIS T8114 test protocol. The findings indicate that shelf aging induces the reduction of vibration attenuation performance in air-packaged anti-vibration gloves.

  8. Metric diffusion along foliations

    CERN Document Server

    Walczak, Szymon M


    Up-to-date research in metric diffusion along compact foliations is presented in this book. Beginning with fundamentals from the optimal transportation theory and the theory of foliations; this book moves on to cover Wasserstein distance, Kantorovich Duality Theorem, and the metrization of the weak topology by the Wasserstein distance. Metric diffusion is defined, the topology of the metric space is studied and the limits of diffused metrics along compact foliations are discussed. Essentials on foliations, holonomy, heat diffusion, and compact foliations are detailed and vital technical lemmas are proved to aide understanding. Graduate students and researchers in geometry, topology and dynamics of foliations and laminations will find this supplement useful as it presents facts about the metric diffusion along non-compact foliation and provides a full description of the limit for metrics diffused along foliation with at least one compact leaf on the two dimensions.

  9. Rectangular spectral collocation

    KAUST Repository

    Driscoll, Tobin A.


    Boundary conditions in spectral collocation methods are typically imposed by removing some rows of the discretized differential operator and replacing them with others that enforce the required conditions at the boundary. A new approach based upon resampling differentiated polynomials into a lower-degree subspace makes differentiation matrices, and operators built from them, rectangular without any row deletions. Then, boundary and interface conditions can be adjoined to yield a square system. The resulting method is both flexible and robust, and avoids ambiguities that arise when applying the classical row deletion method outside of two-point scalar boundary-value problems. The new method is the basis for ordinary differential equation solutions in Chebfun software, and is demonstrated for a variety of boundary-value, eigenvalue and time-dependent problems.

  10. Transparent Window Vibrational Probes for the Characterization of Proteins With High Structural and Temporal Resolution. (United States)

    Adhikary, Ramkrishna; Zimmermann, Jörg; Romesberg, Floyd E


    Vibrational spectroscopy provides a direct route to the physicochemical characterization of molecules. While both IR and Raman spectroscopy have been used for decades to provide detailed characterizations of small molecules, similar studies with proteins are largely precluded due to spectral congestion. However, the vibrational spectra of proteins do include a "transparent window", between ∼1800 and ∼2500 cm-1, and progress is now being made to develop site-specifically incorporated carbon-deuterium (C-D), cyano (CN), thiocyanate (SCN), and azide (N3) "transparent window vibrational probes" that absorb within this window and report on their environment to facilitate the characterization of proteins with small molecule-like detail. This Review opens with a brief discussion of the advantages and limitations of conventional vibrational spectroscopy and then discusses the strengths and weaknesses of the different transparent window vibrational probes, methods by which they may be site-specifically incorporated into peptides and proteins, and the physicochemical properties they may be used to study, including electrostatics, stability and folding, hydrogen bonding, protonation, solvation, dynamics, and interactions with inhibitors. The use of the probes to vibrationally image proteins and other biomolecules within cells is also discussed. We then present four case studies, focused on ketosteroid isomerase, the SH3 domain, dihydrofolate reductase, and cytochrome c, where the transparent window vibrational probes have already been used to elucidate important aspects of protein structure and function. The Review concludes by highlighting the current challenges and future potential of using transparent window vibrational probes to understand the evolution and function of proteins and other biomolecules.

  11. Spectral unmixing: estimating partial abundances

    CSIR Research Space (South Africa)

    Debba, Pravesh


    Full Text Available of spectral unmixing 3 End-member spectra and synthetic mixtures 4 Results 5 Conclusions Debba (CSIR) Spectral Unmixing LQM 2009 2 / 22 Background and Research Question If research could be as easy as eating a chocolate cake . . . Figure: Can you guess... the ingredients for this chocolate cake? Debba (CSIR) Spectral Unmixing LQM 2009 3 / 22 Background and Research Question Ingredients Quantity unsweetened chocolate unsweetened cocoa powder boiling water flour baking powder baking soda salt unsalted...

  12. Gold micro- and nano-particles for surface enhanced vibrational spectroscopy of pyridostigmine bromide

    DEFF Research Database (Denmark)

    Dolgov, Leonid; Fesenko, Olena; Kavelin, Vladyslav


    Triangular gold microprisms and spherical silica nanoparticles with attached gold nano-islands were examined as an active nanostructures for the surface enhanced Raman and infrared spectroscopy. These particles were probed for the detection of pyridostigmine bromide as a safe analog of military...... compound sarin. Raman and infrared spectral bands of the pyridostigmine bromide were measured. Detailed correlation of obtained spectral bands with specific vibrations in pyridostigmine bromide was done. Silica nanoparticles with attached gold nano-islands showed more essential enhancement of the Raman...

  13. Rotating shadowband radiometer development and analysis of spectral shortwave data

    Energy Technology Data Exchange (ETDEWEB)

    Michalsky, J.; Harrison, L.; Min, Q. [State Univ. of New York, Albany, NY (United States)] [and others


    Our goals in the Atmospheric Radiation Measurement (ARM) Program are improved measurements of spectral shortwave radiation and improved techniques for the retrieval of climatologically sensitive parameters. The multifilter rotating shadowband radiometer (MFRSR) that was developed during the first years of the ARM program has become a workhorse at the Southern Great Plains (SGP) Cloud and Radiation Testbed (CART) site, and it is widely deployed in other climate programs. We have spent most of our effort this year developing techniques to retrieve column aerosol, water vapor, and ozone from direct beam spectral measurements of the MFRSR. Additionally, we have had some success in calculating shortwave surface diffuse spectral irradiance. Using the surface albedo and the global irradiance, we have calculated cloud optical depths. From cloud optical depth and liquid water measured with the microwave radiometer, we have calculated effective liquid cloud particle radii. The rest of the text will provide some detail regarding each of these efforts.

  14. Predicting soil organic carbon at field scale using a national soil spectral library

    DEFF Research Database (Denmark)

    Peng, Yi; Knadel, Maria; Gislun, Rene


    and the spectral library, 2718 samples) and (iii) three sub-sets selected from the spectral library. In an attempt to improve prediction accuracy, sub-sets of the soil spectral library were made using three different sample selection methods: those geographically closest (84 samples), those with the same landscape......Visible and near infrared diffuse reflectance (vis-NIR) spectroscopy is a low-cost, efficient and accurate soil analysis technique and is thus becoming increasingly popular. Soil spectral libraries are commonly constructed as the basis for estimating soil texture and properties. In this study......, partial least squares regression was used to develop models to predict the soil organic carbon (SOC) content of 35 soil samples from one field using (i) the Danish soil spectral library (2688 samples), (ii) a spiked spectral library (a combination of 30 samples selected from the local area...

  15. The effects of sound level and vibration magnitude on the relative discomfort of noise and vibration. (United States)

    Huang, Yu; Griffin, Michael J


    The relative discomfort caused by noise and vibration, how this depends on the level of noise and the magnitude of vibration, and whether the noise and vibration are presented simultaneously or sequentially has been investigated in a laboratory study with 20 subjects. Noise and vertical vibration were reproduced with all 49 combinations of 7 levels of noise and 7 magnitudes of vibration to allow the discomfort caused by one of the stimuli to be judged relative to the other stimulus using magnitude estimation. In four sessions, subjects judged noise relative to vibration and vibration relative to noise, with both simultaneous and sequential presentations of the stimuli. The equivalence of noise and vibration was not greatly dependent on whether the stimuli were simultaneous or sequential, but highly dependent on whether noise was judged relative to vibration or vibration was judged relative to noise. When judging noise, higher magnitude vibrations appeared to mask the discomfort caused by low levels of noise. When judging vibration, higher level noises appeared to mask the discomfort caused by low magnitudes of vibration. The judgment of vibration discomfort was more influenced by noise than the judgment of noise discomfort was influenced by vibration.

  16. Quantum chemical studies on structural, vibrational, nonlinear optical properties and chemical reactivity of indigo carmine dye (United States)

    El-Mansy, M. A. M.


    Structural and vibrational spectroscopic studies were performed on indigo carmine (IC) isomers using FT-IR spectral analysis along with DFT/B3LYP method utilizing Gaussian 09 software. GaussView 5 program has been employed to perform a detailed interpretation of vibrational spectra. Simulation of infrared spectra has led to an excellent overall agreement with the observed spectral patterns. Mulliken population analyses on atomic charges, MEP, HOMO-LUMO, NLO, first order hyperpolarizability and thermodynamic properties have been examined by (DFT/B3LYP) method with the SDD basis set level. Density of state spectra (DOS) were calculated using GaussSum 3 at the same level of theory. Molecular modeling approved that DOS Spectra are the most significant tools for differentiating between two IC isomers so far. Moreover, The IC isomers (cis-isomer) have shown an extended applicability for manufacturing both NLO and photovoltaic devices such as solar cells.

  17. Diffusion formalism and applications

    CERN Document Server

    Dattagupta, Sushanta


    Within a unifying framework, Diffusion: Formalism and Applications covers both classical and quantum domains, along with numerous applications. The author explores the more than two centuries-old history of diffusion, expertly weaving together a variety of topics from physics, mathematics, chemistry, and biology. The book examines the two distinct paradigms of diffusion-physical and stochastic-introduced by Fourier and Laplace and later unified by Einstein in his groundbreaking work on Brownian motion. The author describes the role of diffusion in probability theory and stochastic calculus and

  18. Inpainting using airy diffusion (United States)

    Lorduy Hernandez, Sara


    One inpainting procedure based on Airy diffusion is proposed, implemented via Maple and applied to some digital images. Airy diffusion is a partial differential equation with spatial derivatives of third order in contrast with the usual diffusion with spatial derivatives of second order. Airy diffusion generates the Airy semigroup in terms of the Airy functions which can be rewritten in terms of Bessel functions. The Airy diffusion can be used to smooth an image with the corresponding noise elimination via convolution. Also the Airy diffusion can be used to erase objects from an image. We build an algorithm using the Maple package ImageTools and such algorithm is tested using some images. Our results using Airy diffusion are compared with the similar results using standard diffusion. We observe that Airy diffusion generates powerful filters for image processing which could be incorporated in the usual packages for image processing such as ImageJ and Photoshop. Also is interesting to consider the possibility to incorporate the Airy filters as applications for smartphones and smart-glasses.

  19. [Review of digital ground object spectral library]. (United States)

    Zhou, Xiao-Hu; Zhou, Ding-Wu


    A higher spectral resolution is the main direction of developing remote sensing technology, and it is quite important to set up the digital ground object reflectance spectral database library, one of fundamental research fields in remote sensing application. Remote sensing application has been increasingly relying on ground object spectral characteristics, and quantitative analysis has been developed to a new stage. The present article summarized and systematically introduced the research status quo and development trend of digital ground object reflectance spectral libraries at home and in the world in recent years. Introducing the spectral libraries has been established, including desertification spectral database library, plants spectral database library, geological spectral database library, soil spectral database library, minerals spectral database library, cloud spectral database library, snow spectral database library, the atmosphere spectral database library, rocks spectral database library, water spectral database library, meteorites spectral database library, moon rock spectral database library, and man-made materials spectral database library, mixture spectral database library, volatile compounds spectral database library, and liquids spectral database library. In the process of establishing spectral database libraries, there have been some problems, such as the lack of uniform national spectral database standard and uniform standards for the ground object features as well as the comparability between different databases. In addition, data sharing mechanism can not be carried out, etc. This article also put forward some suggestions on those problems.

  20. Experimental studies on sound and vibration of a two-tone Chinese Peace Bell (United States)

    Cheng, Jianzheng; Lan, Congqing


    In order to examine whether the characteristics of the bell are coincident with the design and make some constructive suggestions for the tuning of bell, the frequency characteristics of sound and the vibrational modes of a two-tone Chinese Peace Bell have been studied. With Welch's spectral estimate, the main partials of radiated sound of the bell have been found out. With time-frequency analysis, the changes of the spectrum with time have been shown. By conditional mean frequency (CMF) of the spectrogram of the sound, the change in the pitch of the bell has been discussed. With an accelerator, the vibration distributions on the different points of the bell have been measured. With short time spectrum analysis, the vibrational modes at different frequencies have been reconstructed.

  1. Investigation of the vibration and EMC characteristics of miniature Stirling electric coolers for space applications (United States)

    Kondratjev, V.; Gostilo, V.; Owens, anb A.


    We present the results of an investigation into the detrimental effects that electromechanical coolers can have on the spectral performance of compact, large volume HPGe spectrometers for space applications. Both mechanical vibration and electromagnetic pickup effects were considered, as well as a comparative assessment between three miniature Stirling cycle coolers—two Ricor model K508 coolers and one Thales model RM3 cooler. In spite of the limited number of coolers tested, the following conclusions can be made. There are significant differences in the vibration characteristics not only between the various types of cooler but also between coolers of the same type. It was also found that compared to the noise induced by mechanical vibrations, electromagnetic interference emanating from the embedded controllers does not significantly impact the energy resolution of detectors.

  2. Experimental study of vortex diffusers

    Energy Technology Data Exchange (ETDEWEB)

    Shakerin, S.; Miller, P.L. [National Renewable Energy Lab., Golden, CO (United States)


    This report documents experimental research performed on vortex diffusers used in ventilation and air-conditioning systems. The main objectives of the research were (1) to study the flow characteristics of isothermal jets issuing from vortex diffusers, (2) to compare the vortex diffuser`s performance with that of a conventional diffuser, and (3) to prepare a report that disseminates the results to the designers of ventilation and air-conditioning systems. The researchers considered three diffusers: a conventional round ceiling diffuser and two different styles of vortex diffusers. Overall, the vortex diffusers create slightly more induction of ambient air in comparison to the conventional diffuser.

  3. Transient vibration of wind turbine blades (United States)

    Li, Yuanzhe; Li, Minghai; Jiang, Feng


    This article aims to the transient vibration of wind turbine blades. We firstly introduce transient vibration and previous studies in this area. The report then shows the fundamental equations and derivation of Euler Equation. A 3-D beam are created to compare the analytical and numerical result. In addition we operate the existing result and Patran result of a truncation wedge beam, especially the frequencies of free vibration and transient vibration. Transient vibration cannot be vanished but in some case it can be reduced.

  4. UAV-based multi-spectral environmental monitoring (United States)

    Arnold, Thomas; De Biasio, Martin; Fritz, Andreas; Frank, Albert; Leitner, Raimund


    This paper describes an airborne multi-spectral imaging system which is able to simultaneously capture three visible (400-670nm at 50% FWHM) and three near infrared channels (670-1000nm at 50% FWHM). The rst prototype was integrated in a Schiebel CAMCOPTER®S-100 VTOL (Vertical Take-O and Landing) UAV (Unmanned Aerial Vehicle) for initial test ights in spring 2010. The UAV was own over land containing various types of vegetation. A miniaturized version of the initial multi-spectral imaging system was developed in 2011 to t into a more compact UAV. The imaging system captured six bands with a minimal spatial resolution of approx. 10cm x 10cm (depending on altitude). Results show that the system is able to resist the high vibration level during ight and that the actively stabilized camera gimbal compensates for rapid roll/tilt movements of the UAV. After image registration the acquired images are stitched together for land cover mapping and ight path validation. Moreover the system is able to distinguish between dierent types of vegetation and soil. Future work will include the use of spectral imaging techniques to identify spectral features that are related to water stress, nutrient deciency and pest infestation. Once these bands have been identied, narrowband lters will be incorporated into the airborne system.

