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Sample records for mode raman fem

  1. Report on first masing and single mode locking in a prebunched beam FEM oscillator

    Energy Technology Data Exchange (ETDEWEB)

    Cohen, M.; Eichenbaum, A.; Kleinman, H. [Tel-Aviv Univ., Ramat-Aviv (Israel)] [and others

    1995-12-31

    Radiation characteristics of a table-top free electron maser (FEM) are described in this paper. The FEM employs a prebunched electron beam and is operated as an oscillator in the low-gain collective (Raman) regime. Using electron beam prebunching single mode locking at any one of the possible oscillation modes was obtained. The electron beam is prebunched by a microwave tube section before it is injected into the wiggler. By tuning the electron beam bunching frequency, the FEM oscillation frequency can be locked to any eigen frequency of the resonant waveguide cavity which is within the frequency band of net gain of the FEM. The oscillation build up process is sped up, when the FEM operates with a prebunched electron beam, and the build-up time of radiation is shortened significantly. First measurements of masing with and without prebunching and characterization of the emitted radiation are reported.

  2. Mode splitting effect in FEMs with oversized Bragg resonators

    Energy Technology Data Exchange (ETDEWEB)

    Peskov, N. Yu.; Sergeev, A. S. [Institute of Applied Physics Russian Academy of Sciences, Nizhny Novgorod (Russian Federation); Kaminsky, A. K.; Perelstein, E. A.; Sedykh, S. N. [Joint Institute for Nuclear Research, Dubna (Russian Federation); Kuzikov, S. V. [Institute of Applied Physics Russian Academy of Sciences, Nizhny Novgorod (Russian Federation); Nizhegorodsky State University, Nizhny Novgorod (Russian Federation)

    2016-07-15

    Splitting of the fundamental mode in an oversized Bragg resonator with a step of the corrugation phase, which operates over the feedback loop involving the waveguide waves of different transverse structures, was found to be the result of mutual influence of the neighboring zones of the Bragg scattering. Theoretical description of this effect was developed within the framework of the advanced (four-wave) coupled-wave approach. It is shown that mode splitting reduces the selective properties, restricts the output power, and decreases the stability of the narrow-band operating regime in the free-electron maser (FEM) oscillators based on such resonators. The results of the theoretical analysis were confirmed by 3D simulations and “cold” microwave tests. Experimental data on Bragg resonators with different parameters in a 30-GHz FEM are presented. The possibility of reducing the mode splitting by profiling the corrugation parameters is shown. The use of the mode splitting effect for the output power enhancement by passive compression of the double-frequency pulse generated in the FEM with such a resonator is discussed.

  3. Challenges in higher order mode Raman amplifiers

    DEFF Research Database (Denmark)

    Rottwitt, Karsten; Nielsen, Kristian; Friis, Søren Michael Mørk

    2015-01-01

    A higher order Raman amplifier model that take random mode coupling into account ispresented. Mode dependent gain and signal power fluctuations at the output of the higher order modeRaman amplifier are discussed......A higher order Raman amplifier model that take random mode coupling into account ispresented. Mode dependent gain and signal power fluctuations at the output of the higher order modeRaman amplifier are discussed...

  4. Higher order mode optical fiber Raman amplifiers

    DEFF Research Database (Denmark)

    Rottwitt, Karsten; Friis, Søren Michael Mørk; Usuga Castaneda, Mario A.

    2016-01-01

    We review higher order mode Raman amplifiers and discuss recent theoretical as well as experimental results including system demonstrations.......We review higher order mode Raman amplifiers and discuss recent theoretical as well as experimental results including system demonstrations....

  5. Raman amplification of OAM modes

    DEFF Research Database (Denmark)

    Ingerslev, Kasper; Gregg, Patrick; Galili, Michael

    2017-01-01

    The set of fibre modes carrying orbital angular momentum (OAM) is a possible basis for mode division multiplexing. In this regard, fibres supporting OAM modes have been fabricated [1], and optical communication using these fibres, has been demonstrated [2]. A vital part of any long range...

  6. All-fiber Raman Probe using Higher Order Modes

    DEFF Research Database (Denmark)

    Larsen, Stine Højer Møller; Rishøj, Lars Søgaard; Rottwitt, Karsten

    2013-01-01

    We demonstrate the first all-fiber Raman probe utilizing higher order modes for the excitation. The spectrum of cyclohexane is measured using both the fundamental mode as well as in-fiber-generated Bessel-like modes.......We demonstrate the first all-fiber Raman probe utilizing higher order modes for the excitation. The spectrum of cyclohexane is measured using both the fundamental mode as well as in-fiber-generated Bessel-like modes....

  7. Experimental characterization of Raman overlaps between mode-groups

    DEFF Research Database (Denmark)

    Christensen, Erik Nicolai; Koefoed, Jacob Gade; Friis, Søren Michael Mørk

    2016-01-01

    Mode-division multiplexing has the potential to further increase data transmission capacity through optical fibers. In addition, distributed Raman amplification is a promising candidate for multi-mode signal amplification due to its desirable noise properties and the possibility of mode-equalized......Mode-division multiplexing has the potential to further increase data transmission capacity through optical fibers. In addition, distributed Raman amplification is a promising candidate for multi-mode signal amplification due to its desirable noise properties and the possibility of mode......-equalized gain. In this paper, we present an experimental characterization of the intermodal Raman intensity overlaps of a few-mode fiber using backward-pumped Raman amplification. By varying the input pump power and the degree of higher order mode-excitation for the pump and the signal in a 10km long two......-mode fiber, we are able to characterize all intermodal Raman intensity overlaps. Using these results, we perform a Raman amplification measurement and demonstrate a mode-differential gain of only 0.25dB per 10dB overall gain. This is, to the best of our knowledge, the lowest mode differential gain achieved...

  8. Raman intensity and vibrational modes of armchair CNTs

    Science.gov (United States)

    Hur, Jaewoong; Stuart, Steven J.

    2017-07-01

    Raman intensity changes and frequency patterns have been studied using the various armchair (n, n) to understand the variations of bond polarizability, in regard to changing diameters, lengths, and the number of atoms in the (n, n). The Raman intensity trends of the (n, n) are validated by those of Cn isomers. For frequency trends, similar frequency patterns and frequency inward shifts for the (n, n) are characterized. Also, VDOS trends of the (n, n) expressing Raman modes are interpreted. The decomposition of vibrational modes in the (n, n) into radial, longitudinal, and tangential mode is beneficially used to recognize the distinct characteristics of vibrational modes.

  9. Prediction of the FOM FEM experimental results using multi-mode time-dependent simulations

    NARCIS (Netherlands)

    Caplan, M.; Bongers, W. A.; Verhoeven, A. G. A.; van der Geer, C. A. J.; Valentini, M.; Urbanus, W. H.

    1998-01-01

    The Free Electron Maser (FEM) constructed at the FOM Institute, Netherlands is now ready to undergo the first set of short pulse (< 20 mu s) experiments to demonstrate the capability of generating 1 MW of microwave power in the range 130-250 GHz. Predictions of the FEM performance requires a

  10. Mode-dependent dispersion in Raman line shapes: Observation and implications from ultrafast Raman loss spectroscopy

    International Nuclear Information System (INIS)

    Umapathy, S.; Mallick, B.; Lakshmanna, A.

    2010-01-01

    Ultrafast Raman loss spectroscopy (URLS) enables one to obtain the vibrational structural information of molecular systems including fluorescent materials. URLS, a nonlinear process analog to stimulated Raman gain, involves a narrow bandwidth picosecond Raman pump pulse and a femtosecond broadband white light continuum. Under nonresonant condition, the Raman response appears as a negative (loss) signal, whereas, on resonance with the electronic transition the line shape changes from a negative to a positive through a dispersive form. The intensities observed and thus, the Franck-Condon activity (coordinate dependent), are sensitive to the wavelength of the white light corresponding to a particular Raman frequency with respect to the Raman pump pulse wavelength, i.e., there is a mode-dependent response in URLS.

  11. [Raman, FTIR spectra and normal mode analysis of acetanilide].

    Science.gov (United States)

    Liang, Hui-Qin; Tao, Ya-Ping; Han, Li-Gang; Han, Yun-Xia; Mo, Yu-Jun

    2012-10-01

    The Raman and FTIR spectra of acetanilide (ACN) were measured experimentally in the regions of 3 500-50 and 3 500-600 cm(-1) respectively. The equilibrium geometry and vibration frequencies of ACN were calculated based on density functional theory (DFT) method (B3LYP/6-311G(d, p)). The results showed that the theoretical calculation of molecular structure parameters are in good agreement with previous report and better than the ones calculated based on 6-31G(d), and the calculated frequencies agree well with the experimental ones. Potential energy distribution of each frequency was worked out by normal mode analysis, and based on this, a detailed and accurate vibration frequency assignment of ACN was obtained.

  12. FEM Analysis of Sezawa Mode SAW Sensor for VOC Based on CMOS Compatible AlN/SiO2/Si Multilayer Structure

    Directory of Open Access Journals (Sweden)

    Muhammad Zubair Aslam

    2018-05-01

    Full Text Available A Finite Element Method (FEM simulation study is conducted, aiming to scrutinize the sensitivity of Sezawa wave mode in a multilayer AlN/SiO2/Si Surface Acoustic Wave (SAW sensor to low concentrations of Volatile Organic Compounds (VOCs, that is, trichloromethane, trichloroethylene, carbon tetrachloride and tetrachloroethene. A Complimentary Metal-Oxide Semiconductor (CMOS compatible AlN/SiO2/Si based multilayer SAW resonator structure is taken into account for this purpose. In this study, first, the influence of AlN and SiO2 layers’ thicknesses over phase velocities and electromechanical coupling coefficients (k2 of two SAW modes (i.e., Rayleigh and Sezawa is analyzed and the optimal thicknesses of AlN and SiO2 layers are opted for best propagation characteristics. Next, the study is further extended to analyze the mass loading effect on resonance frequencies of SAW modes by coating a thin Polyisobutylene (PIB polymer film over the AlN surface. Finally, the sensitivity of the two SAW modes is examined for VOCs. This study concluded that the sensitivity of Sezawa wave mode for 1 ppm of selected volatile organic gases is twice that of the Rayleigh wave mode.

  13. Enhanced Raman scattering assisted by ultrahigh order modes of the double metal cladding waveguide

    Energy Technology Data Exchange (ETDEWEB)

    Xu, Tian; Huang, Liming; Jin, Yonglong; Fang, Jinghuai, E-mail: cyin.phys@gmail.com, E-mail: fjhuai@ntu.edu.cn [Physics Department, Nantong University, No. 9, Seyuan Road, Nantong, Jiangsu 226007 (China); Yin, Cheng, E-mail: cyin.phys@gmail.com, E-mail: fjhuai@ntu.edu.cn [Jiangsu Key Laboratory of Power Transmission and Distribution Equipment Technology, Hohai University, Changzhou 213022 (China); Huang, Meizhen [Department of Instrument Science and Engineering, Shanghai Jiaotong University, No. 800, DongChuan Road, Shanghai 200240 (China)

    2014-10-20

    Distinguished from the usual strategy to enhance the Raman scattering such as creating hot spots in the surface-enhanced Raman scattering, this paper takes a quite different approach based on the double metal cladding waveguide. The target analyte is located in the guiding layer of sub-millimeter scale, where several ultrahigh order modes with high intensity are simultaneously excited via a focused laser beam. The experimental setup is simple, and both simulation and experimental results confirm the enhancement mechanism of these oscillating modes. Other appealing features include the large detection area and the ability to excite guided modes via both polarizations. This scheme can be applied to large molecules detection and readily integrated with other Raman enhancement techniques.

  14. Raman analysis of phonon modes in a short period AlN/GaN superlattice

    Science.gov (United States)

    Sarkar, Ketaki; Datta, Debopam; Gosztola, David J.; Shi, Fengyuan; Nicholls, Alan; Stroscio, Michael A.; Dutta, Mitra

    2018-03-01

    AlN/GaN-based optoelectronic devices have been the subject of intense research underlying the commercialization of efficient devices. Areas of considerable interest are the study of their lattice dynamics, phonon transport, and electron-phonon interactions specific to the interface of these heterostructures which results in additional optical phonon modes known as interface phonon modes. In this study, the framework of the dielectric continuum model (DCM) has been used to compare and analyze the optical phonon modes obtained from experimental Raman scattering measurements on AlN/GaN short-period superlattices. We have observed the localized E2(high), A1(LO) and the E1(TO) modes in superlattice measurements at frequencies shifted from their bulk values. To the best of our knowledge, the nanostructures used in these studies are among the smallest yielding useful Raman signatures for the interface modes. In addition, we have also identified an additional spread of interface phonon modes in the TO range resulting from the superlattice periodicity. The Raman signature contribution from the underlying AlxGa1-xN ternary has also been observed and analyzed. A temperature calibration was done based on Stokes/anti-Stokes ratio of A1(LO) using Raman spectroscopy in a broad operating temperature range. Good agreement between the experimental results and theoretically calculated calibration plot predicted using Bose-Einstein statistics was obtained.

  15. Low-Frequency Interlayer Raman Modes to Probe Interface of Twisted Bilayer MoS2.

    Science.gov (United States)

    Huang, Shengxi; Liang, Liangbo; Ling, Xi; Puretzky, Alexander A; Geohegan, David B; Sumpter, Bobby G; Kong, Jing; Meunier, Vincent; Dresselhaus, Mildred S

    2016-02-10

    van der Waals homo- and heterostructures assembled by stamping monolayers together present optoelectronic properties suitable for diverse applications. Understanding the details of the interlayer stacking and resulting coupling is crucial for tuning these properties. We investigated the low-frequency interlayer shear and breathing Raman modes (frequency and intensity changes of low-frequency modes. The frequency variation can be up to 8 cm(-1) and the intensity can vary by a factor of ∼5 for twisting angles near 0° and 60°, where the stacking is a mixture of high-symmetry stacking patterns and is thus sensitive to twisting. For twisting angles between 20° and 40°, the interlayer coupling is nearly constant because the stacking results in mismatched lattices over the entire sample. It follows that the Raman signature is relatively uniform. Note that for some samples, multiple breathing mode peaks appear, indicating nonuniform coupling across the interface. In contrast to the low-frequency interlayer modes, high-frequency intralayer Raman modes are much less sensitive to interlayer stacking and coupling. This research demonstrates the effectiveness of low-frequency Raman modes for probing the interfacial coupling and environment of twisted bilayer MoS2 and potentially other two-dimensional materials and heterostructures.