  5. Spring 2014 Internship Diffuser Data Analysis (United States)

    Laigaie, Robert T.; Ryan, Harry M.


    J-2X engine testing on the A-2 test stand at the NASA John C. Stennis Space Center (SSC) has recently concluded. As part of that test campaign, the engine was operated at lower power levels in support of expanding the use of J-2X to other missions. However, the A-2 diffuser was not designed for engine testing at the proposed low power levels. To evaluate the risk of damage to the diffuser, computer simulations were created of the rocket engine exhaust plume inside the 50ft long, water-cooled, altitude-simulating diffuser. The simulations predicted that low power level testing would cause the plume to oscillate in the lower sections of the diffuser. This can possibly cause excessive vibrations, stress, and heat transfer from the plume to the diffuser walls. To understand and assess the performance of the diffuser during low power level engine testing, nine accelerometers and four strain gages were installed around the outer surface of the diffuser. The added instrumentation also allowed for the verification of the rocket exhaust plume computational model. Prior to engine hot-fire testing, a diffuser water-flow test was conducted to verify the proper operation of the newly installed instrumentation. Subsequently, two J-2X engine hot-fire tests were completed. Hot-Fire Test 1 was 11.5 seconds in duration, and accelerometer and strain data verified that the rocket engine plume oscillated in the lower sections of the diffuser. The accelerometers showed very different results dependent upon location. The diffuser consists of four sections, with Section 1 being closest to the engine nozzle and Section 4 being farthest from the engine nozzle. Section 1 accelerometers showed increased amplitudes at startup and shutdown, but low amplitudes while the diffuser was started. Section 3 accelerometers showed the opposite results with near zero G amplitudes prior to and after diffuser start and peak amplitudes to +/- 100G while the diffuser was started. Hot-Fire Test 1 strain gages

  6. Analysis of the Vibration Spectrum Based on the Input Voltage Spectrum


    Mathe, Laszlo; Jakobsen, Uffe; Rasmussen, Peter Omand; Pedersen, John Kim


    Pulse width modulation, present in most drives, gives rise to harmonics in the current and this generates radial forces that cause vibrations in the motor shell. This paper derives an analytical expression for the estimation of the spectrum of the radial force in a machine with an air gap, based on the spectrum of the applied voltage. The measurements show that the spectral components are caused mainly by the modulation, which agrees with the results from the analytical solution. A method...

  7. Application of fluorescent and vibration spectroscopy for septic serum human albumin structure deformation during pathology (United States)

    Zyubin, A.; Konstantinova, E.; Slezhkin, V.; Matveeva, K.; Samusev, I.; Bryukhanov, V.


    In this paper we perform results of conformational analysis of septic human serum albumin (HSA) carried out by Raman spectroscopy (RS), infrared (IR) spectroscopy and fluorescent spectroscopy. The main vibrational groups were identified and analyzed for septic HSA and its health control. Comparison between Raman and IR results were done. Fluorescent spectral changes of Trp-214 group were analyzed. Application of Raman, IR spectroscopy, fluorescent spectroscopy for conformational changes study of HSA during pathology were shown.

  8. Multiple Rabi Splittings under Ultrastrong Vibrational Coupling. (United States)

    George, Jino; Chervy, Thibault; Shalabney, Atef; Devaux, Eloïse; Hiura, Hidefumi; Genet, Cyriaque; Ebbesen, Thomas W


    From the high vibrational dipolar strength offered by molecular liquids, we demonstrate that a molecular vibration can be ultrastrongly coupled to multiple IR cavity modes, with Rabi splittings reaching 24% of the vibration frequencies. As a proof of the ultrastrong coupling regime, our experimental data unambiguously reveal the contributions to the polaritonic dynamics coming from the antiresonant terms in the interaction energy and from the dipolar self-energy of the molecular vibrations themselves. In particular, we measure the opening of a genuine vibrational polaritonic band gap of ca. 60 meV. We also demonstrate that the multimode splitting effect defines a whole vibrational ladder of heavy polaritonic states perfectly resolved. These findings reveal the broad possibilities in the vibrational ultrastrong coupling regime which impact both the optical and the molecular properties of such coupled systems, in particular, in the context of mode-selective chemistry.

  9. Vibrations on board and health effects

    DEFF Research Database (Denmark)

    Jensen, Anker; Jepsen, Jørgen Riis


    for such relation among seafarers except for fishermen, who, however, are also exposed to additional recognised physical risk factors at work. The assessment and reduction of vibrations by naval architects relates to technical implications of this impact for the ships’ construction, but has limited value......There is only limited knowledge of the exposure to vibrations of ships’ crews and their risk of vibration-induced health effects. Exposure to hand-arm vibrations from the use of vibrating tools at sea does not differ from that in the land-based trades. However, in contrast to most other work places...... of the health consequences of whole body vibrations in land-transportation, such exposure at sea may affect ships’ passengers and crews. While the relation of back disorders to high levels of whole body vibration has been demonstrated among e.g. tractor drivers, there are no reported epidemiological evidence...

  10. Application of a computerized vibroacoustic data bank for random vibration criteria development (United States)

    Ferebee, R. C.


    A computerized data bank system was developed for utilization of large amounts of vibration and acoustic data to formulate component random vibration design and test criteria. This system consists of a computer, graphics tablets, and a dry silver hard copier which are all desk top type hardware and occupy minimal space. Currently, the data bank contains data from the Saturn 5 and Titan 3 flight and static test programs. The vibration and acoustic data are stored in the form of power spectral density and one third octave band plots over the frequency range from 20 to 2000 Hz. The data were stored by digitizing each spectral plot by tracing with the graphics tablet. The digitized data were statistically analyzed, and the resulting 97.5 percent confidence levels were stored on tape along with the appropriate structural parameters. Standard extrapolation procedures were programmed for prediction of component random vibration test criteria for new launch vehicle and payload configurations. A user's manual is included to guide potential users through the programs.

  11. Concorde noise-induced building vibrations, Sully Plantation - Report no. 2, Chantilly, Virginia (United States)


    Noise-induced building vibrations associated with Concorde operations were studied. The approach is to record the levels of induced vibrations and associated indoor/outdoor noise levels in selected homes, historic and other buildings near Dulles International Airport. Representative data are presented which were recorded at Sully Plantation, Chantilly, Virginia during the periods of May 20 through May 28, 1976, and June 14 through June 17, 1976. Recorded data provide relationships between the vibration levels of windows, walls, floors, and the noise associated with Concorde operations, other aircraft, and nonaircraft events. The results presented are drawn from the combined May-June data base which is considerably larger than the May data base covered. The levels of window, wall and floor vibratory response resulting from Concorde operations are higher than the vibratory levels associated with conventional aircraft. Furthermore, the vibratory responses of the windows are considerably higher than those of the walls and floors. The window response is higher for aircraft than recorded nonaircraft events and exhibits a linear response relationship with the overall sound pressure level. For a given sound pressure level, the Concorde may cause more vibration than a conventional aircraft due to spectral or other differences. However, the responses associated with Concorde appear to be much more dependent upon sound pressure level than spectral or other characteristics of the noise.

  12. 2-Bromohydroquinone: structures, vibrational assignments and RHF, B- and B3-based density functional calculations. (United States)

    Ramoji, Anuradha; Yenagi, Jayashree; Tonannavar, J


    Vibrational spectral measurements, namely, infrared (4000-400 cm(-1)) and Raman (3500-50 cm(-1)) spectra have been made for 2-Bromohydroquinone. Optimized geometrical structures, harmonic vibrational frequencies and intensities have been computed by the ab initio (RHF), B-based (BLYP, BP86) and B3-based (B3P86, B3LYP, B3PW91) density functional methods using 6-31G(d) basis set. A complete assignment of the observed spectra has been proposed. Coupling of vibrations has been determined by calculating potential energy distributions (PEDs) at BP86/6-31G(d) level of theory. In the computed equilibrium geometries by all the levels, the bond lengths and bond angles show changes in the neighborhood of Bromine. Similarly, the vibrational spectra exhibit some marked spectral features unlike in hydroquinone and phenol. On the other hand, the infrared spectrum shows a clear evidence of O-H...O bonding near 3200 cm(-1) as in hydroquinone. Evaluation of the theoretical methods demonstrates that all the levels but the RHF have reproduced frequencies fairly accurately in the 2000-500 cm(-1); below 500 cm(-1) the RHF has performed reasonably well.

  13. Health State Monitoring of Bladed Machinery with Crack Growth Detection in BFG Power Plant Using an Active Frequency Shift Spectral Correction Method. (United States)

    Sun, Weifang; Yao, Bin; He, Yuchao; Chen, Binqiang; Zeng, Nianyin; He, Wangpeng


    Power generation using waste-gas is an effective and green way to reduce the emission of the harmful blast furnace gas (BFG) in pig-iron producing industry. Condition monitoring of mechanical structures in the BFG power plant is of vital importance to guarantee their safety and efficient operations. In this paper, we describe the detection of crack growth of bladed machinery in the BFG power plant via vibration measurement combined with an enhanced spectral correction technique. This technique enables high-precision identification of amplitude, frequency, and phase information (the harmonic information) belonging to deterministic harmonic components within the vibration signals. Rather than deriving all harmonic information using neighboring spectral bins in the fast Fourier transform spectrum, this proposed active frequency shift spectral correction method makes use of some interpolated Fourier spectral bins and has a better noise-resisting capacity. We demonstrate that the identified harmonic information via the proposed method is of suppressed numerical error when the same level of noises is presented in the vibration signal, even in comparison with a Hanning-window-based correction method. With the proposed method, we investigated vibration signals collected from a centrifugal compressor. Spectral information of harmonic tones, related to the fundamental working frequency of the centrifugal compressor, is corrected. The extracted spectral information indicates the ongoing development of an impeller blade crack that occurred in the centrifugal compressor. This method proves to be a promising alternative to identify blade cracks at early stages.

  14. Health State Monitoring of Bladed Machinery with Crack Growth Detection in BFG Power Plant Using an Active Frequency Shift Spectral Correction Method

    Directory of Open Access Journals (Sweden)

    Weifang Sun


    Full Text Available Power generation using waste-gas is an effective and green way to reduce the emission of the harmful blast furnace gas (BFG in pig-iron producing industry. Condition monitoring of mechanical structures in the BFG power plant is of vital importance to guarantee their safety and efficient operations. In this paper, we describe the detection of crack growth of bladed machinery in the BFG power plant via vibration measurement combined with an enhanced spectral correction technique. This technique enables high-precision identification of amplitude, frequency, and phase information (the harmonic information belonging to deterministic harmonic components within the vibration signals. Rather than deriving all harmonic information using neighboring spectral bins in the fast Fourier transform spectrum, this proposed active frequency shift spectral correction method makes use of some interpolated Fourier spectral bins and has a better noise-resisting capacity. We demonstrate that the identified harmonic information via the proposed method is of suppressed numerical error when the same level of noises is presented in the vibration signal, even in comparison with a Hanning-window-based correction method. With the proposed method, we investigated vibration signals collected from a centrifugal compressor. Spectral information of harmonic tones, related to the fundamental working frequency of the centrifugal compressor, is corrected. The extracted spectral information indicates the ongoing development of an impeller blade crack that occurred in the centrifugal compressor. This method proves to be a promising alternative to identify blade cracks at early stages.

  15. Confusion, Diffusion, and Innovation (United States)

    Eyestone, Robert


    Examines several possible models of public policy diffusion, then presents and illustrates the use of a technique for identifying clusters of similar policies on the bases of their diffusion patterns. Available from: American Political Science Association, 1527 New Hampshire Avenue, N.W., Washington, DC 20036; $10.50 single copy. (JG)

  16. Galactic Diffuse Polarized Emission

    Indian Academy of Sciences (India)

    Diffuse polarized emission by synchrotron is a key tool to investigate magnetic fields in the Milky Way, particularly the ordered component of the large scale structure. Key observables are the synchrotron emission itself and the RM is by Faraday rotation. In this paper the main properties of the radio polarized diffuse emission ...

  17. Speckle reducing anisotropic diffusion. (United States)

    Yu, Yongjian; Acton, Scott T


    This paper provides the derivation of speckle reducing anisotropic diffusion (SRAD), a diffusion method tailored to ultrasonic and radar imaging applications. SRAD is the edge-sensitive diffusion for speckled images, in the same way that conventional anisotropic diffusion is the edge-sensitive diffusion for images corrupted with additive noise. We first show that the Lee and Frost filters can be cast as partial differential equations, and then we derive SRAD by allowing edge-sensitive anisotropic diffusion within this context. Just as the Lee and Frost filters utilize the coefficient of variation in adaptive filtering, SRAD exploits the instantaneous coefficient of variation, which is shown to be a function of the local gradient magnitude and Laplacian operators. We validate the new algorithm using both synthetic and real linear scan ultrasonic imagery of the carotid artery. We also demonstrate the algorithm performance with real SAR data. The performance measures obtained by means of computer simulation of carotid artery images are compared with three existing speckle reduction schemes. In the presence of speckle noise, speckle reducing anisotropic diffusion excels over the traditional speckle removal filters and over the conventional anisotropic diffusion method in terms of mean preservation, variance reduction, and edge localization.

  18. Diffusion Based Photon Mapping

    DEFF Research Database (Denmark)

    Schjøth, Lars; Fogh Olsen, Ole; Sporring, Jon


    . To address this problem we introduce a novel photon mapping algorithm based on nonlinear anisotropic diffusion. Our algorithm adapts according to the structure of the photon map such that smoothing occurs along edges and structures and not across. In this way we preserve the important illumination features......, while eliminating noise. We call our method diffusion based photon mapping....