  16. Observation of the low frequency vibrational modes of bacteriophage M13 in water by Raman spectroscopy

    Directory of Open Access Journals (Sweden)

    Tsen Shaw-Wei D

    2006-09-01

    Full Text Available Abstract Background Recently, a technique which departs radically from conventional approaches has been proposed. This novel technique utilizes biological objects such as viruses as nano-templates for the fabrication of nanostructure elements. For example, rod-shaped viruses such as the M13 phage and tobacco mosaic virus have been successfully used as biological templates for the synthesis of semiconductor and metallic nanowires. Results and discussion Low wave number (≤ 20 cm-1 acoustic vibrations of the M13 phage have been studied using Raman spectroscopy. The experimental results are compared with theoretical calculations based on an elastic continuum model and appropriate Raman selection rules derived from a bond polarizability model. The observed Raman mode has been shown to belong to one of the Raman-active axial torsion modes of the M13 phage protein coat. Conclusion It is expected that the detection and characterization of this low frequency vibrational mode can be used for applications in nanotechnology such as for monitoring the process of virus functionalization and self-assembly. For example, the differences in Raman spectra can be used to monitor the coating of virus with some other materials and nano-assembly process, such as attaching a carbon nanotube or quantum dots.

  17. Theoretical study of the Raman active CDW gap mode in manganites

    International Nuclear Information System (INIS)

    Rout, G C; Panda, Saswati; Behera, S N

    2010-01-01

    We report here the microscopic theory of the Raman spectra of the colossal magnetoresistive (CMR) manganite systems. The system is described by a model Hamiltonian consisting of the double exchange interaction in addition to the charge ordering interaction in the e g band and spin-spin interaction among the t 2g core electrons. Further the phonon coupling to the conduction electron density is incorporated in the model for phonons in the harmonic approximation. The spectral density function for the Raman spectra is calculated from the imaginary part of the phonon Green's function. The calculated spectra display the Raman active bare phonon peak along with the charge ordering peak. The magnetic field and temperature dependence of the charge ordering peak agrees with the 480 cm -1 JT mode observed in the experiments. The evolution of this mode is investigated in the report.

  18. Soft mode in cubic PbTiO.sub.3./sub. by hyper-Raman scattering

    Czech Academy of Sciences Publication Activity Database

    Hlinka, Jiří; Hehlen, B.; Kania, A.; Gregora, Ivan

    2013-01-01

    Roč. 87, č. 6 (2013), "064101-1"-"064101-4" ISSN 1098-0121 R&D Projects: GA MŠk ME08109 Institutional support: RVO:68378271 Keywords : soft mode * PbTiO 3 * hyper-Raman scattering Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 3.664, year: 2013

  19. Study of optical phonon modes of CdS nanoparticles using Raman

    Indian Academy of Sciences (India)

    In this paper we report the study of optical phonon modes of nanoparticles of CdS using Raman spectroscopy. Nanoparticle sample for the present study was synthesized through chemical precipitation technique. The CdS nanoparticles were then subjected to heat treatment at low temperature (150°C) for extended time ...

  20. Mechanisms for the control of two-mode transient stimulated Raman scattering in liquids

    International Nuclear Information System (INIS)

    Spanner, Michael; Brumer, Paul

    2006-01-01

    Recent adaptive feedback control experiments demonstrated control of transient (i.e. nonimpulsive) Stokes emission from two closely spaced Raman-active modes in liquid methanol [e.g., B. J. Pearson et al., Phys. Rev. A 63, 063412 (2001)]. Optimally shaped pulses were found that selectively excited one of the two Stokes lines alone, optimized emission from both modes together, or completely suppressed all Stokes emission. Here, two general control mechanisms capable of affecting the ratio of intensities of the Stokes lines are identified. The first is operational when the duration of the pump pulse (t p ) is on the order of the collisional dephasing time (t d ). The ratio of the peak heights of the two Stokes lines can then be controlled by simply varying the duration and/or intensity of the pump pulse. The second operates when 1/t p is on the order of the energy separation of the two Raman modes, and hence when the two Raman modes are coupled due to overlapping nonlinear polarizations that drive the stimulated Raman scattering. In this regime, asymmetry in the spectral amplitudes within the pump pulse can control the asymmetry in the peak heights of the Stokes emission. Both these mechanisms have the same clear physical interpretation: shaping the pump pulse controls the nonlinear optical response of the medium, which in turn controls the stimulated Stokes emission, itself a χ (3) nonlinear effect. In neither mechanism does the ratio of peak heights in the Stokes spectrum reflect directly the ratio of excited-state populations associated with the two Raman modes, as was assumed in the experiments, nor does the control involve coherent quantum interference effects

  1. An FEM-based AI approach to model parameter identification for low vibration modes of wind turbine composite rotor blades

    Science.gov (United States)

    Navadeh, N.; Goroshko, I. O.; Zhuk, Y. A.; Fallah, A. S.

    2017-11-01

    An approach to construction of a beam-type simplified model of a horizontal axis wind turbine composite blade based on the finite element method is proposed. The model allows effective and accurate description of low vibration bending modes taking into account the effects of coupling between flapwise and lead-lag modes of vibration transpiring due to the non-uniform distribution of twist angle in the blade geometry along its length. The identification of model parameters is carried out on the basis of modal data obtained by more detailed finite element simulations and subsequent adoption of the 'DIRECT' optimisation algorithm. Stable identification results were obtained using absolute deviations in frequencies and in modal displacements in the objective function and additional a priori information (boundedness and monotony) on the solution properties.

  2. Surface-Enhanced Raman Scattering Using Silica Whispering-Gallery Mode Resonators

    Science.gov (United States)

    Anderson, Mark S.

    2013-01-01

    The motivation of this work was to have robust spectroscopic sensors for sensitive detection and chemical analysis of organic and molecular compounds. The solution is to use silica sphere optical resonators to provide surface-enhanced spectroscopic signal. Whispering-gallery mode (WGM) resonators made from silica microspheres were used for surface-enhanced Raman scattering (SERS) without coupling to a plasmonic mechanism. Large Raman signal enhancement is observed by exclusively using 5.08-micron silica spheres with 785-nm laser excitation. The advantage of this non-plasmonic approach is that the active substrate is chemically inert silica, thermally stable, and relatively simple to fabricate. The Raman signal enhancement is broadly applicable to a wide range of molecular functional groups including aliphatic hydrocarbons, siloxanes, and esters. Applications include trace organic analysis, particularly for in situ planetary instruments that require robust sensors with consistent response.

  3. Measurement of the Raman scattering cross section of the breathing mode in KDP and DKDP crystals.

    Science.gov (United States)

    Demos, Stavros G; Raman, Rajesh N; Yang, Steven T; Negres, Raluca A; Schaffers, Kathleen I; Henesian, Mark A

    2011-10-10

    The spontaneous Raman scattering cross sections of the main peaks (related to the A1 vibrational mode) in rapid and conventional grown potassium dihydrogen phosphate and deuterated crystals are measured at 532 nm, 355 nm, and 266 nm. The measurement involves the use of the Raman line of water centered at 3400 cm-1 as a reference to obtain relative values of the cross sections which are subsequently normalized against the known absolute value for water as a function of excitation wavelength. This measurement enables the estimation of the transverse stimulated Raman scattering gain of these nonlinear optical materials in various configurations suitable for frequency conversion and beam control in high-power, large-aperture laser systems.

  4. Revealing silent vibration modes of nanomaterials by detecting anti-Stokes hyper-Raman scattering with femtosecond laser pulses.

    Science.gov (United States)

    Zeng, Jianhua; Chen, Lei; Dai, Qiaofeng; Lan, Sheng; Tie, Shaolong

    2016-01-21

    We proposed a scheme in which normal Raman scattering is coupled with hyper-Raman scattering for generating a strong anti-Stokes hyper-Raman scattering in nanomaterials by using femtosecond laser pulses. The proposal was experimentally demonstrated by using a single-layer MoS2 on a SiO2/Si substrate, a 17 nm-thick MoS2 on an Au/SiO2 substrate and a 9 nm-thick MoS2 on a SiO2-SnO2/Ag/SiO2 substrate which were confirmed to be highly efficient for second harmonic generation. A strong anti-Stokes hyper-Raman scattering was also observed in other nanomaterials possessing large second-order susceptibilities, such as silicon quantum dots self-assembled into "coffee" rings and tubular Cu-doped ZnO nanorods. In all the cases, many Raman inactive vibration modes were clearly revealed in the anti-Stokes hyper-Raman scattering. Apart from the strong anti-Stokes hyper-Raman scattering, Stokes hyper-Raman scattering with small Raman shifts was detected during the ablation process of thick MoS2 layers. It was also observed by slightly defocusing the excitation light. The detection of anti-Stokes hyper-Raman scattering may serve as a new technique for studying the Raman inactive vibration modes in nanomaterials.

  5. Dynamics for a two-atom two-mode intensity-dependent Raman coupled model

    Energy Technology Data Exchange (ETDEWEB)

    Singh, S., E-mail: vasudha-rnc1@rediffmail.com, E-mail: sudhhasingh@gmail.com; Gilhare, K. [Ranchi University, Department of Physics (India)

    2016-06-15

    We study the quantum dynamics of a two-atom Raman coupled model interacting with a quantized bimodal field with intensity-dependent coupling terms in a lossless cavity. The unitary transformation method used to solve the time-dependent problem also gives the eigensolutions of the interaction Hamiltonian. We study the atomic-population dynamics and dynamics of the photon statistics in the two cavity modes, and present evidence of cooperative effects in the production of antibunching and anticorrelations between the modes. We also investigate the effect of detuning on the evolution of second-order correlation functions and observe that the oscillations become more rapid for large detuning.

  6. Defect induced activation of Raman silent modes in rf co-sputtered Mn doped ZnO thin films

    Energy Technology Data Exchange (ETDEWEB)

    Yadav, Harish Kumar [Department of Physics and Astrophysics, University of Delhi, Delhi-110007 (India); Sreenivas, K [Department of Physics and Astrophysics, University of Delhi, Delhi-110007 (India); Katiyar, R S [Department of Physics, University of Puerto Rico, San Juan, PR 00931-3343 (Puerto Rico); Gupta, Vinay [Department of Physics and Astrophysics, University of Delhi, Delhi-110007 (India)

    2007-10-07

    We study the influence of Mn doping on the vibrational properties of rf sputtered ZnO thin films. Raman spectra of the Mn doped ZnO samples reveal two additional vibrational modes, in addition to the host phonon modes, at 252 and 524 cm{sup -1}. The intensity of the additional modes increases continuously with Mn concentration in ZnO and can be used as an indication of Mn incorporation in ZnO. The modes are assigned to the activation of ZnO silent modes due to relaxation of Raman selection rules produced by the breakdown of the translational symmetry of the crystal lattice with the incorporation of Mn at the Zn site. Furthermore, the A{sub 1} (LO) mode is observed with very high intensity in the Raman spectra of undoped ZnO thin film and is attributed to the built-in electric field at the grain boundaries.

  7. Defect induced activation of Raman silent modes in rf co-sputtered Mn doped ZnO thin films

    International Nuclear Information System (INIS)

    Yadav, Harish Kumar; Sreenivas, K; Katiyar, R S; Gupta, Vinay

    2007-01-01

    We study the influence of Mn doping on the vibrational properties of rf sputtered ZnO thin films. Raman spectra of the Mn doped ZnO samples reveal two additional vibrational modes, in addition to the host phonon modes, at 252 and 524 cm -1 . The intensity of the additional modes increases continuously with Mn concentration in ZnO and can be used as an indication of Mn incorporation in ZnO. The modes are assigned to the activation of ZnO silent modes due to relaxation of Raman selection rules produced by the breakdown of the translational symmetry of the crystal lattice with the incorporation of Mn at the Zn site. Furthermore, the A 1 (LO) mode is observed with very high intensity in the Raman spectra of undoped ZnO thin film and is attributed to the built-in electric field at the grain boundaries

  8. Anharmonic properties of Raman modes in double wall carbon nano tubes

    Energy Technology Data Exchange (ETDEWEB)

    Marquina, J. [Universidad de los Andes, Facultad de Ciencias, Centro de Estudios Avanzados en Optica, 5101 Merida (Venezuela, Bolivarian Republic of); Power, Ch.; Gonzalez, J. [Universidad de los Andes, Facultad de Ciencias, Centro de Estudios en Semiconductores, 5101 Merida (Venezuela, Bolivarian Republic of); Broto, J. M. [Universite de Toulouse, Laboratoire National des Champs Magnetiques Intenses, CNRS UPR 3228, 31400 Toulouse (France); Flahaut, E., E-mail: castella@ula.v [Universite Paul Sabatier, Laboratoire de Chimie des Materiaux Inorganiques, UMR CNRS 5085, 31062 Toulouse (France)

    2011-07-01

    The temperature dependence of the radial breathing modes (RB Ms) and the zone-center tangential optical phonons (G-bands) of double-walled carbon nano tubes has been investigated between 300 and 700 K using Raman scattering. As expected, with increasing temperature, the frequencies of the Raman peaks, including the RB Ms and G-bands downshift simultaneously. We show here that the temperature dependence of the RB Ms can be fitted by a simple linear dependence and different RB Ms have different frequency shifts. We observe a noticeable nonlinearity in the temperature dependence of the G-band associated with the outer semiconducting tube G+ext (s). The deviation from the linear trend is due to the contribution of the third-order anharmonic term in the lattice potential energy with a pure temperature effect. An estimated value of 1.5 for the Grueneisen parameter of the G+ext (s) band was found. (Author)