  19. Modelling of Innovation Diffusion

    Directory of Open Access Journals (Sweden)

    Arkadiusz Kijek


    Full Text Available Since the publication of the Bass model in 1969, research on the modelling of the diffusion of innovation resulted in a vast body of scientific literature consisting of articles, books, and studies of real-world applications of this model. The main objective of the diffusion model is to describe a pattern of spread of innovation among potential adopters in terms of a mathematical function of time. This paper assesses the state-of-the-art in mathematical models of innovation diffusion and procedures for estimating their parameters. Moreover, theoretical issues related to the models presented are supplemented with empirical research. The purpose of the research is to explore the extent to which the diffusion of broadband Internet users in 29 OECD countries can be adequately described by three diffusion models, i.e. the Bass model, logistic model and dynamic model. The results of this research are ambiguous and do not indicate which model best describes the diffusion pattern of broadband Internet users but in terms of the results presented, in most cases the dynamic model is inappropriate for describing the diffusion pattern. Issues related to the further development of innovation diffusion models are discussed and some recommendations are given. (original abstract

  20. Diffusion Based Photon Mapping

    DEFF Research Database (Denmark)

    Schjøth, Lars; Olsen, Ole Fogh; Sporring, Jon


    . To address this problem we introduce a novel photon mapping algorithm based on nonlinear anisotropic diffusion. Our algorithm adapts according to the structure of the photon map such that smoothing occurs along edges and structures and not across. In this way we preserve the important illumination features......, while eliminating noise. We call our method diffusion based photon mapping....

  1. Dependence of Exciton Diffusion Length and Diffusion Coefficient on Photophysical Parameters in Bulk Heterojunction Organic Solar Cells (United States)

    Yeboah, Douglas; Singh, Jai


    Recently, the dependence of exciton diffusion length (LD ) on some photophysical parameters of organic solids has been experimentally demonstrated, however no systematic theoretical analysis of this phenomenon has been carried out. We have conducted a theoretical study by using the Förster resonance energy transfer and Dexter carrier transfer mechanisms together with the Einstein-Smoluchowski diffusion equation to derive analytical models for the diffusion lengths (LD ) and diffusion coefficients (D) of singlet (S) and triplet (T) excitons in organic solids as functions of spectral overlap integral (J) , photoluminescence (PL) quantum yield (φD ) , dipole moment (μT ) and refractive index (n) of the photoactive material. The exciton diffusion lengths and diffusion coefficients in some selected organic solids were calculated, and we found that the singlet exciton diffusion length (LDS ) increases with φD and J, and decreases with n. Also, the triplet exciton diffusion length (LDT ) increases with φD and decreases with μT . These may be achieved through doping the organic solids into broad optical energy gap host materials as observed in previous experiments. The calculated exciton diffusion lengths are compared with experimental values and a reasonably good agreement is found between them. The results presented are expected to provide insight relevant to the synthesis of new organic solids for fabrication of bulk heterojunction organic solar cells characterized by better power conversion efficiency.

  2. Sub-THz spectroscopic characterization of vibrational modes in artificially designed DNA monocrystal (United States)

    Sizov, Igor; Rahman, Masudur; Gelmont, Boris; Norton, Michael L.; Globus, Tatiana


    Sub-terahertz (sub-THz) vibrational spectroscopy is a new spectroscopic branch for characterizing biological macromolecules. In this work, highly resolved sub-THz resonance spectroscopy is used for characterizing engineered molecular structures, an artificially designed DNA monocrystal, built from a short DNA sequence. Using a recently developed frequency domain spectroscopic instrument operating at room temperature with high spectral and spatial resolution, we demonstrated very intense and specific spectral lines from a DNA crystal in general agreement with a computational molecular dynamics (MD) simulation of a short double stranded DNA fragment. The spectroscopic signature measured in the frequency range between 310 and 490 GHz is rich in well resolved and reproducible spectral features thus demonstrating the capability of THz resonance spectroscopy to be used for characterizing custom macromolecules and structures designed and implemented via nanotechnology for a wide variety of application domains. Analysis of MD simulation indicates that intense and narrow vibrational modes with atomic movements perpendicular (transverse) and parallel (longitudinal) to the long DNA axis coexist in dsDNA, with much higher contribution from longitudinal vibrations.

  3. Structure, isomerism, and vibrational assignment of aluminumtrifluoroacetylacetonate. An experimental and theoretical study (United States)

    Afzali, R.; Vakili, M.; Boluri, E.; Tayyari, S. F.; Nekoei, A.-R.; Hakimi-Tabar, M.; Darugar, V.


    An interpretation of the experimental IR and Raman spectra of Aluminum (III) trifluoroacetylacetonate (Al(TFAA)3) complex, which were synthesized by us, is first reported here. The charge distribution, isomerism, strength of metal‑oxygen binding and vibrational spectral properties for this complex structure were theoretically investigated through population analysis, geometry optimization and harmonic frequency calculations, performed at B3LYP/6-311G* level of theory. In the population analysis, two different approaches reffered to as ;Atoms in molecules (AIM);, and ;Natural Bond Orbital (NBO); were used. According to the calculation resuls, the energy difference between the cis and trans isomers of Al(TFAA)3 is very small and indicates that both isomers coexist in the sample in comparable proportions. Comparison of the calculated frequency and intensity data with the observed IR and Raman spectra of the complex has supported this conclusion. On the other hand, comparison of the structural and vibrational spectral data of Al(TFAA)3, which were experimentally measured and calculated at B3LYP/6-311G* level, with the corresponding data of Aluminum acetylacetonate (Al(AA)3) has revealed the effects of CF3 substitution on the structural and vibrational spectral data associated with the CH3 groups in the complex structure.

  4. Vibration characteristics of casing string under the exciting force of an electric vibrator

    Directory of Open Access Journals (Sweden)

    Yiyong Yin


    Full Text Available Vibration cementing is a new technique that can significantly improve the bond strength of cementing interface. To popularize this technique, it is necessary to solve the key problem of how to make cementing string generate downhole radial vibration in the WOC stage. For this purpose, an electric vibrator was developed. With this vibrator, electric energy is converted into mechanical energy by means of a high-temperature motor vibration unit. The motor vibration unit rotates the eccentric block through an output shaft to generate an exciting source, which produces an axial-rotating exciting force at the bottom of the casing string. Then, the vibration characteristics of vertical well casing string under the exciting force were analyzed by using the principal coordinate analysis method, and the response model of casing string to an electric vibrator was developed. Finally, the effects of casing string length, exciting force and vibration frequency on the vibration amplitude at the lowermost of the casing string were analyzed based on a certain casing program. It is indicated that the casing string length and the square of vibration frequency are inversely proportional to the vibration amplitude at the lowermost of the casing string, and the exciting force is proportional to the vibration amplitude at the lowermost of the casing string. These research results provide a theoretical support for the application of vibration cementing technology to the cementing sites with different requirements on well depth and amplitude.

  5. Generation of Spectral Clusters in a Mixture of Noble and Raman-Active Gases

    CERN Document Server

    Hosseini, Pooria; Russell, Philip St J


    We report a novel scheme for the generation of dense clusters of Raman sidebands. The scheme uses a broadband-guiding hollow-core photonic crystal fiber (HC-PCF) filled with a mixture of H2, D2, and Xe for efficient interaction between the gas mixture and a green laser pump pulse (532 nm, 1 ns) of only 5 uJ energy. This results in the generation from noise of more than 135 ro-vibrational Raman sidebands covering the visible spectral region with an average spacing of only 2 THz. Such a spectrally dense and compact fiber-based source is ideal for applications where closely spaced narrow-band laser lines with high spectral power density are required, such as in spectroscopy and sensing. When the HC-PCF is filled with a H2-D2 mixture the Raman comb spans the spectral region from the deep UV (280 nm) to the near infrared (1000 nm).

  6. Speech recognition from spectral dynamics

    Indian Academy of Sciences (India)

    Information is carried in changes of a signal. The paper starts with revisiting Dudley's concept of the carrier nature of speech. It points to its close connection to modulation spectra of speech and argues against short-term spectral envelopes as dominant carriers of the linguistic information in speech. The history of spectral ...


    Directory of Open Access Journals (Sweden)



    Full Text Available Using spectral analysis is very common in technical areas but rather unusual in economics and finance, where ARIMA and GARCH modeling are much more in use. To show that spectral analysis can be useful in determining hidden periodic components for high-frequency finance data as well, we use the example of foreign exchange rates

  8. Diffuse ceiling ventilation

    DEFF Research Database (Denmark)

    Zhang, Chen

    Diffuse ceiling ventilation is an innovative ventilation concept where the suspended ceiling serves as air diffuser to supply fresh air into the room. Compared with conventional ventilation systems, diffuse ceiling ventilation can significantly reduce or even eliminate draught risk due to the low...... momentum supply. In addition, this ventilation system uses a ceiling plenum to deliver air and requires less energy consumption for air transport than full-ducted systems. There is a growing interest in applying diffuse ceiling ventilation in offices and other commercial buildings due to the benefits from...... both thermal comfort and energy efficient aspects. The present study aims to characterize the air distribution and thermal comfort in the rooms with diffuse ceiling ventilation. Both the stand-alone ventilation system and its integration with a radiant ceiling system are investigated. This study also...

  9. Atomic diffusion in stars

    CERN Document Server

    Michaud, Georges; Richer, Jacques


    This book gives an overview of atomic diffusion, a fundamental physical process, as applied to all types of stars, from the main sequence to neutron stars. The superficial abundances of stars as well as their evolution can be significantly affected. The authors show where atomic diffusion plays an essential role and how it can be implemented in modelling.  In Part I, the authors describe the tools that are required to include atomic diffusion in models of stellar interiors and atmospheres. An important role is played by the gradient of partial radiative pressure, or radiative acceleration, which is usually neglected in stellar evolution. In Part II, the authors systematically review the contribution of atomic diffusion to each evolutionary step. The dominant effects of atomic diffusion are accompanied by more subtle effects on a large number of structural properties throughout evolution. One of the goals of this book is to provide the means for the astrophysicist or graduate student to evaluate the importanc...

  10. Vibrational damping of composite materials (United States)

    Biggerstaff, Janet M.

    The purpose of this research was to develop new methods of vibrational damping in polymeric composite materials along with expanding the knowledge of currently used vibrational damping methods. A new barrier layer technique that dramatically increased damping in viscoelastic damping materials that interacted with the composite resin was created. A method for testing the shear strength of damping materials cocured in composites was developed. Directional damping materials, where the loss factor and modulus could be tailored by changing the angle, were produced and investigated. The addition of particles between composite prepreg layers to increase damping was studied. Electroviscoelastic materials that drastically changed properties such as loss factor and modulus with an applied voltage were manufactured and tested.

  11. Vibration of imperfect rotating disk

    Directory of Open Access Journals (Sweden)

    Půst L.


    Full Text Available This study is concerned with the theoretical and numerical calculations of the flexural vibrations of a bladed disk. The main focus of this study is to elaborate the basic background for diagnostic and identification methods for ascertaining the main properties of the real structure or an experimental model of turbine disks. The reduction of undesirable vibrations of blades is proposed by using damping heads, which on the experimental model of turbine disk are applied only on a limited number of blades. This partial setting of damping heads introduces imperfection in mass, stiffness and damping distribution on the periphery and leads to more complicated dynamic properties than those of a perfect disk. Calculation of FEM model and analytic—numerical solution of disk behaviour in the limited (two modes frequency range shows the splitting of resonance with an increasing speed of disk rotation. The spectrum of resonance is twice denser than that of a perfect disk.

  12. Dynamical response of vibrating ferromagnets

    CERN Document Server

    Gaganidze, E; Ziese, M


    The resonance frequency of vibrating ferromagnetic reeds in a homogeneous magnetic field can be substantially modified by intrinsic and extrinsic field-related contributions. Searching for the physical reasons of the field-induced resonance frequency change and to study the influence of the spin glass state on it, we have measured the low-temperature magnetoelastic behavior and the dynamical response of vibrating amorphous and polycrystalline ferromagnetic ribbons. We show that the magnetoelastic properties depend strongly on the direction of the applied magnetic field. The influence of the re-entrant spin glass transition on these properties is discussed. We present clear experimental evidence that for applied fields perpendicular to the main area of the samples the behavior of ferromagnetic reeds is rather independent of the material composition and magnetic state, exhibiting a large decrease of the resonance frequency. This effect can be very well explained with a model based on the dynamical response of t...

  13. Vibrational coupling in plasmonic molecules. (United States)

    Yi, Chongyue; Dongare, Pratiksha D; Su, Man-Nung; Wang, Wenxiao; Chakraborty, Debadi; Wen, Fangfang; Chang, Wei-Shun; Sader, John E; Nordlander, Peter; Halas, Naomi J; Link, Stephan


    Plasmon hybridization theory, inspired by molecular orbital theory, has been extremely successful in describing the near-field coupling in clusters of plasmonic nanoparticles, also known as plasmonic molecules. However, the vibrational modes of plasmonic molecules have been virtually unexplored. By designing precisely configured plasmonic molecules of varying complexity and probing them at the individual plasmonic molecule level, intramolecular coupling of acoustic modes, mediated by the underlying substrate, is observed. The strength of this coupling can be manipulated through the configuration of the plasmonic molecules. Surprisingly, classical continuum elastic theory fails to account for the experimental trends, which are well described by a simple coupled oscillator picture that assumes the vibrational coupling is mediated by coherent phonons with low energies. These findings provide a route to the systematic optical control of the gigahertz response of metallic nanostructures, opening the door to new optomechanical device strategies. Published under the PNAS license.

  14. A night with good vibrations

    CERN Multimedia


    Next week-end, the Geneva Science History Museum invites you to a Science Night under the banner of waves and vibrations. Scientists, artists and storytellers from more than forty institutes and local or regional associations will show that waves and vibrations form an integral part of our environment. You will be able to get in contact with the nature of waves through interactive exhibitions on sound and light and through hands-on demonstrations arranged in the Park of the Perle du Lac. On the CERN stand, you will be able to measure the speed of light with a bar of chocolate, and understand the scattering of waves with plastic ducks. Amazing, no? In addition to the stands, the Night will offer many other activities: reconstructions of experiments, a play, a concert of crystal glasses, an illuminated fountain, a house of spirits. More information Science Night, 6 and 7 July, Park of the Perle du Lac, Geneva

  15. A vibrational analysis of the O2 (A 3Sigma/+/u) Herzberg I system using rocket data (United States)

    Siskind, David E.; Sharp, William E.


    An observation of the UV nightglow between 2670 and 3040 A was conducted over White Sands Missile Range on October 22, 1984. A 1/4-m spectrometer operating at 3.5-A resolution viewed the earth's limb at tangent heights between 90 and 110 km for 120 sec. A total of 41 spectral scans of the nightglow were obtained with the brightest feature being the O2 Herzberg I bands. The data were sorted into two groups, one from the top side of the layer and one containing the emission peak, and compared with synthetic spectra. The deduced vibrational distributions indicate that, at low altitudes, the higher vibrational levels (v-prime greater than 6) were relatively depleted; however, the magnitude of the vibrational shift is much less than that predicted from theories of vibrational relaxation. It is shown that increasing the electronic quenching with respect to the vibrational quenching can reduce the vibrational shift in the model and qualitatively explain the observations; however, several details of the vibrational distribution are not well reproduced.