  9. Low-Frequency Shear and Layer-Breathing Modes in Raman Scattering of Two-Dimensional Materials.

    Science.gov (United States)

    Liang, Liangbo; Zhang, Jun; Sumpter, Bobby G; Tan, Qing-Hai; Tan, Ping-Heng; Meunier, Vincent

    2017-12-26

    Ever since the isolation of single-layer graphene in 2004, two-dimensional layered structures have been among the most extensively studied classes of materials. To date, the pool of two-dimensional materials (2DMs) continues to grow at an accelerated pace and already covers an extensive range of fascinating and technologically relevant properties. An array of experimental techniques have been developed and used to characterize and understand these properties. In particular, Raman spectroscopy has proven to be a key experimental technique, thanks to its capability to identify minute structural and electronic effects in nondestructive measurements. While high-frequency (HF) intralayer Raman modes have been extensively employed for 2DMs, recent experimental and theoretical progress has demonstrated that low-frequency (LF) interlayer Raman modes are more effective at determining layer numbers and stacking configurations and provide a unique opportunity to study interlayer coupling. These advantages are due to 2DMs' unique interlayer vibration patterns where each layer behaves as an almost rigidly moving object with restoring forces corresponding to weak interlayer interactions. Compared to HF Raman modes, the relatively small attention originally devoted to LF Raman modes is largely due to their weaker signal and their proximity to the strong Rayleigh line background, which previously made their detection challenging. Recent progress in Raman spectroscopy with technical and hardware upgrades now makes it possible to probe LF modes with a standard single-stage Raman system and has proven crucial to characterize and understand properties of 2DMs. Here, we present a comprehensive and forward-looking review on the current status of exploiting LF Raman modes of 2DMs from both experimental and theoretical perspectives, revealing the fundamental physics and technological significance of LF Raman modes in advancing the field of 2DMs. We review a broad array of materials, with

  10. Impairments due to Burst-Mode Transmission in a Raman-based Long Reach PON Link

    DEFF Research Database (Denmark)

    Kjær, Rasmus; Tafur Monroy, Idelfonso; Oxenløwe, Leif Katsuo

    2007-01-01

    A recently proposed passive-optical-network (PON) link based on distributed Raman amplification is tested with disturbing burst-mode traffic. The resulting impairments are quantified through penalty measurements on a single surviving data channel as a function of the disturbing channel power. When...... the disturbing channels co- or counter propagate with the data channel, penalties of less than 1 dB are found for disturbing input powers up to 7 and 11 dBm, respectively. The penalty is further reduced when a moderate amount of continuous-wave light is used to clamp the gain. The results indicate...

  11. Red-excitation resonance Raman analysis of the nu(Fe=O) mode of ferryl-oxo hemoproteins.

    Science.gov (United States)

    Ikemura, Kenichiro; Mukai, Masahiro; Shimada, Hideo; Tsukihara, Tomitake; Yamaguchi, Satoru; Shinzawa-Itoh, Kyoko; Yoshikawa, Shinya; Ogura, Takashi

    2008-11-05

    The Raman excitation profile of the nuFe O mode of horseradish peroxidase compound II exhibits a maximum at 580 nm. This maximum is located within an absorption band with a shoulder assignable to an oxygen-to-iron charge transfer band on the longer wavelength side of the alpha-band. Resonance Raman bands of the nuFe O mode of various ferryl-oxo type hemoproteins measured at 590 nm excitation indicate that many hemoproteins in the ferryl-oxo state have an oxygen-to-iron charge transfer band in the visible region. Since this red-excited resonance Raman technique causes much less photochemical damage in the proteins relative to blue-excited resonance Raman spectroscopy, it produces a higher signal-to-noise ratio and thus represents a powerful tool for investigations of ferryl-oxo intermediates of hemoproteins.

  12. Observation of anisotropic interlayer Raman modes in few-layer ReS{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Nagler, Philipp; Plechinger, Gerd; Schueller, Christian; Korn, Tobias [Institut fuer Experimentelle und Angewandte Physik, Universitaet Regensburg, 93040, Regensburg (Germany)

    2016-02-15

    ReS{sub 2} has recently emerged as a new member in the rapidly growing family of two-dimensional materials. Unlike MoS{sub 2} or WSe{sub 2}, the optical and electrical properties of ReS{sub 2} are not isotropic due to the reduced symmetry of the crystal. Here, we present layer-dependent Raman measurements of ReS{sub 2} samples ranging from monolayers to ten layers in the ultralow frequency regime. We observe layer breathing and shear modes which allow for easy assignment of the number of layers. Polarization-dependent measurements give further insight into the crystal structure and reveal an energetic shift of the shear mode which stems from the in-plane anisotropy of the shear modulus in this material. (copyright 2016 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  13. Breathing Raman modes in Ag{sub 2}S nanoparticles obtained from F9 zeolite matrix

    Energy Technology Data Exchange (ETDEWEB)

    Delgado-Beleño, Y. [Departamento de Investigación en Física, Universidad de Sonora, Apdo. Postal 5-88, 83190 Hermosillo, Son. (Mexico); Cortez-Valadez, M., E-mail: jose.cortez@unison.mx [CONACYT Research Fellow, Departamento de Investigación en Física, Universidad de Sonora, Apdo. Postal 5-88, 83190 Hermosillo, Son. (Mexico); Martinez-Nuñez, C.E.; Britto Hurtado, R.; Alvarez, Ramón A.B.; Rocha-Rocha, O.; Arizpe-Chávez, H.; Perez-Rodríguez, A.; Flores-Acosta, M. [Departamento de Investigación en Física, Universidad de Sonora, Apdo. Postal 5-88, 83190 Hermosillo, Son. (Mexico)

    2015-12-16

    Highlights: • Raman breathing modes in small silver sulfide nanoparticles. • Low energy (AgS){sub n} clusters. • Vibrational spectra predicted by DFT. • Zeolite synthesis for small nanoparticles. - Abstract: Ag{sub 2}S nanoparticles were synthesized with a combination of synthetic F9, silver nitrate (AgNO{sub 3}) and monohydrated sodium sulfide (Na{sub 2}S{sub 9}H{sub 2}O). An ionic exchange was achieved via hydrothermal reaction. Nanoparticles with a predominant size ranging from 2 to 3 nm were obtained through Transmission Electron Microscopy (TEM). The nanoparticles feature a phase P21/n (14) monoclinic structure. A Raman band can be observed at around 250 cm{sup −1} in the nanoparticles. Furthermore, the vibrational properties and stability parameters of the clusters (AgS){sub n}, (with n = 2–9) were studied by the Density Functional Theory (DFT). The approximation levels used with DFT were: Local Spin Density Approximation (LSDA) and Becke’s three-parameter and the gradient corrected functional of Lee, Yang and Puar (B3LYP) in combination with the basis set LANL2DZ (the effective core potentials and associated double-zeta valence). The Radial Breathing Mode (RBM) for B3LYP was found between 227 and 295 cm{sup −1} as well as in longer wavelengths for LSDA.

  14. Communication: Effect of accidental mode degeneracy on Raman intensity in 2D materials: Hybrid functional study of bilayer phosphorene

    Energy Technology Data Exchange (ETDEWEB)

    Sun, Yi-Yang; Zhang, Shengbai [Department of Physics, Applied Physics and Astronomy, Rensselaer Polytechnic Institute, Troy, New York 12180 (United States)

    2016-07-14

    Bulk black phosphorus has two optical phonon modes labeled as A{sub g}{sup 2} and B{sub 2u}, respectively, that are nearly degenerate in frequency. However, density functional theory calculations using local or semi-local functionals cannot reproduce this degeneracy. Here, we propose a hybrid functional approach aided by van der Waals (vdW) force fields, which can accurately describe the lattice dynamic and electronic properties of both bulk and few-layer black phosphorus (phosphorene). Using this approach we show that in bilayer phosphorene, the two Raman modes derived from the B{sub 2u} and A{sub g}{sup 2} modes could exhibit strong resonance as a result of the accidental degeneracy so that both modes could be observed in Raman experiment. Without the mode degeneracy, however, the Raman intensity of the B{sub 2u}-derived mode would be too weak to be observed. We further show that the accidental degeneracy is correlated to the applied strain, which enables Raman spectroscopy to be a powerful tool for characterizing built-in strains in 2D materials, e.g., due to the interaction with substrates, which has emerged as an important issue in vdW epitaxy.

  15. Low-Frequency Raman Modes of 2H-TaSe2 in the Charge Density Wave Phase

    Science.gov (United States)

    Chowdhury, Sugata; Simpson, J.; Einstein, T. L.; Hight Walker, A. R.; Theoretical Collaboration

    With changes in temperatures, tantalum diselenide (2H-TaSe2) , a layered, transition metal chalcogenides (TMD) exhibits unique super-lattice structures. The metallic ground state changes to an incommensurate charge density wave (CDW) state at 122?K followed by a commensurate CDW state at 90?K, and eventually a superconducting state 0.14 K. These phase transitions are driven by strong electron-phonon coupling and favored by the particular form of the Fermi surface of these systems. Here we theoretically studied the structural origin of low-frequency Raman modes of bulk 2H-TaSe2\\ in the CDW phases. Our calculations reveal that changes observed in the Raman modes are associated with the thermal expansion in the basal plane of 2H-TaSe2. The Grüneisen parameters of these two Raman modes increase in the CDW phases. Changes in the lattice parameter ``a'' are large compared to ``c'' which induces strain along the a-axis. We compared our results with experimental data which show low-frequency Raman phonon modes are very sensitive to temperature and are not observed in the metallic room-temperature state. In addition, we found that cation displacement is more than anion in CDW phase. Our results may shed more light on exact nature of the CDW instability and optical properties in this system.

  16. Characterization of defect modes in YBa2Cu3O7-δ thin films probed by Raman scattering

    International Nuclear Information System (INIS)

    Hong, Seongsik; Jo, Hyunchul; Cheong, Hyeonsik; Park, Gwangseo

    2005-01-01

    A Raman analysis is performed on a series of fully oxygenated YBa 2 Cu 3 O 7-δ thin films, on MgO(1 0 0) substrates, deposited by the pulsed laser technique at temperatures between 680 deg C and 820 deg C. θ - 2θ scans of the films by the X-ray diffraction show that the YBCO films are oriented in the c-axis. There are no extra peaks appearing in the X-ray diffraction data. Besides the well-known active modes, however, Raman spectra reveal a number of defect modes. The defect mode at 594 cm -1 redshifts and merges toward the O(4)-A g mode at 502 cm -1 with decreasing deposition temperatures. This mode is significantly asymmetrical and broad, whereas the mode at 243 cm -1 is symmetrical, with a small full width at half maximum remaining unchanged at a value around its own frequency. The intensity of the mode at 243 cm -1 seems to depend on the intensity of the mode at 594 cm -1 . Quantitative calculations concerning the relative intensities show that the two modes are related to each other

  17. The electron–phonon coupling of fundamental, overtone, and combination modes and its effects on the resonance Raman spectra

    Energy Technology Data Exchange (ETDEWEB)

    Li, Shuo [State Key Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China); College of Physics, Jilin University, Changchun 130012 (China); Li, Zhanlong; Wang, Shenghan; Gao, Shuqin [College of Physics, Jilin University, Changchun 130012 (China); Sun, Chenglin, E-mail: chenglin@jlu.edu.cn [State Key Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China); College of Physics, Jilin University, Changchun 130012 (China); Li, Zuowei [College of Physics, Jilin University, Changchun 130012 (China)

    2015-12-15

    Highlights: • The Huang–Rhys factors and electron–phonon coupling constants are calculated. • The changes of overtone mode are larger than those of fundamental mode. • The variation pattern of electron–phonon coupling well interprets the changes of spectra. - Abstract: External field plays a very important role in the interaction between the π-electron transition and atomic vibration of polyenes. It has significant effects on both the Huang–Rhys factor and the electron–phonon coupling. In this paper, the visible absorption and resonance Raman spectra of all-trans-β-carotene are measured in the 345–295 K temperature range and it is found that the changes of the 0–1 and 0–2 vibration bands of the absorption spectra with the temperature lead to the different electron–phonon coupling of fundamental, overtone, and combination modes. The electron-phonon coupling constants of all the modes are calculated and analyzed under different temperatures. The variation law of the electron–phonon coupling with the temperature well interprets the changes of the resonance Raman spectra, such as the shift, intensity and line width of the overtone and combination modes, which are all greater than those of the fundamental modes.

  18. Raman Scattering Study of the Soft Phonon Mode in the Hexagonal Ferroelectric Crystal KNiCl 3

    Science.gov (United States)

    Machida, Ken-ichi; Kato, Tetsuya; Chao, Peng; Iio, Katsunori

    1997-10-01

    Raman spectra of some phonon modes of the hexagonal ferroelectriccrystal KNiCl3are obtained in the temperature range between 290 K and 590 K, which includes the structural phase transition point T2(=561 K) at which previous measurements of dielectric constant and spontaneouspolarization as a function of temperature had shown that KNiCl3 undergoes a transition between polar phases II and III. An optical birefringence measurement carried outas a complement to the present Raman scattering revealed that this transition is of second order. Towards this transition point, the totally symmetric phonon mode with the lowest frequency observed in the room-temperature phasewas found to soften with increasing temperature.The present results provide new information on the phase-transitionmechanism and the space groups of thehigher (II)- and lower (III)-symmetric phases around T2.

  19. ITER Plasma at Electron Cyclotron Frequency Domain: Stimulated Raman Scattering off Gould-Trivelpiece Modes and Generation of Suprathermal Electrons and Energetic Ions

    Science.gov (United States)

    Stefan, V. Alexander

    2011-04-01

    Stimulated Raman scattering in the electron cyclotron frequency range of the X-Mode and O-Mode driver with the ITER plasma leads to the ``tail heating'' via the generation of suprathermal electrons and energetic ions. The scattering off Trivelpiece-Gould (T-G) modes is studied for the gyrotron frequency of 170GHz; X-Mode and O-Mode power of 24 MW CW; on-axis B-field of 10T. The synergy between the two-plasmon decay and Raman scattering is analyzed in reference to the bulk plasma heating. Supported in part by Nikola TESLA Labs, La Jolla, CA

  20. Effect of pressure on Zircon's (ZrSiO4) Raman active modes: a first-principles study

    Science.gov (United States)

    Sheremetyeva, Natalya; Cherniak, Daniele; Watson, Bruce; Meunier, Vincent

    Zircon is a mineral commonly found in the Earth crust. Its remarkable properties have given rise to considerable attention. This includes possible inclusion of radioactive elements in natural samples, which allows for geochronological investigations. Subsequently, Zircon was proposed as possible host material for radioactive waste management. Internal radiation damage in zircon leads to the destruction of its crystal structure (an effect known as metamictization) which is subject to ongoing research. Recently, the effect of pressure and temperature on synthetic zircon has been analyzed experimentally using Raman spectroscopy which led to the calibration of zircon as a pressure sensor in diamond-anvil cell experiments. While there have been a number of theoretical studies, the effect of pressure on the Raman active modes of zircon has not been investigated theoretically. Here we present a first-principles pressure calibration of the Raman active modes in Zircon employing density-functional theory (DFT). We find excellent quantitative agreement of the slopes ∂ω / ∂P with the experimental ones and are able to rationalize the ω vs. P behavior based on the details of the vibrational modes.

  1. Fine structure of the stimulated Raman spectrum in compressed hydrogen. The relaxation-oscillation mode of backscattered Stokes emission

    International Nuclear Information System (INIS)

    Bespalov, V.G.; Efimov, Yu.N.; Staselko, D.I.

    1992-01-01

    This paper studies the emission spectra of backscattered stimulated Raman scattering (SRS) in compressed hydrogen in the relaxation-oscillation mode and the compression SRS mode for the minimum width of the spontaneous scattering spectrum (in the region of the Dicke dip). It is shown that the generation of a train of Stokes-emission subpulses results in the appearance of fine structure in the backscattered SRS spectrum. The influence of the temporal structure of reflected Stokes pulses on this spectrum and on the appearance of fine structure in it is analyzed. The conditions for generating spectrally limited (without phase modulation), extremely coherent Stokes pulses are explained. 18 refs., 3 figs

  2. Pressure dependence of Raman modes in the chalcopyrite quaternary alloy AgxCu1-xGaS2

    International Nuclear Information System (INIS)

    Choi, In-Hwan; Yu, Peter Y.

    2000-01-01

    Raman scattering in the chalcopyrite quaternary alloy Ag x Cu 1-x GaS 2 has been studied under high pressure (up to 7 GPa) and at low temperature (50 K) using a diamond anvil high pressure cell for alloy concentrations x=1, 0.75, 0.5, 0.25 and 0. This has allowed us to determine the dependence of their zone-center phonon modes on both pressure and alloy concentration. The resultant phonon pressure coefficients are helpful in understanding the nature of the phonon modes in these chalcopyrites

  3. Spectral quantum fluctuations in a stimulated Raman generator: a description in terms of temporally coherent modes.

    Science.gov (United States)

    Walmsley, I A

    1992-03-15

    The probability density of the single-shot mean Stokes frequency from a linear Raman generator is calculated. It is shown that the fluctuations in the Stokes pulse energy spectrum that arise from the quantum initiation of the Stokes light are reduced in the transient regime of amplification. Also, it appears that saturation of the Raman gain does not reduce the phase fluctuations of the Stokes light below those present in the unsaturated gain (linear) regime.

  4. Lattice parameters and Raman-active phonon modes of β-(AlxGa1−x)2O3

    International Nuclear Information System (INIS)

    Kranert, Christian; Jenderka, Marcus; Lenzner, Jörg; Lorenz, Michael; Wenckstern, Holger von; Schmidt-Grund, Rüdiger; Grundmann, Marius

    2015-01-01

    We present X-ray diffraction and Raman spectroscopy investigations of a (100)-oriented (Al x Ga 1–x ) 2 O 3 thin film on MgO (100) and bulk-like ceramics in dependence on their composition. The thin film grown by pulsed laser deposition has a continuous lateral composition spread allowing to determine precisely the dependence of the phonon mode properties and lattice parameters on the chemical composition. For x < 0.4, we observe the single-phase β-modification. Its lattice parameters and phonon energies depend linearly on the composition. We determined the slopes of these dependencies for the individual lattice parameters and for nine Raman lines, respectively. While the lattice parameters of the ceramics follow Vegard's rule, deviations are observed for the thin film. This deviation has only a small effect on the phonon energies, which show a reasonably good agreement between thin film and ceramics

  5. Phase-sensitive detection of optical resonances by using an acousto-optic modulator in the Raman - Nath diffraction mode

    International Nuclear Information System (INIS)

    Baryshev, V N; Domnin, Yu S; Kopylov, L N

    2007-01-01

    A new method for frequency control of an external cavity diode laser without direct modulation of the injection current is proposed. The Pound - Drever optical heterodyne technique or the method of frequency control by frequency-modulated sidebands, in which an acousto-optic modulator operating in the Raman - Nath diffraction mode is used as an external phase modulator, can be employed to obtain error signals upon automatic frequency locking of the diode laser to the saturated absorption resonances within the D 2 line of cesium atoms or to the optical cavity resonances. (control of laser radiation parameters)

  6. The role of ion irradiation in activating silent Raman modes via tuning in plasmonic behaviour and surface disorder of Au/ZnO/Pt NFG system

    Science.gov (United States)

    Singh, Udai B.; Gautam, Subodh K.; Kumar, Sunil; Ojha, Sunil; Ghosh, Santanu; Singh, Fouran

    2017-09-01

    The perceptible progression of Raman modes of zinc oxide (ZnO) is studied in nanostructures film gap (Au (10 nm)/ZnO (70 nm)/Pt (50 nm)) system with 1.2 MeV Xe ion irradiation. Unattainable silent Raman modes of ZnO turn out to be strongly visible after ion irradiation. The creation of ion-beam-induced lattice disorder, defects, and impurities in a ZnO layer leads to breakdown the translational crystal symmetry that results in the origin of silent modes. The formation of hot-spots in the ZnO layer of the NFG system also supports the enhancement of the intensity of Raman modes. Overall results are attributed to combined effects of lattice disorder, defects, and impurities along with plasmonic effect and explained in the framework of elastic-thermal-spike formation.

  7. Raman scattering evidence for a cascade-like evolution of the charge-density-wave collective amplitude mode

    Energy Technology Data Exchange (ETDEWEB)

    Eiter, Hans-Martin; Tassini, Leonardo; Muschler, Bernhard; Hackl, Rudi [Walther Meissner Institute, Bavarian Academy of Sciences and Humanities, 85748 Garching (Germany); Lavagnini, Michela; Degiorgi, Leonardo [Laboratorium fuer Festkoerperphysik, ETH - Zuerich, CH-8093 Zuerich (Switzerland); Chu, Jiun-Haw; Ru, Nancy; Fisher, Ian R. [GLAM, Stanford University, CA 94304 (United States)

    2010-07-01

    We report results of Raman scattering experiments as a function of temperature on the charge-density-wave (CDW) systems DyTe{sub 3} and on LaTe{sub 3} at 6 GPa applied pressure. We clearly identify the unidirectional collective CDW amplitude excitation and follow their temperature dependence in the range from 6 K to 311 K. Surprisingly, we discover that the amplitude mode develops as a succession of two mean-field, BCS-like transitions at two different temperatures. Tri-tellurides with heavier rare-earth atoms (i.e. Tm, Er, Ho, Dy) undergo another phase transition to a bidirectional CDW at low temperatures. In DyTe{sub 3} we find spectroscopic evidence for the amplitude mode excitation associated with the bidirectional CDW occuring below 50 K.

  8. Raman Scattering from Higgs Mode Oscillations in the Two-Dimensional Antiferromagnet Ca_{2}RuO_{4}.

    Science.gov (United States)

    Souliou, Sofia-Michaela; Chaloupka, Jiří; Khaliullin, Giniyat; Ryu, Gihun; Jain, Anil; Kim, B J; Le Tacon, Matthieu; Keimer, Bernhard

    2017-08-11

    We present and analyze Raman spectra of the Mott insulator Ca_{2}RuO_{4}, whose quasi-two-dimensional antiferromagnetic order has been described as a condensate of low-lying spin-orbit excitons with angular momentum J_{eff}=1. In the A_{g} polarization geometry, the amplitude (Higgs) mode of the spin-orbit condensate is directly probed in the scalar channel, thus avoiding infrared-singular magnon contributions. In the B_{1g} geometry, we observe a single-magnon peak as well as two-magnon and two-Higgs excitations. Model calculations using exact diagonalization quantitatively agree with the observations. Together with recent neutron scattering data, our study provides strong evidence for excitonic magnetism in Ca_{2}RuO_{4} and points out new perspectives for research on the Higgs mode in two dimensions.

  9. Dominant phonon wave vectors and strain-induced splitting of the 2D Raman mode of graphene

    Science.gov (United States)

    Narula, Rohit; Bonini, Nicola; Marzari, Nicola; Reich, Stephanie

    2012-03-01

    The dominant phonon wave vectors q* probed by the 2D Raman mode of pristine and uniaxially strained graphene are determined via a combination of ab initio calculations and a full two-dimensional integration of the transition matrix. We show that q* are highly anisotropic and rotate about K with the polarizer and analyzer condition relative to the lattice. The corresponding phonon-mediated electronic transitions show a finite component along K-Γ that sensitively determines q*. We invalidate the notion of “inner” and “outer” processes. The characteristic splitting of the 2D mode of graphene under uniaxial tensile strain and given polarizer and analyzer setting is correctly predicted only if the strain-induced distortion and red-shift of the in-plane transverse optical (iTO) phonon dispersion as well as the changes in the electronic band structure are taken into account.

  10. Resonance Raman assignment and evidence for noncoupling of individual 2- and 4-vinyl vibrational modes in a monomeric cyanomethemoglobin

    International Nuclear Information System (INIS)

    Gersonde, K.; Yu, N.T.; Lin, S.H.; Smith, K.M.; Parish, D.W.

    1989-01-01

    We have investigated the resonance Raman spectra of monomeric insect cyanomethemoglobins (CTT III and CTT IV) reconstituted with (1) protohemes IX selectively deuterated at the 4-vinyl as well as the 2,4-divinyls, (2) monovinyl-truncated hemes such as pemptoheme (2-hydrogen, 4-vinyl) and isopemptoheme (2-vinyl, 4-hydrogen), (3) symmetric hemes such as protoheme III (with 2- and 3-vinyls) and protoheme XIII (with 1- and 4-vinyls), and (4) hemes without 2- and 4-vinyls such as mesoheme IX, deuteroheme IX, 2,4-dimethyldeuteroheme IX, and 2,4-dibromodeuteroheme IX. Evidence is presented that the highly localized vinyl C = C stretching vibrations at the 2- and 4-positions of the heme in these cyanomet CTT hemoglobins are noncoupled and inequivalent; i.e., the 1631- and 1624-cm-1 lines have been assigned to 2-vinyl and 4-vinyl, respectively. The elimination of the 2-vinyl (in pemptoheme) or the 4-vinyl (in isopemptoheme) does not affect the C = C stretching frequency of the remaining vinyl. Furthermore, two low-frequency vinyl bending modes at 412 and 591 cm-1 exhibit greatly different resonance Raman intensities between 2-vinyl and 4-vinyl. The observed intensity at 412 cm-1 is primarily derived from 4-vinyl, whereas the 591-cm-1 line results exclusively from the 2-vinyl. Again, there is no significant coupling between 2-vinyl and 4-vinyl for these two bending modes

  11. Effects of phase and coupling between the vibrational modes on selective excitation in coherent anti-Stokes Raman scattering microscopy

    International Nuclear Information System (INIS)

    Patel, Vishesha; Malinovsky, Vladimir S.; Malinovskaya, Svetlana

    2010-01-01

    Coherent anti-Stokes Raman scattering (CARS) microscopy has been a major tool of investigation of biological structures as it contains the vibrational signature of molecules. A quantum control method based on chirped pulse adiabatic passage was recently proposed for selective excitation of a predetermined vibrational mode in CARS microscopy [Malinovskaya and Malinovsky, Opt. Lett. 32, 707 (2007)]. The method utilizes the chirp sign variation at the peak pulse amplitude and gives a robust adiabatic excitation of the desired vibrational mode. Using this method, we investigate the impact of coupling between vibrational modes in molecules on controllability of excitation of the CARS signal. We analyze two models of two coupled two-level systems (TLSs) having slightly different transitional frequencies. The first model, featuring degenerate ground states of the TLSs, gives robust adiabatic excitation and maximum coherence in the resonant TLS for positive value of the chirp. In the second model, implying nondegenerate ground states in the TLSs, a population distribution is observed in both TLSs, resulting in a lack of selectivity of excitation and low coherence. It is shown that the relative phase and coupling between the TLSs play an important role in optimizing coherence in the desired vibrational mode and suppressing unwanted transitions in CARS microscopy.

  12. Parametric FEM for geometric biomembranes

    Science.gov (United States)

    Bonito, Andrea; Nochetto, Ricardo H.; Sebastian Pauletti, M.

    2010-05-01

    We consider geometric biomembranes governed by an L2-gradient flow for bending energy subject to area and volume constraints (Helfrich model). We give a concise derivation of a novel vector formulation, based on shape differential calculus, and corresponding discretization via parametric FEM using quadratic isoparametric elements and a semi-implicit Euler method. We document the performance of the new parametric FEM with a number of simulations leading to dumbbell, red blood cell and toroidal equilibrium shapes while exhibiting large deformations.