  16. The separation of vibrational coherence from ground- and excited-electronic states in P3HT film

    KAUST Repository

    Song, Yin


    © 2015 AIP Publishing LLC. Concurrence of the vibrational coherence and ultrafast electron transfer has been observed in polymer/fullerene blends. However, it is difficult to experimentally investigate the role that the excited-state vibrational coherence plays during the electron transfer process since vibrational coherence from the ground- and excited-electronic states is usually temporally and spectrally overlapped. Here, we performed 2-dimensional electronic spectroscopy (2D ES) measurements on poly(3-hexylthiophene) (P3HT) films. By Fourier transforming the whole 2D ES datasets (S (λ 1, T∼ 2, λ 3)) along the population time (T∼ 2) axis, we develop and propose a protocol capable of separating vibrational coherence from the ground- and excited-electronic states in 3D rephasing and nonrephasing beating maps (S (λ 1, ν∼ 2, λ 3)). We found that the vibrational coherence from pure excited electronic states appears at positive frequency (+ ν∼ 2) in the rephasing beating map and at negative frequency (- ν∼ 2) in the nonrephasing beating map. Furthermore, we also found that vibrational coherence from excited electronic state had a long dephasing time of 244 fs. The long-lived excited-state vibrational coherence indicates that coherence may be involved in the electron transfer process. Our findings not only shed light on the mechanism of ultrafast electron transfer in organic photovoltaics but also are beneficial for the study of the coherence effect on photoexcited dynamics in other systems.

  17. Vibration Control in Periodic Structures

    DEFF Research Database (Denmark)

    Høgsberg, Jan Becker


    Within the framework of periodic structures, the calibration of RL shunted piezoelectric inclusions is investigated with respect to maximum damping of a particular wave form. A finite element setting is assumed, with local shunted inclusions inside the unit cell. The effect of the shunts is repre....... The presentation contains dispersion diagrams and vibration amplitude curves for the optimally calibrated RL shunt system in a 1-D periodic structure with local piezoelectric inclusions....

  18. Package security recorder of vibration (United States)

    Wang, Xiao-na; Hu, Jin-liang; Song, Shi-de


    This paper introduces a new kind of electronic product — Package Security Recorder of Vibration. It utilizes STC89C54RD+ LQFP-44 MCU as its main controller. At the same time, it also utilizes Freescale MMA845A 3-Axis 8-bit/12-bit Digital Accelerometer and Maxim DS1302 Trickle Charge Timekeeping Chip. It utilizes the MCU to read the value of the accelerometer and the value of the timekeeping chip, and records the data into the inner E2PROM of MCU. The whole device achieves measuring, reading and recording the time of the vibration and the intensity of the vibration. When we need the data, we can read them out. The data can be used in analyzing the condition of the cargo when it transported. The device can be applied to monitor the security of package. It solves the problem of responsibility affirming, when the valuable cargo are damaged while it transported. It offers powerful safeguard for the package. It's very value for application.

  19. Chemical reactions of water molecules on Ru(0001) induced by selective excitation of vibrational modes

    Energy Technology Data Exchange (ETDEWEB)

    Mugarza, Aitor; Shimizu, Tomoko K.; Ogletree, D. Frank; Salmeron, Miquel


    Tunneling electrons in a scanning tunneling microscope were used to excite specific vibrational quantum states of adsorbed water and hydroxyl molecules on a Ru(0 0 0 1) surface. The excited molecules relaxed by transfer of energy to lower energy modes, resulting in diffusion, dissociation, desorption, and surface-tip transfer processes. Diffusion of H{sub 2}O molecules could be induced by excitation of the O-H stretch vibration mode at 445 meV. Isolated molecules required excitation of one single quantum while molecules bonded to a C atom required at least two quanta. Dissociation of single H{sub 2}O molecules into H and OH required electron energies of 1 eV or higher while dissociation of OH required at least 2 eV electrons. In contrast, water molecules forming part of a cluster could be dissociated with electron energies of 0.5 eV.

  20. Feedback control design and SHM based on spectral element method (Conference Presentation) (United States)

    Conceição, Sanderson M.; Bueno, Douglas D.; Lopes, Vicente


    Frequency domain modeling has been developed to different engineering applications. In particular, the Spectral Element method (SEM) has been discussed in literature mainly for vibration control design and structural health monitoring once it allows to study unlimited range of frequencies. However, although different authors discuss classical control techniques like PID for SEM formulations there is a limited number of works involving modern control theory based on state space representation. In this context, this work introduces a new approach that allows to use feedback techniques in vibration control design based on SEM. The formulation is presented and numerical simulations are performed using the Timoshenko beam model with two PZT patch bonded. The PZT transducer effects are included too. Results show vibrations reductions of the first three modes of a campled-clamped beam and the proposed approach offers promise to control design using SEM.

  1. Concorde noise-induced building vibrations for Sully Plantation, Chantilly, Virginia (United States)

    Mayes, W. H.; Scholl, H. F.; Stephens, D. G.; Holliday, B. G.; Deloach, R.; Holmes, H. K.; Lewis, R. B.; Lynch, J. W.


    A study to assess the noise-induced building vibrations associated with Concorde operations is presented. The approach is to record the levels of induced vibrations and associated indoor/outdoor noise levels in selected homes, historic and other buildings near Dulles and Kennedy International Airports. Presented is a small, representative sample of data recorded at Sully Plantation, Chantilly, Virginia during the period of May 20 through May 28, 1976. Recorded data provide relationships between the vibration levels of walls, floors, windows, and the noise associated with Concorde operations (2 landings and 3 takeoffs), other aircraft, nonaircraft sources, and normal household activities. Results suggest that building vibrations resulting from aircraft operations were proportional to the overall sound pressure levels and relatively insensitive to spectral differences associated with the different types of aircraft. Furthermore, the maximum levels of vibratory response resulting from Concorde operations were higher than those associated with conventional aircraft. The vibrations of nonaircraft events were observed in some cases to exceed the levels resulting from aircraft operations. These nonaircraft events are currently being analyzed in greater detail.

  2. Numerical Modal Analysis of Vibrations in a Three-Phase Linear Switched Reluctance Actuator

    Directory of Open Access Journals (Sweden)

    José Salvado


    Full Text Available This paper addresses the problem of vibrations produced by switched reluctance actuators, focusing on the linear configuration of this type of machines, aiming at its characterization regarding the structural vibrations. The complexity of the mechanical system and the number of parts used put serious restrictions on the effectiveness of analytical approaches. We build the 3D model of the actuator and use finite element method (FEM to find its natural frequencies. The focus is on frequencies within the range up to nearly 1.2 kHz which is considered relevant, based on preliminary simulations and experiments. Spectral analysis results of audio signals from experimental modal excitation are also shown and discussed. The obtained data support the characterization of the linear actuator regarding the excited modes, its vibration frequencies, and mode shapes, with high potential of excitation due to the regular operation regimes of the machine. The results reveal abundant modes and harmonics and the symmetry characteristics of the actuator, showing that the vibration modes can be excited for different configurations of the actuator. The identification of the most critical modes is of great significance for the actuator’s control strategies. This analysis also provides significant information to adopt solutions to reduce the vibrations at the design.

  3. Axial Fan Blade Vibration Assessment under Inlet Cross-Flow Conditions Using Laser Scanning Vibrometry

    Directory of Open Access Journals (Sweden)

    Till Heinemann


    Full Text Available In thermal power plants equipped with air-cooled condensers (ACCs, axial cooling fans operate under the influence of ambient flow fields. Under inlet cross-flow conditions, the resultant asymmetric flow field is known to introduce additional harmonic forces to the fan blades. This effect has previously only been studied numerically or by using blade-mounted strain gauges. For this study, laser scanning vibrometry (LSV was used to assess fan blade vibration under inlet cross-flow conditions in an adapted fan test rig inside a wind tunnel test section. Two co-rotating laser beams scanned a low-pressure axial fan, resulting in spectral, phase-resolved surface vibration patterns of the fan blades. Two distinct operating points with flow coefficients of 0.17 and 0.28 were examined, with and without inlet cross-flow influence. While almost identical fan vibration patterns were found for both reference operating points, the overall blade vibration increased by 100% at the low fan flow rate as a result of cross-flow, and by 20% at the high fan flow rate. While numerically predicted natural frequency modes could be confirmed from experimental data as minor peaks in the vibration amplitude spectrum, they were not excited significantly by cross-flow. Instead, primarily higher rotation-rate harmonics were amplified; that is, a synchronous blade-tip flapping was strongly excited at the blade-pass frequency.

  4. CCN Spectral Measurements

    Energy Technology Data Exchange (ETDEWEB)

    Hudson, James G.


    Detailed aircraft measurements were made of cloud condensation nuclei (CCN) spectra associated with extensive cloud systems off the central California coast in the July 2005 MASE project. These measurements include the wide supersaturation (S) range (2-0.01%) that is important for these polluted stratus clouds. Concentrations were usually characteristic of continental/anthropogenic air masses. The most notable feature was the consistently higher concentrations above the clouds than below. CCN measurements are so important because they provide a link between atmospheric chemistry and cloud-climate effects, which are the largest climate uncertainty. Extensive comparisons throughout the eleven flights between two CCN spectrometers operated at different but overlapping S ranges displayed the precision and accuracy of these difficult spectral determinations. There are enough channels of resolution in these instruments to provide differential spectra, which produce more rigorous and precise comparisons than traditional cumulative presentations of CCN concentrations. Differential spectra are also more revealing than cumulative spectra. Only one of the eleven flights exhibited typical maritime concentrations. Average below cloud concentrations over the two hours furthest from the coast for the 8 flights with low polluted stratus was 614?233 at 1% S, 149?60 at 0.1% S and 57?33 at 0.04% S cm-3. Immediately above cloud average concentrations were respectively 74%, 55%, and 18% higher. Concentration variability among those 8 flights was a factor of two. Variability within each flight excluding distances close to the coast ranged from 15-56% at 1% S. However, CN and probably CCN concentrations sometimes varied by less than 1% over distances of more than a km. Volatility and size-critical S measurements indicated that the air masses were very polluted throughout MASE. The aerosol above the clouds was more polluted than the below cloud aerosol. These high CCN concentrations from

  5. Quantitative Analysis of Spectral Interference of Spontaneous Raman Scattering in High-Pressure Fuel-Rich H2-Air Combustion (United States)

    Kojima, Jun; Nguyen, Quang-Viet


    We present a theoretical study of the spectral interferences in the spontaneous Raman scattering spectra of major combustion products in 30-atm fuel-rich hydrogen-air flames. An effective methodology is introduced to choose an appropriate line-shape model for simulating Raman spectra in high-pressure combustion environments. The Voigt profile with the additive approximation assumption was found to provide a reasonable model of the spectral line shape for the present analysis. The rotational/vibrational Raman spectra of H2, N2, and H2O were calculated using an anharmonic-oscillator model using the latest collisional broadening coefficients. The calculated spectra were validated with data obtained in a 10-atm fuel-rich H2-air flame and showed excellent agreement. Our quantitative spectral analysis for equivalence ratios ranging from 1.5 to 5.0 revealed substantial amounts of spectral cross-talk between the rotational H2 lines and the N2 O-/Q-branch; and between the vibrational H2O(0,3) line and the vibrational H2O spectrum. We also address the temperature dependence of the spectral cross-talk and extend our analysis to include a cross-talk compensation technique that removes the nterference arising from the H2 Raman spectra onto the N2, or H2O spectra.

  6. Diffuse X-ray scattering and far infrared absorption of barium and lead β" aluminas

    DEFF Research Database (Denmark)

    Hayes, W.; Kjær, Kristian; Pratt, F. L.


    The authors have carried out high-momentum-resolution studies in diffuse X-ray scattering of barium and lead B" aluminas in the temperature range 20-700 degrees C. They have also measured the vibrational spectra of these compounds between 2K and 300K in the energy range 10-100 cm-1. The results...

  7. Diffuse infiltrating lipomatosis

    Energy Technology Data Exchange (ETDEWEB)

    Grabbe, E.; Boecker, W.; Buecheler, E.


    Nineteen patients with various types of lipoma in the pelvis are described. Clinical findings, radiological examinations, and follow-up studies constitute a particular type of lipoma, diffuse infiltrating lipomatosis; this can be distinguished from other fatty tumours because of its localisation, extent, therapeutic results and long course. Computed tomography enables us to differentiate simple lipomatosis pelvis from diffuse infiltrating lipomatosis. Histological examination is essential for excluding a liposarcoma. Growth or malignant change of diffuse infiltrating lipomatosis is most easily recognized by computed tomographic serial observation.

  8. Diffuse Ceiling Ventilation

    DEFF Research Database (Denmark)

    Zhang, Chen; Yu, Tao; Heiselberg, Per Kvols

    -cooling period and night cooling potential. The investment cost of this ventilation system is about 5-10% lower than the conventional ones, because the acoustic ceiling could be directly applied as air diffuser and the use of plenum to distribute air reduces the cost of ductwork. There is a growing interest...... in applying diffuse ceiling ventilation in offices and other commercial buildings because of the benefits from both thermal comfort and energy efficiency aspects. The design guide introduces the principle and key characteristics of room air distribution with diffuse ceiling ventilation and the design...

  9. Infrared diffuse interstellar bands (United States)

    Galazutdinov, G. A.; Lee, Jae-Joon; Han, Inwoo; Lee, Byeong-Cheol; Valyavin, G.; Krełowski, J.


    We present high-resolution (R ˜ 45 000) profiles of 14 diffuse interstellar bands in the ˜1.45 to ˜2.45 μm range based on spectra obtained with the Immersion Grating INfrared Spectrograph at the McDonald Observatory. The revised list of diffuse bands with accurately estimated rest wavelengths includes six new features. The diffuse band at 15 268.2 Å demonstrates a very symmetric profile shape and thus can serve as a reference for finding the 'interstellar correction' to the rest wavelength frame in the H range, which suffers from a lack of known atomic/molecular lines.

  10. Defect Detection for Wheel-Bearings with Time-Spectral Kurtosis and Entropy


    Bin Chen; Zhaoli Yan; Wei Chen


    Wheel-bearings easily acquire defects due to their high-speed operating conditions and constant metal-metal contact, so defect detection is of great importance for railroad safety. The conventional spectral kurtosis (SK) technique provides an optimal bandwidth for envelope demodulation. However, this technique may cause false detections when processing real vibration signals for wheel-bearings, because of sparse interference impulses. In this paper, a novel defect detection method with entrop...

  11. Inverse spectral problem for a non-uniform rod with multiple cracks (United States)

    Shifrin, E. I.


    An inverse spectral problem for a rod of variable cross-section containing a finite number of transverse cracks is considered. The cracks are simulated by translational springs. It is proved that the number of springs, their locations and flexibilities are uniquely reconstructed by two spectra corresponding to longitudinally vibrating rod with free-free and free-fixed end conditions. A constructive procedure for reconstructing unknown damage parameters is developed. Numerical examples are considered.

  12. Theories on diffusion of technology

    DEFF Research Database (Denmark)

    Munch, Birgitte

    Tracing the body of the diffusion proces by analysing the diffusion process from historical, sociological, economic and technical approaches. Discussing central characteristics of the proces of diffusion og CAD/CAM in Denmark....

  13. Actively controlled vibration welding system and method (United States)

    Cai, Wayne W.; Kang, Bongsu; Tan, Chin-An


    A vibration welding system includes a controller, welding horn, an active material element, and anvil assembly. The assembly may include an anvil body connected to a back plate and support member. The element, e.g., a piezoelectric stack or shape memory alloy, is positioned with respect to the assembly. The horn vibrates in a desirable first direction to form a weld on a work piece. The element controls any vibrations in a second direction by applying calibrated response to the anvil body in the second direction. A method for controlling undesirable vibrations in the system includes positioning the element with respect to the anvil assembly, connecting the anvil body to the support member through the back plate, vibrating the horn in a desirable first direction, and transmitting an input signal to the element to control vibration in an undesirable second direction.

  14. Coupled rotor/airframe vibration analysis (United States)

    Sopher, R.; Studwell, R. E.; Cassarino, S.; Kottapalli, S. B. R.


    A coupled rotor/airframe vibration analysis developed as a design tool for predicting helicopter vibrations and a research tool to quantify the effects of structural properties, aerodynamic interactions, and vibration reduction devices on vehicle vibration levels is described. The analysis consists of a base program utilizing an impedance matching technique to represent the coupled rotor/airframe dynamics of the system supported by inputs from several external programs supplying sophisticated rotor and airframe aerodynamic and structural dynamic representation. The theoretical background, computer program capabilities and limited correlation results are presented in this report. Correlation results using scale model wind tunnel results show that the analysis can adequately predict trends of vibration variations with airspeed and higher harmonic control effects. Predictions of absolute values of vibration levels were found to be very sensitive to modal characteristics and results were not representative of measured values.

  15. Multidimensional Spectral Fingerprints of a New Family of Coherent Analytical Spectroscopies. (United States)

    Neff-Mallon, Nathan A; Wright, John C


    Triply resonant sum frequency (TRSF) and doubly vibrationally enhanced (DOVE) spectroscopies are examples of a recently developed family of coherent multidimensional spectroscopies (CMDS) that are analogous to multidimensional NMR and current analytical spectroscopies. CMDS methods are particularly promising for analytical applications because their inherent selectivity makes them applicable to complex samples. Like NMR, they are based on creating quantum mechanical superposition states that are fully coherent and lack intermediate quantum state populations that cause quenching or other relaxation effects. Instead of the nuclear spin states of NMR, their multidimensional spectral fingerprints result from creating quantum mechanical mixtures of vibrational and electronic states. Vibrational states provide spectral selectivity, and electronic states provide large signal enhancements. This paper presents the first electronically resonant DOVE spectra and demonstrates the capabilities for analytical chemistry applications by comparing electronically resonant TRSF and DOVE spectra with each other and with infrared absorption and resonance Raman spectra using a Styryl 9 M dye as a model system. The methods each use two infrared absorption transitions and a resonant Raman transition to create a coherent output beam, but they differ in how they access the vibrational and electronic states and the frequency of their output signal. Just as FTIR, UV-vis, Raman, and resonance Raman are complementary methods, TRSF and DOVE methods are complementary to coherent Raman methods such as coherent anti-Stokes Raman spectroscopy (CARS).

  16. Automation of vibroacoustic data bank for random vibration criteria development. [for the space shuttle and launch vehicles (United States)

    Ferebee, R. C.


    A computerized data bank system was developed for utilization of large amounts of vibration and acoustic data to formulate component random vibration design and test criteria. This system consists of a computer, graphics tablet, and a dry-silver hard copier which are all desk-top type hardware and occupy minimal space. The data bank contains data from the Saturn V and Titan III flight and static test programs. The vibration and acoustic data are stored in the form of power spectral density and one-third octave band plots over the frequency range from 20 to 2000 Hz. The data was stored by digitizing each spectral plot by tracing with the graphics tablet. The digitized data was statistically analyzed and the resulting 97.5% probability levels were stored on tape along with the appropriate structural parameters. Standard extrapolation procedures were programmed for prediction of component random vibration test criteria for new launch vehicle and payload configurations. This automated vibroacoustic data bank system greatly enhances the speed and accuracy of formulating vibration test criteria. In the future, the data bank will be expanded to include all data acquired from the space shuttle flight test program.

  17. Assessment of myofascial trigger points (MTrPs): a new application of ultrasound imaging and vibration sonoelastography. (United States)

    Sikdar, Siddhartha; Shah, Jay P; Gilliams, Elizabeth; Gebreab, Tadesse; Gerber, Lynn H


    Myofascial trigger points (MTrPs) are palpable hyperirritable nodules in skeletal muscle that are associated with chronic musculoskeletal pain. The goal of this study was to image MTrPs in the upper trapezius muscle using 2D gray scale ultrasound (US) and vibration sonoelastography (VSE) for differentiating the soft tissue characteristics of MTrPs compared to surrounding muscle. MTrPs appeared as hypoechoeic elliptically-shaped focal regions within the trapezius muscle on 2D US. Audio-frequency vibrations (100-250 Hz) were induced in the trapezius muscle of four volunteers with clinically identifiable MTrPs, and the induced vibration amplitudes were imaged using the color Doppler variance mode, and were further quantified using spectral Doppler analysis. Spectral Doppler analysis showed that vibration amplitudes were 27% lower on average within the MTrP compared to surrounding tissue (p0.05). Color variance imaging consistently detected a focal region of reduced vibration amplitude, which correlated with the hypoechoeic region identified as an MTrP (r =0.76 for area). Real-time 2D US identifies MTrPs, and VSE is feasible for differentiating MTrPs from surrounding tissue. Preliminary findings show that MTrPs are hypoechoeic on 2D US and the relative stiffness of MTrPs can be quantified using VSE. Ultrasound offers a convenient, accessible and low-risk approach for identifying MTrPs and for evaluating clinical observations of palpable, painful nodules.

  18. On Diffusion and Permeation

    KAUST Repository

    Peppin, Stephen S. L.


    Diffusion and permeation are discussed within the context of irreversible thermodynamics. A new expression for the generalized Stokes-Einstein equation is obtained which links the permeability to the diffusivity of a two-component solution and contains the poroelastic Biot-Willis coefficient. The theory is illustrated by predicting the concentration and pressure profiles during the filtration of a protein solution. At low concentrations the proteins diffuse independently while at higher concentrations they form a nearly rigid porous glass through which the fluid permeates. The theoretically determined pressure drop is nonlinear in the diffusion regime and linear in the permeation regime, in quantitative agreement with experimental measurements. © 2009 Walter de Gruyter, Berlin, New York.

  19. Isomorphism, Diffusion and Decoupling

    DEFF Research Database (Denmark)

    Boxenbaum, Eva; Jonsson, Stefan


    This chapter traces the evolution of the core theoretical constructs of isomorphism, decoupling and diffusion in organizational institutionalism. We first review the original theoretical formulations of these constructs and then examine their evolution in empirical research conducted over the past...

  20. Diffusing Best Practices

    DEFF Research Database (Denmark)

    Pries-Heje, Jan; Baskerville, Richard


    Both the practice and the research literature on information systems attach great value to the identification and dissemination of information on “best practices”. In the philosophy of science, this type of knowledge is regarded as technological knowledge because it becomes manifest...... in the successful techniques in one context. While the value for other contexts is unproven, knowledge of best practices circulates under an assumption that the practices will usefully self-diffuse through innovation and adoption in other contexts. We study diffusion of best practices using a design science...... approach. The study context is a design case in which an organization desires to diffuse its best practices across different groups. The design goal is embodied in organizational mechanisms to achieve this diffusion. The study used Theory of Planned Behavior (TPB) as a kernel theory. The artifacts...

  1. High force vibration testing with wide frequency range (United States)

    Romero, Edward F.; Jepsen, Richard A.; Gregory, Danny Lynn


    A shaker assembly for vibration testing includes first and second shakers, where the first shaker includes a piezo-electric material for generating vibration. A support structure permits a test object to be supported for vibration of the test object by both shakers. An input permits an external vibration controller to control vibration of the shakers.

  2. Experimental Research on Vibration Fatigue of CFRP and Its Influence Factors Based on Vibration Testing


    Fan, Zhengwei; Jiang, Yu; Zhang, Shufeng; Chen, Xun


    A new research method based on vibration testing for the vibration fatigue of FRP was proposed in this paper. Through the testing on a closed-loop controlled vibration fatigue test system, the vibration fatigue phenomenon of typical carbon-fiber-reinforced plastic (CFRP) cantilevered laminate specimens was carefully studied. Moreover, a method based on the frequency response function was proposed to monitor the fatigue damage accumulation of specimens. On the basis of that, the influence fact...

  3. Vibrational dynamics of crystalline L-alanine

    Energy Technology Data Exchange (ETDEWEB)

    Bordallo, H.N.; Eckert, J. [Los Alamos National Lab., NM (United States); Barthes, M. [Univ. Montpellier II (France)


    The authors report a new, complete vibrational analysis of L-alanine and L-alanine-d{sub 4} which utilizes IINS intensities in addition to frequency information. The use of both isotopomers resulted in a self-consistent force field for and assignment of the molecular vibrations in L-alanine. Some details of the calculation as well as a comparison of calculated and observed IINS spectra are presented. The study clarifies a number of important issues on the vibrational dynamics of this molecule and presents a self-consistent force field for the molecular vibrations in crystalline L-alanine.

  4. Analysis of potential helicopter vibration reduction concepts (United States)

    Landgrebe, A. J.; Davis, M. W.


    Results of analytical investigations to develop, understand, and evaluate potential helicopter vibration reduction concepts are presented in the following areas: identification of the fundamental sources of vibratory loads, blade design for low vibration, application of design optimization techniques, active higher harmonic control, blade appended aeromechanical devices, and the prediction of vibratory airloads. Primary sources of vibration are identified for a selected four-bladed articulated rotor operating in high speed level flight. The application of analytical design procedures and optimization techniques are shown to have the potential for establishing reduced vibration blade designs through variations in blade mass and stiffness distributions, and chordwise center-of-gravity location.

  5. Drift-Diffusion Equation

    Directory of Open Access Journals (Sweden)

    K. Banoo


    equation in the discrete momentum space. This is shown to be similar to the conventional drift-diffusion equation except that it is a more rigorous solution to the Boltzmann equation because the current and carrier densities are resolved into M×1 vectors, where M is the number of modes in the discrete momentum space. The mobility and diffusion coefficient become M×M matrices which connect the M momentum space modes. This approach is demonstrated by simulating electron transport in bulk silicon.

  6. Power Delivered to Mechanical Systems by Random Vibrations

    Directory of Open Access Journals (Sweden)

    Timothy S. Edwards


    Full Text Available This paper develops deformational response power descriptions of multiple degree-of-freedom systems due to stationary random vibration excitation. Two new concepts are developed. The deformational response power density (DRPD can be computed when a structure's natural frequencies and modal masses are available. The DRPD shows the spectral content of the deformational power delivered to a specific structure by the stationary, random excitation. This function can be found through a weighted windowing of the power spectrum of the input acceleration excitation. Deformational response input power spectra (DRIPS, similar to the input energy spectrum and shock response spectrum, give the power delivered to single-degree-of-freedom systems as a function of natural frequency. It is shown that the DRIPS is simply a smoothed version of the power spectrum of the input acceleration excitation. The DRIPS gives rise to a useful power-based data smoothing operation.

  7. Advanced manufacturing: Technology diffusion

    Energy Technology Data Exchange (ETDEWEB)

    Tesar, A.


    In this paper we examine how manufacturing technology diffuses rom the developers of technology across national borders to those who do not have the capability or resources to develop advanced technology on their own. None of the wide variety of technology diffusion mechanisms discussed in this paper are new, yet the opportunities to apply these mechanisms are growing. A dramatic increase in technology diffusion occurred over the last decade. The two major trends which probably drive this increase are a worldwide inclination towards ``freer`` markets and diminishing isolation. Technology is most rapidly diffusing from the US In fact, the US is supplying technology for the rest of the world. The value of the technology supplied by the US more than doubled from 1985 to 1992 (see the Introduction for details). History shows us that technology diffusion is inevitable. It is the rates at which technologies diffuse to other countries which can vary considerably. Manufacturers in these countries are increasingly able to absorb technology. Their manufacturing efficiency is expected to progress as technology becomes increasingly available and utilized.

  8. Exciton-vibrational coupling in the dynamics and spectroscopy of Frenkel excitons in molecular aggregates (United States)

    Schröter, M.; Ivanov, S. D.; Schulze, J.; Polyutov, S. P.; Yan, Y.; Pullerits, T.; Kühn, O.


    The influence of exciton-vibrational coupling on the optical and transport properties of molecular aggregates is an old problem that gained renewed interest in recent years. On the experimental side, various nonlinear spectroscopic techniques gave insight into the dynamics of systems as complex as photosynthetic antennae. Striking evidence was gathered that in these protein-pigment complexes quantum coherence is operative even at room temperature conditions. Investigations were triggered to understand the role of vibrational degrees of freedom, beyond that of a heat bath characterized by thermal fluctuations. This development was paralleled by theory, where efficient methods emerged, which could provide the proper frame to perform non-Markovian and non-perturbative simulations of exciton-vibrational dynamics and spectroscopy. This review summarizes the state of affairs of the theory of exciton-vibrational interaction in molecular aggregates and photosynthetic antenna complexes. The focus is put on the discussion of basic effects of exciton-vibrational interaction from the stationary and dynamics points of view. Here, the molecular dimer plays a prominent role as it permits a systematic investigation of absorption and emission spectra by numerical diagonalization of the exciton-vibrational Hamiltonian in a truncated Hilbert space. An extension to larger aggregates, having many coupled nuclear degrees of freedom, becomes possible with the Multi-Layer Multi-Configuration Time-Dependent Hartree (ML-MCTDH) method for wave packet propagation. In fact it will be shown that this method allows one to approach the limit of almost continuous spectral densities, which is usually the realm of density matrix theory. Real system-bath situations are introduced for two models, which differ in the way strongly coupled nuclear coordinates are treated, as a part of the relevant system or the bath. A rather detailed exposition of the Hierarchy Equations Of Motion (HEOM) method will be

  9. Nonlinear spectral imaging of fungi

    NARCIS (Netherlands)

    Knaus, H.


    Nonlinear microscopy combined with fluorescence spectroscopy is known as nonlinear spectral imaging microscopy (NLSM). This method provides simultaneously specimen morphology – distinguishing different parts in a tissue – and (auto)fluorescence spectra, thus their biochemical composition. A novel

  10. Matched Spectral Filter Imager Project (United States)

    National Aeronautics and Space Administration — OPTRA proposes the development of an imaging spectrometer for greenhouse gas and volcanic gas imaging based on matched spectral filtering and compressive imaging....