  13. New Method to Study the Vibrational Modes of Biomolecules in the Terahertz Range Based on a Single-Stage Raman Spectrometer.

    Science.gov (United States)

    Kalanoor, Basanth S; Ronen, Maria; Oren, Ziv; Gerber, Doron; Tischler, Yaakov R

    2017-03-31

    The low-frequency vibrational (LFV) modes of biomolecules reflect specific intramolecular and intermolecular thermally induced fluctuations that are driven by external perturbations, such as ligand binding, protein interaction, electron transfer, and enzymatic activity. Large efforts have been invested over the years to develop methods to access the LFV modes due to their importance in the studies of the mechanisms and biological functions of biomolecules. Here, we present a method to measure the LFV modes of biomolecules based on Raman spectroscopy that combines volume holographic filters with a single-stage spectrometer, to obtain high signal-to-noise-ratio spectra in short acquisition times. We show that this method enables LFV mode characterization of biomolecules even in a hydrated environment. The measured spectra exhibit distinct features originating from intra- and/or intermolecular collective motion and lattice modes. The observed modes are highly sensitive to the overall structure, size, long-range order, and configuration of the molecules, as well as to their environment. Thus, the LFV Raman spectrum acts as a fingerprint of the molecular structure and conformational state of a biomolecule. The comprehensive method we present here is widely applicable, thus enabling high-throughput study of LFV modes of biomolecules.

  14. Entropy squeezing for a two-level atom in two-mode Raman coupled model with intrinsic decoherence

    Institute of Scientific and Technical Information of China (English)

    Zhang Jian; Shao Bin; Zou Jian

    2009-01-01

    In this paper,we investigate the entropy squeezing for a two-level atom interacting with two quantized fields through Raman coupling.We obtain the dynamical evolution of the total system under the influence of intrinsic decoherence when the two quantized fields are prepared in a two-mode squeezing vacuum state initially.The effects of the field squeezing factor,the two-level atomic transition frequency,the second field frequency and the intrinsic decoherence on the entropy squeezing are discussed.Without intrinsic decoherence,the increase of field squeezing factor can break the entropy squeezing.The two-level atomic transition frequency changes only the period of oscillation but not the strength of entropy squeezing.The influence of the second field frequency is complicated.With the intrinsic decoherence taken into consideration,the results show that the stronger the intrinsic decoherence is,the more quickly the entropy squeezing will disappear.The increase of the atomic transition frequency can hasten the disappearance of entropy squeezing.

  15. Entropy squeezing for a two-level atom in two-mode Raman coupled model with intrinsic decoherence

    International Nuclear Information System (INIS)

    Jian, Zhang; Bin, Shao; Jian, Zou

    2009-01-01

    In this paper, we investigate the entropy squeezing for a two-level atom interacting with two quantized fields through Raman coupling. We obtain the dynamical evolution of the total system under the influence of intrinsic decoherence when the two quantized fields are prepared in a two-mode squeezing vacuum state initially. The effects of the field squeezing factor, the two-level atomic transition frequency, the second field frequency and the intrinsic decoherence on the entropy squeezing are discussed. Without intrinsic decoherence, the increase of field squeezing factor can break the entropy squeezing. The two-level atomic transition frequency changes only the period of oscillation but not the strength of entropy squeezing. The influence of the second field frequency is complicated. With the intrinsic decoherence taken into consideration, the results show that the stronger the intrinsic decoherence is, the more quickly the entropy squeezing will disappear. The increase of the atomic transition frequency can hasten the disappearance of entropy squeezing. (classical areas of phenomenology)

  16. Enhanced light scattering of the forbidden longitudinal optical phonon mode studied by micro-Raman spectroscopy on single InN nanowires

    International Nuclear Information System (INIS)

    Schaefer-Nolte, E O; Stoica, T; Gotschke, T; Limbach, F A; Gruetzmacher, D; Calarco, R; Sutter, E; Sutter, P

    2010-01-01

    In the literature, there are controversies on the interpretation of the appearance in InN Raman spectra of a strong scattering peak in the energy region of the unscreened longitudinal optical (LO) phonons, although a shift caused by the phonon-plasmon interaction is expected for the high conductance observed in this material. Most measurements on light scattering are performed on ensembles of InN nanowires (NWs). However, it is important to investigate the behavior of individual nanowires and here we report on micro-Raman measurements on single nanowires. When changing the polarization direction of the incident light from parallel to perpendicular to the wire, the expected reduction of the Raman scattering was observed for transversal optical (TO) and E 2 phonon scattering modes, while a strong symmetry-forbidden LO mode was observed independently on the laser polarization direction. Single Mg- and Si-doped crystalline InN nanowires were also investigated. Magnesium doping results in a sharpening of the Raman peaks, while silicon doping leads to an asymmetric broadening of the LO peak. The results can be explained based on the influence of the high electron concentration with a strong contribution of the surface accumulation layer and the associated internal electric field.

  17. Enhanced Light Scattering of the Forbidden longitudinal Optical Phonon Mode Studied by Micro-Raman Spectroscopy on Single InN nanowires

    International Nuclear Information System (INIS)

    Sutter, E.; Schafer-Nolte, E.O.; Stoica, T.; Gotschke, T.; Limbach, F.A.; Sutter, P.; Grutzmacher, D.; Calarco, R.

    2010-01-01

    In the literature, there are controversies on the interpretation of the appearance in InN Raman spectra of a strong scattering peak in the energy region of the unscreened longitudinal optical (LO) phonons, although a shift caused by the phonon-plasmon interaction is expected for the high conductance observed in this material. Most measurements on light scattering are performed on ensembles of InN nanowires (NWs). However, it is important to investigate the behavior of individual nanowires and here we report on micro-Raman measurements on single nanowires. When changing the polarization direction of the incident light from parallel to perpendicular to the wire, the expected reduction of the Raman scattering was observed for transversal optical (TO) and E2 phonon scattering modes, while a strong symmetry-forbidden LO mode was observed independently on the laser polarization direction. Single Mg- and Si-doped crystalline InN nanowires were also investigated. Magnesium doping results in a sharpening of the Raman peaks, while silicon doping leads to an asymmetric broadening of the LO peak. The results can be explained based on the influence of the high electron concentration with a strong contribution of the surface accumulation layer and the associated internal electric field.

  18. Enhanced light scattering of the forbidden longitudinal optical phonon mode studied by micro-Raman spectroscopy on single InN nanowires.

    Science.gov (United States)

    Schäfer-Nolte, E O; Stoica, T; Gotschke, T; Limbach, F A; Sutter, E; Sutter, P; Grützmacher, D; Calarco, R

    2010-08-06

    In the literature, there are controversies on the interpretation of the appearance in InN Raman spectra of a strong scattering peak in the energy region of the unscreened longitudinal optical (LO) phonons, although a shift caused by the phonon-plasmon interaction is expected for the high conductance observed in this material. Most measurements on light scattering are performed on ensembles of InN nanowires (NWs). However, it is important to investigate the behavior of individual nanowires and here we report on micro-Raman measurements on single nanowires. When changing the polarization direction of the incident light from parallel to perpendicular to the wire, the expected reduction of the Raman scattering was observed for transversal optical (TO) and E(2) phonon scattering modes, while a strong symmetry-forbidden LO mode was observed independently on the laser polarization direction. Single Mg- and Si-doped crystalline InN nanowires were also investigated. Magnesium doping results in a sharpening of the Raman peaks, while silicon doping leads to an asymmetric broadening of the LO peak. The results can be explained based on the influence of the high electron concentration with a strong contribution of the surface accumulation layer and the associated internal electric field.

  19. Surface-enhanced Raman Scattering Study of the Binding Modes of a Dibenzotetraaza[14]annulene Derivative with DNA/RNA Polynucleotides

    OpenAIRE

    Miljanić, Snežana; Dijanošić, Adriana; Kalac, Matea; Radić Stojković, Marijana; Piantanida, Ivo; Pawlica, Dariusz; Eilmes, Julita

    2012-01-01

    Binding modes of a dibenzotetraaza14annulene (DBTAA) derivative with synthetic nucleic acids were studied using surface-enhanced Raman spectroscopy (SERS). Changes in SERS intensity and appearance of new bands in spectra were attributed to different complexes formed between the DBTAA molecules and DNA/RNA polynucleotides. A decrease in intensity pointed to intercalation as the dominant binding mode of the annulene derivative with poly dGdC-poly dGdC and poly rA-poly rU, whereas new bands in...

  20. Rapid Structural Design Change Evaluation with AN Experiment Based FEM

    Science.gov (United States)

    Chu, C.-H.; Trethewey, M. W.

    1998-04-01

    The work in this paper proposes a dynamic structural design model that can be developed in a rapid fashion. The approach endeavours to produce a simplified FEM developed in conjunction with an experimental modal database. The FEM is formulated directly from the geometry and connectivity used in an experimental modal test using beam/frame elements. The model sacrifices fine detail for a rapid development time. The FEM is updated at the element level so the dynamic response replicates the experimental results closely. The physical attributes of the model are retained, making it well suited to evaluate the effect of potential design changes. The capabilities are evaluated in a series of computational and laboratory tests. First, a study is performed with a simulated cantilever beam with a variable mass and stiffness distribution. The modal characteristics serve as the updating target with random noise added to simulate experimental uncertainty. A uniformly distributed FEM is developed and updated. The results show excellent results, all natural frequencies are within 0·001% with MAC values above 0·99. Next, the method is applied to predict the dynamic changes of a hardware portal frame structure for a radical design change. Natural frequency predictions from the original FEM differ by as much as almost 18% with reasonable MAC values. The results predicted from the updated model produce excellent results when compared to the actual hardware changes, the first five modal natural frequency difference is around 5% and the corresponding mode shapes producing MAC values above 0·98.

  1. Transverse stress induced LP 02-LP 21 modal interference of stimulated Raman scattered light in a few-mode optical fiber

    Science.gov (United States)

    Sharma, A.; Posey, R.

    1996-02-01

    Four-photon mixing followed by stimulated Raman scattering is observed in LP 02 mode in a 7.9 μm core diameter optical fiber. A localized transverse stress efficiency couples LP 02 to the LP 21 mode with a macroscopic beat length of 1.8 mm. LP 02-LP 21 modal interference is investigated by detecting the 550-590 nm SRS through a pinhole in the far field exit plane. Quantitative explanation of wavelength dependent intensity modulation results in a precise experimental determination of {∂[β 02(λ) - β 21(λ)] }/{∂λ}, for mode-propagation constants β02( λ) and β21( λ) of LP 02 and LP 21 modes respectively, as well as Δ, the relative core-cladding refractive index difference. The LP 02-LP 21 modal interference is used for sensing of temperature between 50-300°C.

  2. Measurement of the surface-enhanced coherent anti-Stokes Raman scattering (SECARS) due to the 1574 cm(-1) surface-enhanced Raman scattering (SERS) mode of benzenethiol using low-power (CW diode lasers.

    Science.gov (United States)

    Aggarwal, Roshan L; Farrar, Lewis W; Greeneltch, Nathan G; Van Duyne, Richard P; Polla, Dennis L

    2013-02-01

    The surface-enhanced coherent anti-Stokes Raman scattering (SECARS) from a self-assembled monolayer (SAM) of benzenethiol on a silver-coated surface-enhanced Raman scattering (SERS) substrate has been measured for the 1574 cm(-1) SERS mode. A value of 9.6 ± 1.7×10(-14) W was determined for the resonant component of the SECARS signal using 17.8 mW of 784.9 nm pump laser power and 7.1 mW of 895.5 nm Stokes laser power; the pump and Stokes lasers were polarized parallel to each other but perpendicular to the grooves of the diffraction grating in the spectrometer. The measured value of resonant component of the SECARS signal is in agreement with the calculated value of 9.3×10(-14) W using the measured value of 8.7 ± 0.5 cm(-1) for the SERS linewidth Γ (full width at half-maximum) and the value of 5.7 ± 1.4×10(-7) for the product of the Raman cross section σSERS and the surface concentration Ns of the benzenethiol SAM. The xxxx component of the resonant part of the third-order nonlinear optical susceptibility |3 χxxxx((3)R)| for the 1574 cm(-1) SERS mode has been determined to be 4.3 ± 1.1×10(-5) cm·g(-1)·s(2). The SERS enhancement factor for the 1574 cm(-1) mode was determined to be 3.6 ± 0.9×10(7) using the value of 1.8×10(15) molecules/cm(2) for Ns.

  3. Effect of pressure on the Raman-active modes of zircon (ZrSiO4): a first-principles study

    Science.gov (United States)

    Sheremetyeva, Natalya; Cherniak, Daniele J.; Watson, E. Bruce; Meunier, Vincent

    2018-02-01

    Density-functional theory (DFT) was employed in a first-principles study of the effects of pressure on the Raman-active modes of zircon (ZrSiO4), using both the generalized gradient and local density approximations (GGA and LDA, respectively). Beginning with the equilibrium structure at zero pressure, we conducted a calibration of the effect of pressure in a manner procedurally similar to an experimental calibration. For pressures between 0 and 7 GPa, we find excellent qualitative agreement of frequency-pressure slopes partial ω /partial P calculated from GGA DFT with results of previous experimental studies. In addition, we were able to rationalize the ω vs. P behavior based on details of the vibrational modes and their atomic displacements. Most of the partial ω /partial P slopes are positive as expected, but the symmetry of the zircon lattice also results in two negative slopes for modes that involve slight shearing and rigid rotation of SiO4 tetrahedra. Overall, LDA yields absolute values of the frequencies of the Raman-active modes in good agreement with experimental values, while GGA reproduces the shift in frequency with pressure especially well.

  4. Vibrational normal modes of diazo-dimedone: A comparative study by Fourier infrared/Raman spectroscopies and conformational analysis by MM/QM

    Science.gov (United States)

    Téllez Soto, C. A.; Ramos, J. M.; Rianelli, R. S.; de Souza, M. C. B. V.; Ferreira, V. F.