  11. Multi-spectral camera development

    CSIR Research Space (South Africa)

    Holloway, M


    Full Text Available ) ? 6 Spectral bands plus laser range finder ? High Definition (HD) video format ? Synchronised image capture ? Configurable mounts ? positioner and laboratory ? Radiometric and geometric calibration ? Fiber optic data transmission Proposed system...

  12. Broadband Advanced Spectral System Project (United States)

    National Aeronautics and Space Administration — NovaSol proposes to develop an advanced hyperspectral imaging system for earth science missions named BRASS (Broadband Advanced Spectral System). BRASS combines...

  13. Brownian yet Non-Gaussian Diffusion: From Superstatistics to Subordination of Diffusing Diffusivities

    Directory of Open Access Journals (Sweden)

    Aleksei V. Chechkin


    Full Text Available A growing number of biological, soft, and active matter systems are observed to exhibit normal diffusive dynamics with a linear growth of the mean-squared displacement, yet with a non-Gaussian distribution of increments. Based on the Chubinsky-Slater idea of a diffusing diffusivity, we here establish and analyze a minimal model framework of diffusion processes with fluctuating diffusivity. In particular, we demonstrate the equivalence of the diffusing diffusivity process with a superstatistical approach with a distribution of diffusivities, at times shorter than the diffusivity correlation time. At longer times, a crossover to a Gaussian distribution with an effective diffusivity emerges. Specifically, we establish a subordination picture of Brownian but non-Gaussian diffusion processes, which can be used for a wide class of diffusivity fluctuation statistics. Our results are shown to be in excellent agreement with simulations and numerical evaluations.

  14. Detection of plum pox virus infection in selection plum trees using spectral imaging (United States)

    Angelova, Liliya; Stoev, Antoniy; Borisova, Ekaterina; Avramov, Latchezar


    Plum pox virus (PPV) is among the most studied viral diseases in the world in plants. It is considered to be one of the most devastating diseases of stone fruits in terms of agronomic impact and economic importance. Noninvasive, fast and reliable techniques are required for evaluation of the pathology in selection trees with economic impact. Such advanced tools for PPV detection could be optical techniques as light-induced fluorescence and diffuse reflectance spectroscopies. Specific regions in the electromagnetic spectra have been found to provide information about the physiological stress in plants, and consequently, diseased plants usually exhibit different spectral signature than non-stressed healthy plants in those specific ranges. In this study spectral reflectance and chlorophyll fluorescence were used for the identification of biotic stress caused by the pox virus on plum trees. The spectral responses of healthy and infected leaves from cultivars, which are widespread in Bulgaria were investigated. The two applied techniques revealed statistically significant differences between the spectral data of healthy plum leaves and those infected by PPV in the visible and near-infrared spectral ranges. Their application for biotic stress detection helps in monitoring diseases in plants using the different plant spectral properties in these spectral ranges. The strong relationship between the results indicates the applicability of diffuse reflectance and fluorescence techniques for conducting health condition assessments of vegetation and their importance for plant protection practices.

  15. Spectral width of SuperDARN echoes: measurement, use and physical interpretation

    Directory of Open Access Journals (Sweden)

    P. V. Ponomarenko


    Full Text Available The Doppler velocity and spectral width are two important parameters derived from coherent scatter radar systems. The Super Dual Auroral Radar Network (SuperDARN is capable of monitoring most of the high latitude region where different boundaries of the magnetosphere map to the ionosphere. In the past, the spectral width, calculated from SuperDARN data, has been used to identify the ionosphere footprints of various magnetosphere boundaries. In this paper we examine the way the spectral width is presently estimated from the radar data and describe several recommendations for improving the algorithm. Using the improved algorithm, we show that typical spectral width values reported in the literature are most probably overestimated. The physical interpretation of the cause of various magnitudes of the spectral width is explored in terms of the diffusion and dynamics of ionospheric plasma irregularities.

  16. Nonlinear vibration absorption for a flexible arm via a virtual vibration absorber (United States)

    Bian, Yushu; Gao, Zhihui


    A semi-active vibration absorption method is put forward to attenuate nonlinear vibration of a flexible arm based on the internal resonance. To maintain the 2:1 internal resonance condition and the desirable damping characteristic, a virtual vibration absorber is suggested. It is mathematically equivalent to a vibration absorber but its frequency and damping coefficients can be readily adjusted by simple control algorithms, thereby replacing those hard-to-implement mechanical designs. Through theoretical analyses and numerical simulations, it is proven that the internal resonance can be successfully established for the flexible arm, and the vibrational energy of flexible arm can be transferred to and dissipated by the virtual vibration absorber. Finally, experimental results are presented to validate the theoretical predictions. Since the proposed method absorbs rather than suppresses vibrational energy of the primary system, it is more convenient to reduce strong vibration than conventional active vibration suppression methods based on smart material actuators with limited energy output. Furthermore, since it aims to establish an internal vibrational energy transfer channel from the primary system to the vibration absorber rather than directly respond to external excitations, it is especially applicable for attenuating nonlinear vibration excited by unpredictable excitations.

  17. Vibrational spectroscopy of Cm–C/Cb–Cb stretching vibrations of ...

    Indian Academy of Sciences (India)

    operator which conveniently describes stretching vibrations of biomolecules. For a copper tetramesityl porphyrin molecule, the higher excited vibrational levels are calculated by applying the U(2) algebraic approach. Keywords. Lie algebraic techniques; vibrational spectra; copper tetramesityl porphyrin. PACS Nos 31.65.

  18. Root Asymptotics of Spectral Polynomials

    Directory of Open Access Journals (Sweden)

    B. Shapiro


    Full Text Available We have been studying the asymptotic energy distribution of the algebraic part of the spectrum of the one-dimensional sextic anharmonic oscillator. We review some (both old and recent results on the multiparameter spectral problem and show that our problem ranks among the degenerate cases of Heine-Stieltjes spectral problem, and we derive the density of the corresponding probability measure. 

  19. Vibrational Spectroscopy of Chromatographic Interfaces

    Energy Technology Data Exchange (ETDEWEB)

    Jeanne E. Pemberton


    Chromatographic separations play a central role in DOE-supported fundamental research related to energy, biological systems, the environment, and nuclear science. The overall portfolio of research activities in the Separations and Analysis Program within the DOE Office of Basic Energy Sciences includes support for activities designed to develop a molecular-level understanding of the chemical processes that underlie separations for both large-scale and analytical-scale purposes. The research effort funded by this grant award was a continuation of DOE-supported research to develop vibrational spectroscopic methods to characterize the interfacial details of separations processes at a molecular level.

  20. Introduction to vibrations and waves

    CERN Document Server

    Pain, H John


    Based on the successful multi-edition book "The Physics ofVibrations and Waves" by John Pain, the authors carry overthe simplicity and logic of the approach taken in the originalfirst edition with its focus on the patterns underlying andconnecting so many aspects of physical behavior, whilst bringingthe subject up-to-date so it is relevant to teaching in the21st century.The transmission of energy by wave propagation is a key conceptthat has applications in almost every branch of physics withtransmitting mediums essentially acting as a continuum of coupledoscillators. The characterization of t

  1. Vibration diagnostics instrumentation for ILC

    Energy Technology Data Exchange (ETDEWEB)

    Bertolini, A.


    The future e{sup -}e{sup +} 500 GeV International Linear Collider will rely on unprecedented nanometer scale particle beam size at the interaction point, in order to achieve the design luminosity. Tight tolerances on static and dynamic alignment of the accelerator cavities and optical components are demanded to transport and focus the high energy electron and positron beams with reasonable position jitter and low emittance. A brief review of techniques and devices evaluated and developed so far for the vibration diagnostics of the machine is presented in this paper. (orig.)

  2. Monothiodibenzoylmethane: Structural and vibrational assignments

    DEFF Research Database (Denmark)

    Hansen, Bjarke Knud Vilster; Gorski, Alexander; Posokhov, Yevgen


    The vibrational structure of the title compound (1,3-diphenyl-3-thioxopropane-1-one, TDBM) was studied by a variety of experimental and theoretical methods. The stable ground state configuration of TDBM was investigated by IR absorption measurements in different media, by LD polarization spectros...... to an “open”, non-chelated enethiol form (t-TCC), thereby supporting the previous conclusions by Posokhov et al. No obvious indications of the contribution of other forms to the observed spectra could be found....

  3. A Multiscale Vibrational Spectroscopic Approach for Identification and Biochemical Characterization of Pollen. (United States)

    Bağcıoğlu, Murat; Zimmermann, Boris; Kohler, Achim


    Analysis of pollen grains reveals valuable information on biology, ecology, forensics, climate change, insect migration, food sources and aeroallergens. Vibrational (infrared and Raman) spectroscopies offer chemical characterization of pollen via identifiable spectral features without any sample pretreatment. We have compared the level of chemical information that can be obtained by different multiscale vibrational spectroscopic techniques. Pollen from 15 different species of Pinales (conifers) were measured by seven infrared and Raman methodologies. In order to obtain infrared spectra, both reflectance and transmission measurements were performed on ground and intact pollen grains (bulk measurements), in addition, infrared spectra were obtained by microspectroscopy of multigrain and single pollen grain measurements. For Raman microspectroscopy measurements, spectra were obtained from the same pollen grains by focusing two different substructures of pollen grain. The spectral data from the seven methodologies were integrated into one data model by the Consensus Principal Component Analysis, in order to obtain the relations between the molecular signatures traced by different techniques. The vibrational spectroscopy enabled biochemical characterization of pollen and detection of phylogenetic variation. The spectral differences were clearly connected to specific chemical constituents, such as lipids, carbohydrates, carotenoids and sporopollenins. The extensive differences between pollen of Cedrus and the rest of Pinaceae family were unambiguously connected with molecular composition of sporopollenins in pollen grain wall, while pollen of Picea has apparently higher concentration of carotenoids than the rest of the family. It is shown that vibrational methodologies have great potential for systematic collection of data on ecosystems and that the obtained phylogenetic variation can be well explained by the biochemical composition of pollen. Out of the seven tested

  4. 2D vibrational properties of epitaxial silicene on Ag(111) (United States)

    Solonenko, Dmytro; Gordan, Ovidiu D.; Le Lay, Guy; Sahin, Hasan; Cahangirov, Seymur; Zahn, Dietrich R. T.; Vogt, Patrick


    The two-dimensional silicon allotrope, silicene, could spur the development of new and original concepts in Si-based nanotechnology. Up to now silicene can only be epitaxially synthesized on a supporting substrate such as Ag(111). Even though the structural and electronic properties of these epitaxial silicene layers have been intensively studied, very little is known about its vibrational characteristics. Here, we present a detailed study of epitaxial silicene on Ag(111) using in situ Raman spectroscopy, which is one of the most extensively employed experimental techniques to characterize 2D materials, such as graphene, transition metal dichalcogenides, and black phosphorous. The vibrational fingerprint of epitaxial silicene, in contrast to all previous interpretations, is characterized by three distinct phonon modes with A and E symmetries. Both, energies and symmetries of theses modes are confirmed by ab initio theory calculations. The temperature dependent spectral evolution of these modes demonstrates unique thermal properties of epitaxial silicene and a significant electron-phonon coupling. These results unambiguously support the purely two-dimensional character of epitaxial silicene up to about 300 °C, whereupon a 2D-to-3D phase transition takes place. The detailed fingerprint of epitaxial silicene will allow us to identify it in different environments or to study its modifications.

  5. The Astrophysical Weeds: Rotational Transitions in Excited Vibrational States (United States)

    Alonso, José L.; Kolesniková, Lucie; Alonso, Elena R.; Mata, Santiago


    The number of unidentified lines in the millimeter and submillimeter wave surveys of the interstellar medium has grown rapidly. The major contributions are due to rotational transitions in excited vibrational states of a relatively few molecules that are called the astrophysical weeds. necessary data to deal with spectral lines from astrophysical weeds species can be obtained from detailed laboratory rotational measurements in the microwave and millimeter wave region. A general procedure is being used at Valladolid combining different time and/or frequency domain spectroscopic tools of varying importance for providing the precise set of spectroscopic constants that could be used to search for this species in the ISM. This is illustrated in the present contribution through its application to several significant examples. Fortman, S. M., Medvedev, I. R., Neese, C.F., & De Lucia, F.C. 2010, ApJ,725, 1682 Rotational Spectra in 29 Vibrationally Excited States of Interstellar Aminoacetonitrile, L. Kolesniková, E. R. Alonso, S. Mata, and J. L. Alonso, The Astrophysical Journal Supplement Series 2017, (in press).

  6. Displacement of polarons by vibrational modes in doped conjugated polymers (United States)

    Anderson, M.; Ramanan, C.; Fontanesi, C.; Frick, A.; Surana, S.; Cheyns, D.; Furno, M.; Keller, T.; Allard, S.; Scherf, U.; Beljonne, D.; D'Avino, G.; von Hauff, E.; Da Como, E.


    Organic pi-conjugated polymers are deemed to be soft materials with strong electron-phonon coupling, which results in the formation of polarons, i.e., charge carriers dressed by self-localized distortion of the nuclei. Universal signatures for polarons are optical resonances below the band gap and intense vibrational modes (IVMs), both found in the infrared (IR) spectral region. Here, we study p -doped conjugated homo- and copolymers by combining first-principles modelling and optical spectroscopy from the far-IR to the visible. Polaronic IVMs are found to feature absorption intensities comparable to purely electronic transitions and, most remarkably, show only loose resemblance to the Raman or IR-active modes of the neutral polymer. The IVM frequency is dramatically scaled down (up to 50%) compared to the backbone carbon-stretching modes in the pristine polymers. The very large intensity of IVMs is associated with displacement of the excess positive charge along the backbone driven by specific vibrational modes. We propose a quantitative picture for the identification of these polaron shifting modes that solely based on structural information, directly correlates with their IR intensity. This finding finally discloses the elusive microscopic mechanism behind the huge IR intensity of IVMs in doped polymeric semiconductors.

  7. Effect of ionic solutes on the hydrogen bond network dynamics of water: power spectral analysis of aqueous NaCl solutions. (United States)

    Mudi, Anirban; Chakravarty, Charusita


    To understand the modifications of the hydrogen bond network of water by ionic solutes, power spectra as well as static distributions of the potential energies of tagged solvent molecules and solute ions have been computed from molecular dynamics simulations of aqueous NaCl solutions. The key power spectral features of interest are the presence of high-frequency peaks due to localized vibrational modes, the existence of a multiple time scale or 1/falpha frequency regime characteristic of networked liquids, and the frequency of crossover from 1/falpha type behavior to white noise. Hydrophilic solutes, such as the sodium cation and the chloride anion, are shown to mirror the multiple time scale behavior of the hydrogen bond network fluctuations, unlike hydrophobic solutes which display essentially white noise spectra. While the power spectra associated with tagged H2O molecules are not very sensitive to concentration in the intermediate frequency 1/falpha regime, the crossover to white noise is shifted to lower frequencies on going from pure solvent to aqueous alkali halide solutions. This suggests that new and relatively slow time scales enter the picture, possibly associated with processes such as migration of water molecules from the hydration shell to the bulk or conversion of contact ion pairs into solvent-separated ion pairs which translate into variations in equilibrium transport properties of salt solutions with concentration. For anions, cations, and solvent molecules, the trends in the alpha exponents of the multiple time scale region and the self-diffusivities are found to be strongly correlated.

  8. Vibrational Locomotion Enabling Subsurface Exploration of Unconsolidated Regolith Project (United States)

    National Aeronautics and Space Administration — The idea of vibrational locomotion is based on vibrational-fluidization in ISRU reactor systems, which has proven very effective for regolith mixing. The vibrating...

  9. Technical progress report: Completion of spectral rotating shadowband radiometers and analysis of atmospheric radiation measurement spectral shortwave data

    Energy Technology Data Exchange (ETDEWEB)

    Michalsky, J.; Harrison, L. [State Univ. of New York, Albany, NY (United States)


    Our goal in the Atmospheric Radiation Measurement (ARM) Program is the improvement of radiation models used in general circulation models (GCMs), especially in the shortwave, (1) by providing improved shortwave radiometric measurements for the testing of models and (2) by developing methods for retrieving climatologically sensitive parameters that serve as input to shortwave and longwave models. At the Atmospheric Sciences Research Center (ASRC) in Albany, New York, we are acquiring downwelling direct and diffuse spectral irradiance, at six wavelengths, plus downwelling broadband longwave, and upwelling and downwelling broadband shortwave irradiances that we combine with National Weather Service surface and upper air data from the Albany airport as a test data set for ARM modelers. We have also developed algorithms to improve shortwave measurements made at the Southern Great Plains (SGP) ARM site by standard thermopile instruments and by the multifilter rotating shadowband radiometer (MFRSR) based on these Albany data sets. Much time has been spent developing techniques to retrieve column aerosol, water vapor, and ozone from the direct beam spectral measurements of the MFRSR. Additionally, we have had success in calculating shortwave surface albedo and aerosol optical depth from the ratio of direct to diffuse spectral reflectance.


    Energy Technology Data Exchange (ETDEWEB)

    Martin E. Cobern


    The objective of this program is to develop a system to both monitor the vibration of a bottomhole assembly, and to adjust the properties of an active damper in response to these measured vibrations. Phase I of this program, which entailed modeling and design of the necessary subsystems and design, manufacture and test of a full laboratory prototype, was completed on May 31, 2004. The principal objectives of Phase II are: more extensive laboratory testing, including the evaluation of different feedback algorithms for control of the damper; design and manufacture of a field prototype system; and, testing of the field prototype in drilling laboratories and test wells. Work during this quarter centered on the testing of the rebuilt laboratory prototype and its conversion into a version that will be operable in the drilling tests at TerraTek Laboratories. In addition, formations for use in these tests were designed and constructed, and a test protocol was developed. The change in scope and no-cost extension of Phase II to January, 2006, described in our last report, were approved. The tests are scheduled to be run during the week of January 23, and should be completed before the end of the month.

  11. Chaotic vibrations of heated plates (United States)

    Fermen-Coker, Muge


    In recent years, the investigation of dynamical behavior of plates under thermal loads has become important due to the high temperatures reached on external skin panels of hypersonic vehicles. It has been shown by other researchers that the skin panels may encounter chaotic vibrations about their thermally buckled positions. In this research, the chaotic vibrations of simply supported plates under thermal and sinusoidal excitation is studied in order to predict the vibratory behavior of a representative class of such skin panels. A method for the development of equations of motion, that forms a foundation for further investigation of the response of elastic panels under general thermal, mechanical and aerodynamic loading and various boundary conditions, is presented and discussed. The boundaries of regular and chaotic regions of motion are defined and the sensitivity of these boundaries to changes in design parameters is explored for the purpose of developing useful design criteria. The onset of chaos is predicted through the computation of Lyapunov exponents. The sensitivity of Lyapunov exponent calculations to the choice of numerical method of integration, numerical precision and the magnitude of coefficients as functions of design variables, is discussed. The effects of thermal moment, thermal buckling, amplitude and frequency of excitation, damping, thickness and length to width ratio of panels on the onset of chaos is studied. The results of the research are presented as a contribution to the panel design of hypersonic vehicles.

  12. Time-resolved vibrational spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Tokmakoff, Andrei [Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States); Champion, Paul [Northeastern Univ., Boston, MA (United States); Heilweil, Edwin J. [National Inst. of Standards and Technology (NIST), Boulder, CO (United States); Nelson, Keith A. [Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States); Ziegler, Larry [Boston Univ., MA (United States)


    This document contains the Proceedings from the 14th International Conference on Time-Resolved Vibrational Spectroscopy, which was held in Meredith, NH from May 9-14, 2009. The study of molecular dynamics in chemical reaction and biological processes using time-resolved spectroscopy plays an important role in our understanding of energy conversion, storage, and utilization problems. Fundamental studies of chemical reactivity, molecular rearrangements, and charge transport are broadly supported by the DOE's Office of Science because of their role in the development of alternative energy sources, the understanding of biological energy conversion processes, the efficient utilization of existing energy resources, and the mitigation of reactive intermediates in radiation chemistry. In addition, time-resolved spectroscopy is central to all fiveof DOE's grand challenges for fundamental energy science. The Time-Resolved Vibrational Spectroscopy conference is organized biennially to bring the leaders in this field from around the globe together with young scientists to discuss the most recent scientific and technological advances. The latest technology in ultrafast infrared, Raman, and terahertz spectroscopy and the scientific advances that these methods enable were covered. Particular emphasis was placed on new experimental methods used to probe molecular dynamics in liquids, solids, interfaces, nanostructured materials, and biomolecules.

  13. Bicarbonate diffusion through mucus. (United States)

    Livingston, E H; Miller, J; Engel, E


    The mucus layer overlying duodenal epithelium maintains a pH gradient against high luminal acid concentrations. Despite these adverse conditions, epithelial surface pH remains close to neutrality. The exact nature of the gradient-forming barrier remains unknown. The barrier consists of mucus into which HCO3- is secreted. Quantification of the ability of HCO3- to establish and maintain the gradient depends on accurate measurement of this ion's diffusion coefficient through mucus. We describe new experimental and mathematical methods for diffusion measurement and report diffusion coefficients for HCO3- diffusion through saline, 5% mucin solutions, and rat duodenal mucus. The diffusion coefficients were 20.2 +/- 0.10, 3.02 +/- 0.31, and 1.81 +/- 0.12 x 10(-6) cm2/s, respectively. Modeling of the mucobicarbonate layer with this latter value suggests that for conditions of high luminal acid strength the neutralization of acid by HCO3- occurs just above the epithelial surface. Under these conditions the model predicts that fluid convection toward the lumen could be important in maintaining the pH gradient. In support of this hypothesis we were able to demonstrate a net luminal fluid flux of 5 after perfusion of 0.15 N HCl in the rat duodenum.

  14. Enriched vibrational resonance in certain discrete systems

    Indian Academy of Sciences (India)

    We wish to report the occurrence of vibrational resonance in certain discrete systems like sine square map and sine circle map, in a unique fashion, comprising of multiple resonant peaks which pave the way for enrichment. As the systems of our choice are capable of exhibiting vibrational resonance behaviour unlike the ...

  15. Enriched vibrational resonance in certain discrete systems

    Indian Academy of Sciences (India)

    system [10], bistable systems [1,11,12], time-delayed system [13] and also in a few low- dimensional maps [14] due to its ... the driving force, has attracted much attention in recent years. The study of vibrational ... odic trigonometric functions, one can expect the recurrence of multiple resonant peaks due to vibrational ...

  16. Modified Composite Struts Would Damp Vibrations (United States)

    Chen, Gun-Shing; Dolgin, Benjamin P.


    Composite-material (fiber/matrix laminate) struts damping longitudinal vibrations fabricated more easily in proposed new design. Prior design described in "Composite Struts Would Damp Vibrations" (NPO-17914). New design similar except pattern of fibers includes rounded bends (instead of sharp bends) in fibers.

  17. Torsional vibrations of infinite composite poroelastic cylinders

    African Journals Online (AJOL)


    Abstract. A study of torsional vibrations of an infinite composite poroelastic circular solid cylinder made of two different materials is made. The frequency equation of such torsional vibrations is obtained following analytical model based on Biot's theory of wave propagation in liquid saturated porous media. Each dilatation of ...

  18. Benefits of Spacecraft Level Vibration Testing (United States)

    Gordon, Scott; Kern, Dennis L.


    NASA-HDBK-7008 Spacecraft Level Dynamic Environments Testing discusses the approaches, benefits, dangers, and recommended practices for spacecraft level dynamic environments testing, including vibration testing. This paper discusses in additional detail the benefits and actual experiences of vibration testing spacecraft for NASA Goddard Space Flight Center (GSFC) and Jet Propulsion Laboratory (JPL) flight projects. JPL and GSFC have both similarities and differences in their spacecraft level vibration test approach: JPL uses a random vibration input and a frequency range usually starting at 5 Hz and extending to as high as 250 Hz. GSFC uses a sine sweep vibration input and a frequency range usually starting at 5 Hz and extending only to the limits of the coupled loads analysis (typically 50 to 60 Hz). However, both JPL and GSFC use force limiting to realistically notch spacecraft resonances and response (acceleration) limiting as necessary to protect spacecraft structure and hardware from exceeding design strength capabilities. Despite GSFC and JPL differences in spacecraft level vibration test approaches, both have uncovered a significant number of spacecraft design and workmanship anomalies in vibration tests. This paper will give an overview of JPL and GSFC spacecraft vibration testing approaches and provide a detailed description of spacecraft anomalies revealed.

  19. The analysis of nonstationary vibration data (United States)

    Piersol, Allan G.


    The general methodology for the analysis of arbitrary nonstationary random data is reviewed. A specific parametric model, called the product model, that has applications to space vehicle launch vibration data analysis is discussed. Illustrations are given using the nonstationary launch vibration data measured on the Space Shuttle orbiter vehicle.

  20. Quenching of self-excited vibrations

    NARCIS (Netherlands)

    Verhulst, F.


    Stable normal-mode vibrations in engineering can be undesirable and one of the possibilities for quenching these is by embedding the oscillator in an autoparametric system by coupling to a damped oscillator. There exists the possibility of destabilizing the undesirable vibrations by a suitable


    Directory of Open Access Journals (Sweden)

    Murat Aydın


    Full Text Available Vibration damping and sound insulation are essential for all vehicles. Because moving parts and external factors such as wind, tracks, etc. can cause vibration and noise. Wave which is a dynamic force, drive system and HVAC systems are the main vibration and noise generators in a vessel. These all can affect comfort level on board yachts. Different types of isolators and absorbers such as sylomer®, cork panels, etc. are used to reduce these effects. Comfort level on board yachts can be increased using these types of materials. Otherwise, discomfort of passenger and crew may increase. These materials not only reduce structure-borne and air-borne noise and vibrations from waves, air, engines, pumps, generators and HVAC systems but also protect vibration sensitive interior or fittings. Noise and vibration evaluation is an important issue for this reason. And, measurement tools must be used not only to minimize this problem but also fulfill the regulations such as “comfort class”. Besides, providing quiet and low vibration increases the costs too. From this point of view, this study aims to explain clearly how noise and vibration damping can be done in a yacht.

  2. Vibrational Stability of NLC Linac Accelerating Structure

    CERN Document Server

    Le Pimpec, F; Bowden, G B; Doyle, E; McKee, B; Seryi, Andrei; Redaelli, S; Adiga, S


    The vibration of components of the NLC linac, such as accelerating structures and girders, is being studied both experimentally and analytically. Various effects are being considered including structural resonances and vibration caused by cooling water in the accelerating structure. This paper reports the status of ongoing work.

  3. Real-time video imaging of gas plumes using a DMD-enabled full-frame programmable spectral filter (United States)

    Graff, David L.; Love, Steven P.


    Programmable spectral filters based on digital micromirror devices (DMDs) are typically restricted to imaging a 1D line across a scene, analogous to conventional "push-broom scanning" hyperspectral imagers. In previous work, however, we demonstrated that, by placing the diffraction grating at a telecentric image plane rather than at the more conventional location in collimated space, a spectral plane can be created at which light from the entire 2D scene focuses to a unique location for each wavelength. A DMD placed at this spectral plane can then spectrally manipulate an entire 2D image at once, enabling programmable matched filters to be applied to real-time video imaging. We have adapted this concept to imaging rapidly evolving gas plumes. We have constructed a high spectral resolution programmable spectral imager operating in the shortwave infrared region, capable of resolving the rotational-vibrational line structure of several gases at sub-nm spectral resolution. This ability to resolve the detailed gas-phase line structure enables implementation of highly selective filters that unambiguously separate the gas spectrum from background spectral clutter. On-line and between-line multi-band spectral filters, with bands individually weighted using the DMD's duty-cycle-based grayscale capability, are alternately uploaded to the DMD, the resulting images differenced, and the result displayed in real time at rates of several frames per second to produce real-time video of the turbulent motion of the gas plume.

  4. Communication: creation of molecular vibrational motions via the rotation-vibration coupling

    DEFF Research Database (Denmark)

    Shu, Chuan-Cun; Henriksen, Niels Engholm


    whereas a fast rotational excitation leads to a non-stationary vibrational motion. As a result, under field-free postpulse conditions, either a stretched stationary bond or a vibrating bond can be created due to the coupling between the rotational and vibrational degrees of freedom. The latter corresponds......Building on recent advances in the rotational excitation of molecules, we show how the effect of rotation-vibration coupling can be switched on in a controlled manner and how this coupling unfolds in real time after a pure rotational excitation. We present the first examination of the vibrational...... motions which can be induced via the rotation-vibration coupling after a pulsed rotational excitation. A time-dependent quantum wave packet calculation for the HF molecule shows how a slow (compared to the vibrational period) rotational excitation leads to a smooth increase in the average bond length...

  5. Modeling Displacement Measurement using Vibration Transducers

    Directory of Open Access Journals (Sweden)

    AGOSTON Katalin


    Full Text Available This paper presents some aspects regarding to small displacement measurement using vibration transducers. Mechanical faults, usages, slackness’s, cause different noises and vibrations with different amplitude and frequency against the normal sound and movement of the equipment. The vibration transducers, accelerometers and microphone are used for noise and/or sound and vibration detection with fault detection purpose. The output signal of the vibration transducers or accelerometers is an acceleration signal and can be converted to either velocity or displacement, depending on the preferred measurement parameter. Displacement characteristics are used to indicate when the machine condition has changed. There are many problems using accelerometers to measure position or displacement. It is important to determine displacement over time. To determinate the movement from acceleration a double integration is needed. A transfer function and Simulink model was determinate for accelerometers with capacitive sensing element. Using these models the displacement was reproduced by low frequency input.