    2007-07-01

    The 2-diazo-5,5-dimethyl-cyclohexane-1,3-dione ( 3) was synthesized and the FT-IR/Raman spectra were measured with the purpose of obtain a full assignment of the vibrational modes. Singular aspects concerning the -C dbnd N dbnd N oscillator are discussed in view of two strong bands observed in the region of 2300-2100 cm -1 in both, Infrared and Raman spectra. The density functional theory (DFT) was used to obtain the geometrical structure and for assisting in the vibrational assignment joint to the traditional normal coordinate analysis (NCA). The observed wavenumbers at 2145 (IR), 2144(R) are assigned as the coupled ν(N dbnd N) + ν(C dbnd N) vibrational mode with higher participation of the N dbnd N stretching. A 2188 cm -1 (IR) and at 2186 cm -1 (R) can be assigned as a overtone of one of ν(CC) normal mode or to a combination band of the fundamentals δ(CCH) found at 1169 cm -1 and the δ (CC dbnd N) found at 1017 cm -1 enhanced by Fermi resonance.

  5. Raman spectroscopy, electronic microscopy and SPME-GC-MS to elucidate the mode of action of a new antimicrobial food packaging material.

    Science.gov (United States)

    Clemente, Isabel; Aznar, Margarita; Salafranca, Jesús; Nerín, Cristina

    2017-02-01

    One critical challenge when developing a new antimicrobial packaging material is to demonstrate the mode of action of the antimicrobials incorporated into the packaging. For this task, several analytical techniques as well as microbiology are required. In this work, the antimicrobial properties of benzyl isothiocyanate, allyl isothiocyanate and essential oils of cinnamon and oregano against several moulds and bacteria have been evaluated. Benzyl isothiocyanate showed the highest antimicrobial activity and it was selected for developing the new active packaging material. Scanning electron microscopy and Raman spectroscopy were successfully used to demonstrate the mode of action of benzyl isothiocyanate on Escherichia coli. Bacteria exhibited external modifications such as oval shape and the presence of septum surface, but they did not show any disruption or membrane damage. To provide data on the in vitro action of benzyl isothiocyanate and the presence of inhibition halos, the transfer mechanism to the cells was assessed using solid-phase microextraction-gas chromatography-mass spectrometry. Based on the transfer system, action mechanism and its stronger antimicrobial activity, benzyl isothiocyanate was incorporated to two kinds of antimicrobial labels. The labels were stable and active for 140 days against two mould producers of ochratoxin A; Penicillium verrucosum is more sensitive than Aspergillus ochraceus. Details about the analytical techniques and the results obtained are shown and discussed. Graphical Abstract Antimicrobial evaluation of pure compounds, incorporation in the packaging and study for mode of action on S. coli by Raman, SEM and SPME-GC-MS.

  6. Unconventional material part FEM analysis

    Directory of Open Access Journals (Sweden)

    Michal TROPP

    2016-12-01

    Full Text Available The article covers the usability of alternative materials in vehicles construction. The paper elaborates upon the setup of the process and analysis of the results of carbon composite component FEM model. The 3D model, used for the examination, is a part of axle from alternative small electric vehicle. The analysis was conducted with the help of MSC Adams and Ansys Workbench software. Color maps of von Mises stress in material and total deformations of the component are the results of calculation.

  7. Raman dispersion spectroscopy on the highly saddled nickel(II)-octaethyltetraphenylporphyrin reveals the symmetry of nonplanar distortions and the vibronic coupling strength of normal modes

    International Nuclear Information System (INIS)

    Schweitzer-Stenner, R.; Stichternath, A.; Dreybrodt, W.; Jentzen, W.; Song, X.; Shelnutt, J.A.; Nielsen, O.F.; Medforth, C.J.; Smith, K.M.

    1997-01-01

    We have measured the polarized Raman cross sections and depolarization ratios of 16 fundamental modes of nickel octaethyltetraphenylporphyrin in a CS 2 solution for 16 fundamental modes, i.e., the A 1g -type vibrations ν 1 , ν 2 , ν 3 , ν 4 , ν 5 , and φ 8 , the B 1g vibrations ν 11 and ν 14 , the B 2g vibrations ν 28 , ν 29 , and ν 30 and the antisymmetric A 2g modes ν 19 , ν 20 , ν 22 , and ν 23 as function of the excitation wavelength. The data cover the entire resonant regions of the Q- and B-bands. They were analyzed by use of a theory which describes intra- and intermolecular coupling in terms of a time-independent nonadiabatic perturbation theory [E. Unger, U. Bobinger, W. Dreybrodt, and R. Schweitzer-Stenner, J. Phys. Chem. 97, 9956 (1993)]. This approach explicitly accounts in a self-consistent way for multimode mixing with all Raman modes investigated. The vibronic coupling parameters obtained from this procedure were then used to successfully fit the vibronic side bands of the absorption spectrum and to calculate the resonance excitation profiles in absolute units. Our results show that the porphyrin macrocycle is subject to B 2u -(saddling) and B 1u -(ruffling) distortions which lower its symmetry to S 4 . Thus, evidence is provided that the porphyrin molecule maintains the nonplanar structure of its crystal phase in an organic solvent. The vibronic coupling parameters indicate a breakdown of the four-orbital model. This notion is corroborated by (ZINDO/S) calculations which reveal that significant configurational interaction occurs between the electronic transitions into |Q right-angle- and |1B right-angle-states and various porphyrin→porphyrin, metal→porphyrin, and porphyrin→metal transitions. (Abstract Truncated)

  8. Large-area, uniform and low-cost dual-mode plasmonic naked-eye colorimetry and SERS sensor with handheld Raman spectrometer.

    Science.gov (United States)

    Xu, Zhida; Jiang, Jing; Wang, Xinhao; Han, Kevin; Ameen, Abid; Khan, Ibrahim; Chang, Te-Wei; Liu, Gang Logan

    2016-03-21

    We demonstrated a highly-sensitive, wafer-scale, highly-uniform plasmonic nano-mushroom substrate based on plastic for naked-eye plasmonic colorimetry and surface-enhanced Raman spectroscopy (SERS). We gave it the name FlexBrite. The dual-mode functionality of FlexBrite allows for label-free qualitative analysis by SERS with an enhancement factor (EF) of 10(8) and label-free quantitative analysis by naked-eye colorimetry with a sensitivity of 611 nm RIU(-1). The SERS EF of FlexBrite in the wet state was found to be 4.81 × 10(8), 7 times stronger than in the dry state, making FlexBrite suitable for aqueous environments such as microfluid systems. The label-free detection of biotin-streptavidin interaction by both SERS and colorimetry was demonstrated with FlexBrite. The detection of trace amounts of the narcotic drug methamphetamine in drinking water by SERS was implemented with a handheld Raman spectrometer and FlexBrite. This plastic-based dual-mode nano-mushroom substrate has the potential to be used as a sensing platform for easy and fast analysis in chemical and biological assays.

  9. Possibility of 1-nm level localization of a single molecule with gap-mode surface-enhanced Raman scattering

    International Nuclear Information System (INIS)

    Choi, Han Kyu; Kim, Zee Hwan

    2015-01-01

    The electromagnetic (EM) enhancement mechanism of surface-enhanced Raman scattering (SERS) has been well established through 30 years of extensive investigation: molecules adsorbed on resonantly driven silver or gold nanoparticles (NPs) experience strongly enhanced field and thus show enhanced Raman scattering. Even stronger SERS enhancement is possible with a gap structure in which two or more NPs form assemblies with gap sizes of 1 nm or less. We have theoretically shown that the measurement of SERS angular distribution can reveal the position of a single molecule near the gap with 1-nm accuracy, even though the spatial extent of the enhanced field is ~10 nm. Real implementation of such experiment requires extremely well-defined (preferably a single crystal) dimeric junctions. Nevertheless, the experiment will provide spatial as well as frequency domain information on single-molecule dynamics at metallic surfaces

  10. Noticeable red emission and Raman active modes in nanoscale gadolinium oxyfluoride (Gd4O3F6) systems with Eu3+ inclusion

    International Nuclear Information System (INIS)

    Hazarika, Samiran; Mohanta, Dambarudhar

    2017-01-01

    Eu 3+ doped gadolinium oxyfluoride (Gd 4 O 3 F 6 , GOF) nanoscale systems have been synthesized following a modified Pechini method. While exhibiting a tetragonal crystal structure, the GOF nanosystem gave an average crystallite size (d) of ∝21-26 nm. The Lotgering factor (L F ), which is a measure of orientation of crystallites along the preferred direction was found to vary between 0.22 and 0.48. In the photoluminescence spectra, ∝595 and ∝613 nm peaks were identified as magnetically driven ( 5 D 0 → 7 F 1 ) and electrically driven ( 5 D 0 → 7 F 2 ) transitions with latter (red emission) being strongly manifested with Eu 3+ doping concentration and intrinsic defects. Moreover, several Raman active modes have been probed in the Raman spectra with low frequency peaks (<300 cm -1 ) and moderate frequency peaks (∝481 and 567 cm -1 ) assigned to observable vibration of heavy atom Gd-Gd pairs and Gd-O groups, respectively. Apart from manifestation of phononic features, inclusion of Eu 3+ in the host lattice would bring new insight on improving the red emission response prior to concentration quenching. (orig.)

  11. Lattice parameters and Raman-active phonon modes of β-(Al{sub x}Ga{sub 1−x}){sub 2}O{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Kranert, Christian, E-mail: christian.kranert@uni-leipzig.de; Jenderka, Marcus; Lenzner, Jörg; Lorenz, Michael; Wenckstern, Holger von; Schmidt-Grund, Rüdiger; Grundmann, Marius [Institut für Experimentelle Physik II, Universität Leipzig, Halbleiterphysik, Linnéstr. 5, 04103 Leipzig (Germany)

    2015-03-28

    We present X-ray diffraction and Raman spectroscopy investigations of a (100)-oriented (Al{sub x}Ga{sub 1–x}){sub 2}O{sub 3} thin film on MgO (100) and bulk-like ceramics in dependence on their composition. The thin film grown by pulsed laser deposition has a continuous lateral composition spread allowing to determine precisely the dependence of the phonon mode properties and lattice parameters on the chemical composition. For x < 0.4, we observe the single-phase β-modification. Its lattice parameters and phonon energies depend linearly on the composition. We determined the slopes of these dependencies for the individual lattice parameters and for nine Raman lines, respectively. While the lattice parameters of the ceramics follow Vegard's rule, deviations are observed for the thin film. This deviation has only a small effect on the phonon energies, which show a reasonably good agreement between thin film and ceramics.

  12. ITER Plasma at Ion Cyclotron Frequency Domain: The Fusion Alpha Particles Diagnostics Based on the Stimulated Raman Scattering of Fast Magnetosonic Wave off High Harmonic Ion Bernstein Modes

    Science.gov (United States)

    Stefan, V. Alexander

    2014-10-01

    A novel method for alpha particle diagnostics is proposed. The theory of stimulated Raman scattering, SRS, of the fast wave and ion Bernstein mode, IBM, turbulence in multi-ion species plasmas, (Stefan University Press, La Jolla, CA, 2008). is utilized for the diagnostics of fast ions, (4)He (+2), in ITER plasmas. Nonlinear Landau damping of the IBM on fast ions near the plasma edge leads to the space-time changes in the turbulence level, (inverse alpha particle channeling). The space-time monitoring of the IBM turbulence via the SRS techniques may prove efficient for the real time study of the fast ion velocity distribution function, spatial distribution, and transport. Supported by Nikola Tesla Labs., La Jolla, CA 92037.

  13. 3.05 kW monolithic fiber laser oscillator with simultaneous optimizations of stimulated Raman scattering and transverse mode instability

    Science.gov (United States)

    Yang, Baolai; Zhang, Hanwei; Shi, Chen; Tao, Rumao; Su, Rongtao; Ma, Pengfei; Wang, Xiaolin; Zhou, Pu; Xu, Xiaojun; Lu, Qisheng

    2018-01-01

    We report a high power monolithic ytterbium-doped fiber laser oscillator with an output power of 3.05 kW, which is achieved by simultaneous optimizations of the stimulated Raman scattering (SRS) and transverse mode instability (TMI). The optimizations of the SRS are designed and utilized in the construction of the fiber laser oscillator, while the TMI threshold is optimized with the study of the dependence of TMI threshold on the pump distribution. In the fiber laser oscillator, the TMI threshold is enhanced by ˜30% when the counter-pump scheme is employed instead of the co-pump scheme. By applying bidirectional-pump scheme and appropriately distributing the pump power, the TMI threshold is further enhanced and the monolithic fiber laser oscillator achieves an output power of 3.05 kW with near diffraction limited beam quality.

  14. Red shifts of the Eg(1) Raman mode of nanocrystalline TiO2:Er monoliths grown by sol-gel process

    Science.gov (United States)

    Palomino-Merino, R.; Trejo-Garcia, P.; Portillo-Moreno, O.; Jiménez-Sandoval, S.; Tomás, S. A.; Zelaya-Angel, O.; Lozada-Morales, R.; Castaño, V. M.

    2015-08-01

    Nanocrystalline monoliths of Er doped TiO2 were prepared by the sol-gel technique, by controlling the Er-doping levels into the TiO2 precursor solution. As-prepared and annealed in air samples showed the anatase TiO2 phase. The average diameter of the nanoparticles ranged from 19 to 2.6 nm as the nominal concentration of Er varies from 0% to 7%, as revealed by EDS analysis in an electron microscope. Photo Acoustic Spectroscopy (PAS) allowed calculate the forbidden band gap, evidencing an absorption edge at around 300 nm, attributed to TiO2 and evidence of electronic transitions or Er3+. The Raman spectra, corresponding to the anatase phase, show the main phonon mode Eg(1) band position at 144 cm-1 with a red shift for the annealing samples.

  15. FEM-2D - Input description and performance

    International Nuclear Information System (INIS)

    Schmidt, F.A.R.