  6. Passively damped vibration welding system and method (United States)

    Tan, Chin-An; Kang, Bongsu; Cai, Wayne W.; Wu, Tao


    A vibration welding system includes a controller, welding horn, an anvil, and a passive damping mechanism (PDM). The controller generates an input signal having a calibrated frequency. The horn vibrates in a desirable first direction at the calibrated frequency in response to the input signal to form a weld in a work piece. The PDM is positioned with respect to the system, and substantially damps or attenuates vibration in an undesirable second direction. A method includes connecting the PDM having calibrated properties and a natural frequency to an anvil of an ultrasonic welding system. Then, an input signal is generated using a weld controller. The method includes vibrating a welding horn in a desirable direction in response to the input signal, and passively damping vibration in an undesirable direction using the PDM.

  7. High Energy Vibration for Gas Piping (United States)

    Lee, Gary Y. H.; Chan, K. B.; Lee, Aylwin Y. S.; Jia, ShengXiang


    In September 2016, a gas compressor in offshore Sarawak has its rotor changed out. Prior to this change-out, pipe vibration study was carried-out by the project team to evaluate any potential high energy pipe vibration problems at the compressor’s existing relief valve downstream pipes due to process condition changes after rotor change out. This paper covers high frequency acoustic excitation (HFAE) vibration also known as acoustic induced vibration (AIV) study and discusses detailed methodologies as a companion to the Energy Institute Guidelines for the avoidance of vibration induced fatigue failure, which is a common industry practice to assess and mitigate for AIV induced fatigue failure. Such detailed theoretical studies can help to minimize or totally avoid physical pipe modification, leading to reduce offshore plant shutdown days to plant shutdowns only being required to accommodate gas compressor upgrades, reducing cost without compromising process safety.

  8. Effect of Ionic Diffusion on Extracellular Potentials in Neural Tissue.

    Directory of Open Access Journals (Sweden)

    Geir Halnes


    Full Text Available Recorded potentials in the extracellular space (ECS of the brain is a standard measure of population activity in neural tissue. Computational models that simulate the relationship between the ECS potential and its underlying neurophysiological processes are commonly used in the interpretation of such measurements. Standard methods, such as volume-conductor theory and current-source density theory, assume that diffusion has a negligible effect on the ECS potential, at least in the range of frequencies picked up by most recording systems. This assumption remains to be verified. We here present a hybrid simulation framework that accounts for diffusive effects on the ECS potential. The framework uses (1 the NEURON simulator to compute the activity and ionic output currents from multicompartmental neuron models, and (2 the electrodiffusive Kirchhoff-Nernst-Planck framework to simulate the resulting dynamics of the potential and ion concentrations in the ECS, accounting for the effect of electrical migration as well as diffusion. Using this framework, we explore the effect that ECS diffusion has on the electrical potential surrounding a small population of 10 pyramidal neurons. The neural model was tuned so that simulations over ∼100 seconds of biological time led to shifts in ECS concentrations by a few millimolars, similar to what has been seen in experiments. By comparing simulations where ECS diffusion was absent with simulations where ECS diffusion was included, we made the following key findings: (i ECS diffusion shifted the local potential by up to ∼0.2 mV. (ii The power spectral density (PSD of the diffusion-evoked potential shifts followed a 1/f2 power law. (iii Diffusion effects dominated the PSD of the ECS potential for frequencies up to several hertz. In scenarios with large, but physiologically realistic ECS concentration gradients, diffusion was thus found to affect the ECS potential well within the frequency range picked up in

  9. Cesium diffusion in graphite

    Energy Technology Data Exchange (ETDEWEB)

    Evans, R.B. III; Davis, W. Jr.; Sutton, A.L. Jr.


    Experiments on diffusion of /sup 137/Cs in five types of graphite were performed. The document provides a completion of the report that was started and includes a presentation of all of the diffusion data, previously unpublished. Except for data on mass transfer of /sup 137/Cs in the Hawker-Siddeley graphite, analyses of experimental results were initiated but not completed. The mass transfer process of cesium in HS-1-1 graphite at 600 to 1000/sup 0/C in a helium atmosphere is essentially pure diffusion wherein values of (E/epsilon) and of the equation D/epsilon = (D/epsilon)/sub 0/ exp ( are about 4 x 10/sup -2/ cm/sup 2//s and 30 kcal/mole, respectively.

  10. Diffusion and mass transfer

    CERN Document Server

    Vrentas, James S


    The book first covers the five elements necessary to formulate and solve mass transfer problems, that is, conservation laws and field equations, boundary conditions, constitutive equations, parameters in constitutive equations, and mathematical methods that can be used to solve the partial differential equations commonly encountered in mass transfer problems. Jump balances, Green’s function solution methods, and the free-volume theory for the prediction of self-diffusion coefficients for polymer–solvent systems are among the topics covered. The authors then use those elements to analyze a wide variety of mass transfer problems, including bubble dissolution, polymer sorption and desorption, dispersion, impurity migration in plastic containers, and utilization of polymers in drug delivery. The text offers detailed solutions, along with some theoretical aspects, for numerous processes including viscoelastic diffusion, moving boundary problems, diffusion and reaction, membrane transport, wave behavior, sedime...

  11. Diffusion in flexible pipes

    Energy Technology Data Exchange (ETDEWEB)

    Brogaard Kristensen, S.


    This report describes the work done on modelling and simulation of the complex diffusion of gas through the wall of a flexible pipe. The diffusion and thus the pressure in annulus depends strongly on the diffusion and solubility parameters of the gas-polymer system and on the degree of blocking of the outer surface of the inner liner due to pressure reinforcements. The report evaluates the basis modelling required to describe the complex geometries and flow patterns. Qualitatively results of temperature and concentration profiles are shown in the report. For the program to serve any modelling purpose in 'real life' the results need to be validated and possibly the model needs corrections. Hopefully, a full-scale test of a flexible pipe will provide the required temperatures and pressures in annulus to validate the models. (EHS)

  12. Diffuse Ceiling Ventilation

    DEFF Research Database (Denmark)

    Zhang, Chen; Yu, Tao; Heiselberg, Per Kvols

    -cooling period and night cooling potential. The investment cost of this ventilation system is about 5-10% lower than the conventional ones, because the acoustic ceiling could be directly applied as air diffuser and the use of plenum to distribute air reduces the cost of ductwork. There is a growing interest...... and manufacturers and the users of diffuse ceiling technology. The design guide introduces the principle and key characteristics of room air distribution with diffuse ceiling ventilation. It provides an overview of potential benefit and limitations of this technology. The benefits include high thermal comfort, high...... cooling capacity, energy saving, low investment cost and low noise level; while the limitations include condensation risk and the limit on the room geometry. Furthermore, the crucial design parameters are summarized and their effects on the system performance are discussed. In addition to the stand...

  13. Spectral filtering for plant production

    Energy Technology Data Exchange (ETDEWEB)

    Young, R.E.; McMahon, M.J.; Rajapakse, N.C.; Becoteau, D.R.


    Research to date suggests that spectral filtering can be an effective alternative to chemical growth regulators for altering plant development. If properly implemented, it can be nonchemical and environmentally friendly. The aqueous CuSO{sub 4}, and CuCl{sub 2} solutions in channelled plastic panels have been shown to be effective filters, but they can be highly toxic if the solutions contact plants. Some studies suggest that spectral filtration limited to short EOD intervals can also alter plant development. Future research should be directed toward confirmation of the influence of spectral filters and exposure times on a broader range of plant species and cultivars. Efforts should also be made to identify non-noxious alternatives to aqueous copper solutions and/or to incorporate these chemicals permanently into plastic films and panels that can be used in greenhouse construction. It would also be informative to study the impacts of spectral filters on insect and microbal populations in plant growth facilities. The economic impacts of spectral filtering techniques should be assessed for each delivery methodology.

  14. Solar Spectral Irradiance and Climate (United States)

    Pilewskie, P.; Woods, T.; Cahalan, R.


    Spectrally resolved solar irradiance is recognized as being increasingly important to improving our understanding of the manner in which the Sun influences climate. There is strong empirical evidence linking total solar irradiance to surface temperature trends - even though the Sun has likely made only a small contribution to the last half-century's global temperature anomaly - but the amplitudes cannot be explained by direct solar heating alone. The wavelength and height dependence of solar radiation deposition, for example, ozone absorption in the stratosphere, absorption in the ocean mixed layer, and water vapor absorption in the lower troposphere, contribute to the "top-down" and "bottom-up" mechanisms that have been proposed as possible amplifiers of the solar signal. New observations and models of solar spectral irradiance are needed to study these processes and to quantify their impacts on climate. Some of the most recent observations of solar spectral variability from the mid-ultraviolet to the near-infrared have revealed some unexpected behavior that was not anticipated prior to their measurement, based on an understanding from model reconstructions. The atmospheric response to the observed spectral variability, as quantified in climate model simulations, have revealed similarly surprising and in some cases, conflicting results. This talk will provide an overview on the state of our understanding of the spectrally resolved solar irradiance, its variability over many time scales, potential climate impacts, and finally, a discussion on what is required for improving our understanding of Sun-climate connections, including a look forward to future observations.

  15. In Vivo Optical Detection and Spectral Triangulation of Carbon Nanotubes. (United States)

    Lin, Ching-Wei; Yang, Hailing; Sanchez, Stephen R; Mao, Weiqun; Pang, Lan; Beckingham, Kathleen M; Bast, Robert C; Weisman, R Bruce


    In the first in vivo demonstration of spectral triangulation, biocompatible composites of single-walled carbon nanotubes in Matrigel have been surgically implanted into mouse ovaries and then noninvasively detected and located. This optical method deduces the three-dimensional position of a short-wave IR emission source from the wavelength-dependent attenuation of fluorescence in tissues. Measurements were performed with a second-generation optical scanner that uses a light-emitting diode matrix emitting at 736 nm for diffuse specimen excitation. The intrinsic short-wave IR fluorescence of the nanotubes was collected at various positions on the specimen surface, spectrally filtered, and detected by a photon-counting InGaAs avalanche photodiode. Sensitivity studies showed a detection limit of ∼120 pg of nanotubes located beneath ∼3 mm of tissue. In addition, the mass and location of implanted nanotubes could be deduced through spectral triangulation with sub-millimeter accuracy, as validated with the aid of magnetic resonance imaging (MRI) data. Dual-modality imaging combining spectral triangulation with computed tomography or MRI will allow accurate registration of emission centers with anatomical features. These results are a step toward the future use of probes with targeting agents such as antibodies linked to nanotube tags for the noninvasive detection and imaging of tumors in preclinical research on small animals. Translation to the clinic could aid in early detection of ovarian cancer and identification of metastases for resection during primary surgery.

  16. Scanning, non-contact, hybrid broadband diffuse optical spectroscopy and diffuse correlation spectroscopy system. (United States)

    Johansson, Johannes D; Mireles, Miguel; Morales-Dalmau, Jordi; Farzam, Parisa; Martínez-Lozano, Mar; Casanovas, Oriol; Durduran, Turgut


    A scanning system for small animal imaging using non-contact, hybrid broadband diffuse optical spectroscopy (ncDOS) and diffuse correlation spectroscopy (ncDCS) is presented. The ncDOS uses a two-dimensional spectrophotometer retrieving broadband (610-900 nm) spectral information from up to fifty-seven source-detector distances between 2 and 5 mm. The ncDCS data is simultaneously acquired from four source-detector pairs. The sample is scanned in two dimensions while tracking variations in height. The system has been validated with liquid phantoms, demonstrated in vivo on a human fingertip during an arm cuff occlusion and on a group of mice with xenoimplanted renal cell carcinoma.

  17. Machine Fault Detection Based on Filter Bank Similarity Features Using Acoustic and Vibration Analysis

    Directory of Open Access Journals (Sweden)

    Mauricio Holguín-Londoño


    Full Text Available Vibration and acoustic analysis actively support the nondestructive and noninvasive fault diagnostics of rotating machines at early stages. Nonetheless, the acoustic signal is less used because of its vulnerability to external interferences, hindering an efficient and robust analysis for condition monitoring (CM. This paper presents a novel methodology to characterize different failure signatures from rotating machines using either acoustic or vibration signals. Firstly, the signal is decomposed into several narrow-band spectral components applying different filter bank methods such as empirical mode decomposition, wavelet packet transform, and Fourier-based filtering. Secondly, a feature set is built using a proposed similarity measure termed cumulative spectral density index and used to estimate the mutual statistical dependence between each bandwidth-limited component and the raw signal. Finally, a classification scheme is carried out to distinguish the different types of faults. The methodology is tested in two laboratory experiments, including turbine blade degradation and rolling element bearing faults. The robustness of our approach is validated contaminating the signal with several levels of additive white Gaussian noise, obtaining high-performance outcomes that make the usage of vibration, acoustic, and vibroacoustic measurements in different applications comparable. As a result, the proposed fault detection based on filter bank similarity features is a promising methodology to implement in CM of rotating machinery, even using measurements with low signal-to-noise ratio.

  18. New approach to spectral features modeling

    NARCIS (Netherlands)

    Brug, H. van; Scalia, P.S.


    The origin of spectral features, speckle effects, is explained, followed by a discussion on many aspects of spectral features generation. The next part gives an overview of means to limit the amplitude of the spectral features. This paper gives a discussion of all means to reduce the spectral

  19. Phase transformation and diffusion

    CERN Document Server

    Kale, G B; Dey, G K


    Given that the basic purpose of all research in materials science and technology is to tailor the properties of materials to suit specific applications, phase transformations are the natural key to the fine-tuning of the structural, mechanical and corrosion properties. A basic understanding of the kinetics and mechanisms of phase transformation is therefore of vital importance. Apart from a few cases involving crystallographic martensitic transformations, all phase transformations are mediated by diffusion. Thus, proper control and understanding of the process of diffusion during nucleation, g

  20. Diffusion in advanced materials

    CERN Document Server

    Murch, Graeme; Belova, Irina


    In the first chapter Prof. Kozubski and colleagues present atomisticsimulations of superstructure transformations of intermetallic nanolayers.In Chapter 2, Prof. Danielewski and colleagues discuss a formalism for themorphology of the diffusion zone in ternary alloys. In Chapter 3, ProfessorsSprengel and Koiwa discuss the classical contributions of Boltzmann andMatano for the analysis of concentration-dependent diffusion. This isfollowed by Chapter 4 by Professor Cserháti and colleagues on the use of Kirkendall porosity for fabricating hollow hemispheres. In Chapter 5,Professor Morton-Blake rep