    1975-03-01

    FEM-2D solves the 2d diffusion equation by the Finite Element Method. This version of the code was written for x-y geometry, triangular elements with first and second order flux approximations, and has a solution routine which is based on a modified Cholesky procedure. FEM-2D is fully integrated into the modular system RSYST. However, we have developed a simulation program RSIMK which simulates some of the functions of RSYST and allows to run FEM-2D independently. (orig.) [de

  16. Resonance Raman spectra of phthalocyanine monolayers on different supports. A normal mode analysis of zinc phthalocyanine by means of the MNDO method

    NARCIS (Netherlands)

    Palys, Barbara J.; van den Ham, Dirk M.W.; van den Ham, D.M.W.; Briels, Willem J.; Feil, D.; Feil, Dirk

    1995-01-01

    Resonance Raman spectra of monolayers of transition metal phthalocyanines reveal specific interaction with the support. To elucidate its mechanism, Raman spectra of zinc phthalocyanine monolayers were studied. The analysis was based largely on the results of MNDO calculations. Calculated wavenumbers

  17. A temperature dependent study of the Raman-active phonon modes in Ca and Zn doped YBa2Cu3O7-x

    International Nuclear Information System (INIS)

    Quilty, J. W.; Trodahl, H. J.; Simpson, A.; Flower, N.; Staines, M.; Downes, J.

    1996-01-01

    Full text: The temperature dependent behaviour of the phonon modes in YBa 2 Cu 3 O 7-x (Y-123) are of interest because the strong electron-phonon coupling within these materials yields information about the magnitude of the superconducting gap. The opening of a gap provides a new decay route for phonons, hence phonons near the gap energy show changes in their frequencies and widths as the temperature drops below T c . The magnitude of the superconducting gap may be estimated from these changes. We report our temperature-dependent measurements of the Raman-active phonon modes in ceramic and preferentially oriented polycrystalline samples of Y-123, under a variety of doping regimes. The samples were made underdoped, optimally doped and overdoped by manipulation of the hole concentration on the Cu-O planes, achieved by changing the oxygen stoichiometry, substitution of Zn for Cu, and substitution of Ca for Y. As observed by others, the 340cm -1 phonon, involving vibrations of the oxygen ions on the Cu-O planes, showed the greatest magnitude of change when the samples were cooled below T c , indicating that the superconducting gap energy is close to that of the 340cm -1 phonon

  18. Reconstructing skeletal fiber arrangement and growth mode in the coral Porites lutea (Cnidaria, Scleractinia: a confocal Raman microscopy study

    Directory of Open Access Journals (Sweden)

    G. Nehrke

    2012-11-01

    Full Text Available Confocal Raman microscopy (CRM mapping was used to investigate the microstructural arrangement and organic matrix distribution within the skeleton of the coral Porites lutea. Relative changes in the crystallographic orientation of crystals within the fibrous fan-system could be mapped, without the need to prepare thin sections, as required if this information is obtained by polarized light microscopy. Simultaneously, incremental growth lines can be visualized without the necessity of etching and hence alteration of sample surface. Using these methods two types of growth lines could be identified: one corresponds to the well-known incremental growth layers, whereas the second type of growth lines resemble denticle finger-like structures (most likely traces of former spines or skeletal surfaces. We hypothesize that these lines represent the outer skeletal surface before another growth cycle of elongation, infilling and thickening of skeletal areas continues. We show that CRM mapping with high spatial resolution can significantly improve our understanding of the micro-structural arrangement and growth patterns in coral skeletons.

  19. MODAL ANALYSIS FOR REVISION OF A FEM MODEL OF A STEEL TRUSS BEAM

    Directory of Open Access Journals (Sweden)

    Michal Venglar

    2017-11-01

    Full Text Available The paper deals with a preparation of a complex FEM model for a local damage detection. The initial verified and validated three-dimensional FEM model of a steel truss bridge in laboratory is revised step-by-step to achieve the accurate model according to the experimental model. The emphasis is on modelling of the joints with 4 rivets and modelling of correct boundary conditions, as well as mass parameters and cross-section dimensions.A modal analysis of the structure is performed in FEM software. Many experimental measurements were made to correctly revise the FEM model. The calculated natural frequencies are compared with the measured ones. In addition, mode-shapes from the calculation are validated with the measured mode-shapes. The difference between the prepared FEM model and the measured specimen is small enough after a few steps of tuning. The verified, validated and revised numerical model can be used in future for a local damage detection.

  20. Simultaneous measurements of global vibrational spectra and dephasing times of molecular vibrational modes by broadband time-resolved coherent anti-Stokes Raman scattering spectrography

    International Nuclear Information System (INIS)

    Yin Jun; Yu Ling-Yao; Liu Xing; Wan Hui; Lin Zi-Yang; Niu Han-Ben

    2011-01-01

    In broadband coherent anti-Stokes Raman scattering (CARS) spectroscopy with supercontinuum (SC), the simultaneously detectable spectral coverage is limited by the spectral continuity and the simultaneity of various spectral components of SC in an enough bandwidth. By numerical simulations, the optimal experimental conditions for improving the SC are obtained. The broadband time-resolved CARS spectrography based on the SC with required temporal and spectral distributions is realised. The global molecular vibrational spectrum with well suppressed nonresonant background noise can be obtained in a single measurement. At the same time, the measurements of dephasing times of various molecular vibrational modes can be conveniently achieved from intensities of a sequence of time-resolved CARS signals. It will be more helpful to provide a complete picture of molecular vibrations, and to exhibit a potential to understand not only both the solvent dynamics and the solute-solvent interactions, but also the mechanisms of chemical reactions in the fields of biology, chemistry and material science. (electromagnetism, optics, acoustics, heat transfer, classical mechanics, and fluid dynamics)

  1. Effect of Cr-N codoping on structural phase transition, Raman modes, and optical properties of TiO2 nanoparticles

    Science.gov (United States)

    Hassnain Jaffari, G.; Tahir, Adnan; Ali, Naveed Zafar; Ali, Awais; Qurashi, Umar S.

    2018-04-01

    Noncompensated cation-anion codoping in TiO2 nanoparticles has been achieved by a chemical synthesis route. Significant reduction in the optical bandgap and enhancement in the absorption of visible light have been observed. Structural phase transformation has been tracked in detail as a function of doping and heat treatment temperature. Anatase to rutile phase transition temperature for doped samples was higher in comparison to the pure TiO2 nanoparticles. Nitrogen and chromium addition increases the phase transformation barrier, where the effect of the former dopant is of more significance. The Raman results showed an increase in the oxygen content with higher post annealing temperatures. With Cr incorporation, the peak associated with the Eg mode has been found to shift towards a higher wave number, while with nitrogen incorporation, the shift was towards a lower wave number. A decrease in reflectance with N co-doping for all samples, irrespective of phase and annealing temperatures, has been observed. In compositions with nitrogen of the same content, bandgap reduction was higher in the rutile phase in comparison to the anatase phase. In general, overall results revealed that with a higher loading fraction of ammonia, the N content increases, while Cr addition prevents nitrogen loss even up to high post annealing temperatures, i.e., 850 °C.

  2. Density functional theory and Raman spectroscopy applied to structure and vibrational mode analysis of 1,1',3,3'-tetraethyl-5,5',6,6'-tetrachloro- benzimidazolocarbocyanine iodide and its aggregate.

    Science.gov (United States)

    Aydin, Metin; Dede, Özge; Akins, Daniel L

    2011-02-14

    We have measured electronic and Raman scattering spectra of 1,1',3,3'-tetraethyl-5,5',6,6'-tetrachloro-benzimidazolocarbocyanine iodide (TTBC) in various environments, and we have calculated the ground state geometric and spectroscopic properties of the TTBC cation in the gas and solution phases (e.g., bond distances, bond angles, charge distributions, and Raman vibrational frequencies) using density functional theory. Our structure calculations have shown that the ground state equilibrium structure of a cis-conformer lies ∼200 cm(-1) above that of a trans-conformer and both conformers have C(2) symmetry. Calculated electronic transitions indicate that the difference between the first transitions of the two conformers is about 130 cm(-1). Raman spectral assignments of monomeric- and aggregated-TTBC cations have been aided by density functional calculations at the same level of the theory. Vibrational mode analyses of the calculated Raman spectra reveal that the observed Raman bands above 700 cm(-1) are mainly associated with the in-plane deformation of the benzimidazolo moieties, while bands below 700 cm(-1) are associated with out-of-plane deformations of the benzimidazolo moieties. We have also found that for the nonresonance excited experimental Raman spectrum of aggregated-TTBC cation, the Raman bands in the higher-frequency region are enhanced compared with those in the nonresonance spectrum of the monomeric cation. For the experimental Raman spectrum of the aggregate under resonance excitation, however, we find new Raman features below 600 cm(-1), in addition to a significantly enhanced Raman peak at 671 cm(-1) that are associated with out-of-plane distortions. Also, time-dependent density functional theory calculations suggest that the experimentally observed electronic transition at ∼515 nm (i.e., 2.41 eV) in the absorption spectrum of the monomeric-TTBC cation predominantly results from the π → π∗ transition. Calculations are further interpreted

  3. FEM Simulation of Incremental Shear

    International Nuclear Information System (INIS)

    Rosochowski, Andrzej; Olejnik, Lech

    2007-01-01

    A popular way of producing ultrafine grained metals on a laboratory scale is severe plastic deformation. This paper introduces a new severe plastic deformation process of incremental shear. A finite element method simulation is carried out for various tool geometries and process kinematics. It has been established that for the successful realisation of the process the inner radius of the channel as well as the feeding increment should be approximately 30% of the billet thickness. The angle at which the reciprocating die works the material can be 30 deg. . When compared to equal channel angular pressing, incremental shear shows basic similarities in the mode of material flow and a few technological advantages which make it an attractive alternative to the known severe plastic deformation processes. The most promising characteristic of incremental shear is the possibility of processing very long billets in a continuous way which makes the process more industrially relevant

  4. Raman spectroscopy an intensity approach

    CERN Document Server

    Guozhen, Wu

    2017-01-01

    This book summarizes the highlights of our work on the bond polarizability approach to the intensity analysis. The topics covered include surface enhanced Raman scattering, Raman excited virtual states and Raman optical activity (ROA). The first chapter briefly introduces the Raman effect in a succinct but clear way. Chapter 2 deals with the normal mode analysis. This is a basic tool for our work. Chapter 3 introduces our proposed algorithm for the Raman intensity analysis. Chapter 4 heavily introduces the physical picture of Raman virtual states. Chapter 5 offers details so that the readers can have a comprehensive idea of Raman virtual states. Chapter 6 demonstrates how this bond polarizability algorithm is extended to ROA intensity analysis. Chapters 7 and 8 offer details on ROA, showing many findings on ROA mechanism that were not known or neglected before. Chapter 9 introduces our proposed classical treatment on ROA which, as combined with the results from the bond polarizability analysis, leads to a com...

  5. Resonant Impulsive Stimulated Raman Scattering

    Energy Technology Data Exchange (ETDEWEB)

    Mokhtari, A; Chesnoy, J

    1988-03-15

    Using a femtosecond dye laser, we observe in real-time vibrational oscillations excited by impulsive stimulated Raman scattering (ISRS) close to an electronic resonance. We perform single-beam Raman excitation and probe the driven coherence by a polarization-sensitive detection. We demonstrate for the first time impulsively Raman-induced dichroism, birefringence as well as frequency and time delay shifts. We analyse the characteristics of resonant ISRS on a vibrational mode of a dye molecule (malachite green) in solution.

  6. Resonant Impulsive Stimulated Raman Scattering

    International Nuclear Information System (INIS)

    Mokhtari, A.; Chesnoy, J.

    1988-01-01

    Using a femtosecond dye laser, we observe in real-time vibrational oscillations excited by impulsive stimulated Raman scattering (ISRS) close to an electronic resonance. We perform single-beam Raman excitation and probe the driven coherence by a polarization-sensitive detection. We demonstrate for the first time impulsively Raman-induced dichroism, birefringence as well as frequency and time delay shifts. We analyse the characteristics of resonant ISRS on a vibrational mode of a dye molecule (malachite green) in solution

  7. Simulation of HMA compaction by using FEM

    NARCIS (Netherlands)

    ter Huerne, H.L.; van Maarseveen, M.F.A.M.; Molenaar, A.A.A.; van de Ven, M.F.C.

    2008-01-01

    This paper introduces a simulation tool for the compaction process of Hot Mix Asphalt (HMA) using a roller under varying external conditions. The focus is on the use of the Finite Element Model (FEM) with code DiekA, on its necessary requirements and on the presentation of simulation results. The

  8. FEM growth and yield data monocultures - Poplar

    NARCIS (Netherlands)

    Mohren, G.M.J.; Goudzwaard, L.; Jansen, J.J.; Oosterbaan, A.; Oldenburger, J.F.; Ouden, den J.

    2016-01-01

    The current database is part of the FEM growth and yield database, a collection of growth and yield data from even-aged monocultures (douglas fir, common oak, poplar, Japanese Larch, Norway spruce, Scots pine, Corsican pine, Austrian pine, red oak and several other species, with only a few plots,

  9. Raman spectroscopy

    Science.gov (United States)

    Raman spectroscopy has gained increased use and importance in recent years for accurate and precise detection of physical and chemical properties of food materials, due to the greater specificity and sensitivity of Raman techniques over other analytical techniques. This book chapter presents Raman s...

  10. The program FEM3D users manual

    International Nuclear Information System (INIS)

    Misfeldt, I.

    1977-11-01

    A short description of the program FEM3D that solves the three-dimensional, multigroup, neutron diffusion equation by the finite element method. The elements are box-formed Lagrange type elements of order 1, 2, or 3. The program gives very reliable results within reasonable calculation times, but it is not a fast program and should therefore mostly be used where high precision is needed. (author/BP)

  11. Alignment characterization of single-wall carbon nanotubes by Raman scattering

    International Nuclear Information System (INIS)

    Liu Pijun; Liu Liyue; Zhang Yafei

    2003-01-01

    A novel method for identifying the Raman modes of single-wall carbon nanotubes (SWNT) based on the symmetry of the vibration modes has been studied. The Raman intensity of each vibration mode varies with polarization direction, and the relationship can be expressed as analytical functions. This method avoids troublesome numerical calculation and easily gives clear relations between Raman intensity and polarization direction. In this way, one can distinguish each Raman-active mode of SWNT through the polarized Raman spectrum

  12. Self-pulsation in Raman fiber amplifiers

    DEFF Research Database (Denmark)

    Pedersen, Martin Erland Vestergaard; Ott, Johan Raunkjær; Rottwitt, Karsten

    2009-01-01

    Dynamic behavior caused by Brillouin scattering in Raman fiber amplifiers is studied. Modes of self-pulsation steady state oscillations are found. Their dependence on amplification scheme is demonstrated.......Dynamic behavior caused by Brillouin scattering in Raman fiber amplifiers is studied. Modes of self-pulsation steady state oscillations are found. Their dependence on amplification scheme is demonstrated....

  13. The application of NISA II FEM package in seismic qualification of small class IE electric motors

    International Nuclear Information System (INIS)

    Fancev, T.; Saban, I.; Grgic, D.

    1995-01-01

    According to the IEEE standards 323/1974 and 344/1975, seismic qualification of class IE equipment is appropriate combination of test and analysis methods. Complex equipment and assemblies are usually tested through seismic testing. The analysis is recommended for simple equipment that can be easily modeled to correctly predict its response. This article deals with the application of NISA II FEM package in 3D FE modeling and mode shape calculations of small power low voltage electric motors. (author)

  14. Raman facility

    Data.gov (United States)

    Federal Laboratory Consortium — Raman scattering is a powerful light scattering technique used to diagnose the internal structure of molecules and crystals. In a light scattering experiment, light...

  15. Spacetime Discontinuous Galerkin FEM: Spectral Response

    International Nuclear Information System (INIS)

    Abedi, R; Omidi, O; Clarke, P L

    2014-01-01

    Materials in nature demonstrate certain spectral shapes in terms of their material properties. Since successful experimental demonstrations in 2000, metamaterials have provided a means to engineer materials with desired spectral shapes for their material properties. Computational tools are employed in two different aspects for metamaterial modeling: 1. Mircoscale unit cell analysis to derive and possibly optimize material's spectral response; 2. macroscale to analyze their interaction with conventional material. We compare two different approaches of Time-Domain (TD) and Frequency Domain (FD) methods for metamaterial applications. Finally, we discuss advantages of the TD method of Spacetime Discontinuous Galerkin finite element method (FEM) for spectral analysis of metamaterials

  16. Evaluation of optoelectronic response and Raman active modes in Tb{sup 3+} and Eu{sup 3+}-doped gadolinium oxide (Gd{sub 2}O{sub 3}) nanoparticle systems

    Energy Technology Data Exchange (ETDEWEB)

    Paul, Nibedita [National Institute of Technology Nagaland, Department of Physics, Dimapur, Nagaland (India); Tezpur University, Department of Physics, Tezpur, Assam (India); Mohanta, D. [Tezpur University, Department of Physics, Tezpur, Assam (India)

    2016-09-15

    Rare earth oxide (Tb{sup 3+}:Gd{sub 2}O{sub 3} and Eu{sup 3+}:Gd{sub 2}O{sub 3}) nanophosphors are exploited through spectroscopic and microscopic tools with special emphasis on D-F mediated radiative emission and Raman active vibrational modes. Powder X-ray diffraction measurements have revealed cubic crystal structure of the nanosystems and with an average crystallite size varying between ∝3.2 and 4.8 nm. Photoluminescence (PL) spectra of Tb{sup 3+} doped systems signify intense blue-green (∝490 nm) and green (∝544 nm) emissions mediated by {sup 5}D{sub 4} → {sup 7}F{sub 6} and {sup 5}D{sub 4} → {sup 7}F{sub 5} transitional events; respectively. In the PL responses of Eu{sup 3+} doped nanoparticle systems, we also identify magnetically-driven {sup 5}D{sub 0} → {sup 7}F{sub 1} (∝591 nm) and electrically driven {sup 5}D{sub 0} → {sup 7}F{sub 2} (∝619 nm) radiative features which seem to improve with increasing doping level. However, the magnitude of Judd-Ofelt (J-O) intensity parameters (Ω {sub 2,} {sub 4}), is significantly lowered for the high doping cases. Raman spectra of the undoped and RE doped systems exhibited several A{sub g} and F{sub g} modes in the range of Raman shift ∝100-600 cm{sup -1}. In the Raman spectra, the peaks located at ∝355 cm{sup -1} are assigned to the mixed mode of F{sub g} + A{sub g}, the line width of which was found to increase with RE doping. Moreover, owing to the enhanced defect concentration in the doped systems than its undoped counterpart, we anticipate a faster phonon relaxation and consequently, a suppression of phonon lifetime in the former case. (orig.)

  17. Accuracy of FEM 3-D modeling in the electromagnetic methods; Denjiho ni okeru FEM 3 jigen modeling no seido

    Energy Technology Data Exchange (ETDEWEB)

    Sasaki, Y [Kyushu University, Fukuoka (Japan). Faculty of Engineering

    1996-10-01

    Analytical methods considering 3-D resistivity distribution, in particular, finite element method (FEM) were studied to improve the reliability of electromagnetic exploration. Integral equation, difference calculus, FEM and hybrid method are generally used as computational 3-D modeling method. FEM is widely used in various fields because FEM can easily handle complicated shapes and boundaries. However, in electromagnetic method, the assumption of continuous electric field is pointed out as important problem. The normal (orthogonal) component of current density should be continuous at the boundary between media with different conductivities, while this means that the normal component of electric field is discontinuous. In FEM, this means that current channeling is not properly considered, resulting in poor accuracy. Unless this problem is solved, FEM modeling is not practical. As one of the solutions, it is promising to specifically incorporate interior boundary conditions into element equation. 4 refs., 11 figs.

  18. A low-cost Raman spectrometer design used to study Raman ...

    Indian Academy of Sciences (India)

    Unknown

    The paper discusses the design of a low cost Raman spectrometer. ... system. We observe both the radial-breathing mode (RBM) and the tangential mode ... broadened due to the inherent tube diameter distribution present in the material.

  19. Raman Spectroscopy for Homeland Security Applications

    Directory of Open Access Journals (Sweden)

    Gregory Mogilevsky

    2012-01-01

    Full Text Available Raman spectroscopy is an analytical technique with vast applications in the homeland security and defense arenas. The Raman effect is defined by the inelastic interaction of the incident laser with the analyte molecule’s vibrational modes, which can be exploited to detect and identify chemicals in various environments and for the detection of hazards in the field, at checkpoints, or in a forensic laboratory with no contact with the substance. A major source of error that overwhelms the Raman signal is fluorescence caused by the background and the sample matrix. Novel methods are being developed to enhance the Raman signal’s sensitivity and to reduce the effects of fluorescence by altering how the hazard material interacts with its environment and the incident laser. Basic Raman techniques applicable to homeland security applications include conventional (off-resonance Raman spectroscopy, surface-enhanced Raman spectroscopy (SERS, resonance Raman spectroscopy, and spatially or temporally offset Raman spectroscopy (SORS and TORS. Additional emerging Raman techniques, including remote Raman detection, Raman imaging, and Heterodyne imaging, are being developed to further enhance the Raman signal, mitigate fluorescence effects, and monitor hazards at a distance for use in homeland security and defense applications.

  20. An Anomalous Enhancement of the A(g)(2) Mode in the Resonance Raman Spectra of C-60 Embedded in Single-Walled Carbon Nanotubes during Anodic Charging

    Czech Academy of Sciences Publication Activity Database

    Kalbáč, Martin; Zólyomi, V.; Rusznyák, A.; Koltai, J.; Kürti, J.; Kavan, Ladislav

    2010-01-01

    Roč. 114, č. 6 (2010), 2505-2511 ISSN 1932-7447 R&D Projects: GA AV ČR IAA400400804; GA AV ČR IAA400400911; GA AV ČR KAN200100801; GA ČR GC203/07/J067 Institutional research plan: CEZ:AV0Z40400503 Keywords : spectroelectrochemie * Raman spectra * SWNT Subject RIV: CG - Electrochemistry Impact factor: 4.520, year: 2010

  1. Raman spectra of lithium compounds

    Science.gov (United States)

    Gorelik, V. S.; Bi, Dongxue; Voinov, Y. P.; Vodchits, A. I.; Gorshunov, B. P.; Yurasov, N. I.; Yurasova, I. I.

    2017-11-01

    The paper is devoted to the results of investigating the spontaneous Raman scattering spectra in the lithium compounds crystals in a wide spectral range by the fibre-optic spectroscopy method. We also present the stimulated Raman scattering spectra in the lithium hydroxide and lithium deuteride crystals obtained with the use of powerful laser source. The symmetry properties of the lithium hydroxide, lithium hydroxide monohydrate and lithium deuteride crystals optical modes were analyzed by means of the irreducible representations of the point symmetry groups. We have established the selection rules in the Raman and infrared absorption spectra of LiOH, LiOH·H2O and LiD crystals.

  2. Financial security for women -- Fem Consult congress.

    Science.gov (United States)

    1996-01-01

    The nongovernmental organization "Fem Consult," which seeks to strengthen the socioeconomic position of women by applying a gender perspective to programs and projects in developing countries, celebrated its 10th anniversary in 1996 by holding a conference in the Netherlands on financial security for women in the developing world. During the conference, the President of the WWF (Working Women's Forum) described her agency's 17 years of experience in lending to impoverished rural and urban women in India. By extending microcredit assistance through a network of cooperatives, the WWF has been the catalyst for lasting improvements in the economic and social status of impoverished women. Representatives of the Grameen Bank, Women's World Banking, the Ecumenical Development Cooperative Society, and other organizations also addressed the conference.

  3. Raman scattering tensors of tyrosine.

    Science.gov (United States)

    Tsuboi, M; Ezaki, Y; Aida, M; Suzuki, M; Yimit, A; Ushizawa, K; Ueda, T

    1998-01-01

    Polarized Raman scattering measurements have been made of a single crystal of L-tyrosine by the use of a Raman microscope with the 488.0-nm exciting beam from an argon ion laser. The L-tyrosine crystal belongs to the space group P2(1)2(1)2(1) (orthorhombic), and Raman scattering intensities corresponding to the aa, bb, cc, ab and ac components of the crystal Raman tensor have been determined for each prominent Raman band. A similar set of measurements has been made of L-tyrosine-d4, in which four hydrogen atoms on the benzene ring are replaced by deuterium atoms. The effects of NH3-->ND3 and OH-->OD on the Raman spectrum have also been examined. In addition, depolarization ratios of some bands of L-tyrosine in aqueous solutions of pH 13 and pH 1 were examined. For comparison with these experimental results, on the other hand, ab initio molecular orbital calculations have been made of the normal modes of vibration and their associated polarizability oscillations of the L-tyrosine molecule. On the basis of these experimental data and by referring to the results of the calculations, discussions have been presented on the Raman tensors associated to some Raman bands, including those at 829 cm-1 (benzene ring breathing), 642 cm-1 (benzene ring deformation), and 432 cm-1 (C alpha-C beta-C gamma bending).

  4. Stress And Strain Analysis of The Hip Joint Using FEM

    Czech Academy of Sciences Publication Activity Database

    Vaverka, M.; Návrat, Tomáš; Vrbka, M.; Florian, Z.; Fuis, Vladimír

    2006-01-01

    Roč. 14, 4-5 (2006), s. 271-279 ISSN 0928-7329 R&D Projects: GA ČR GA101/05/0136 Institutional research plan: CEZ:AV0Z20760514 Keywords : hip FEM surgace replacement pathological contact pressure stress * hip FEM surgace replacement pathological contact pressure stress Subject RIV: BO - Biophysics

  5. Advanced HVAC modeling with FemLab/Simulink/MatLab

    NARCIS (Netherlands)

    Schijndel, van A.W.M.

    2003-01-01

    The combined MatLab toolboxes FemLab and Simulink are evaluated as solvers for HVAC problems based on partial differential equations (PDEs). The FemLab software is designed to simulate systems of coupled PDEs, 1-D, 2-D or 3-D, nonlinear and time dependent. In order to show how the program works, a

  6. Stress and fatigue analyses of primary circuit components of NPP using FEM

    International Nuclear Information System (INIS)

    Gal, P.

    2015-01-01

    This poster is a short illustration of the numerical assessment of the VVER-440 reactor pressure vessel (RPV) main flange. RPV main flange consists in free flange, pressure ring, flange bolts, nut and nickel gasket. Operating temperature transient modes, like heat up regime can lead to serious tension in bolts. So temperature fields have to be calculated. The fatigue assessment of the main flange bolt requires the determination of the coefficient of stress concentrators in bolt thread. Stress concentrators can be computed through FEM or given by norms (PNAEG). The most significant value of fatigue usage factor is in the first thread connection between bolt and nut. A finite element method (FEM) is used for calculation stress and temperature distribution in the reactor flange. The reassessment was performed according Czech normative document NTD-A.S.I. and VERLIFE

  7. Noticeable red emission and Raman active modes in nanoscale gadolinium oxyfluoride (Gd{sub 4}O{sub 3}F{sub 6}) systems with Eu{sup 3+} inclusion

    Energy Technology Data Exchange (ETDEWEB)

    Hazarika, Samiran; Mohanta, Dambarudhar [Tezpur University, Nanoscience and Soft Matter Laboratory, Department of Physics, Tezpur, Assam (India)

    2017-05-15

    Eu{sup 3+} doped gadolinium oxyfluoride (Gd{sub 4}O{sub 3}F{sub 6}, GOF) nanoscale systems have been synthesized following a modified Pechini method. While exhibiting a tetragonal crystal structure, the GOF nanosystem gave an average crystallite size (d) of ∝21-26 nm. The Lotgering factor (L{sub F}), which is a measure of orientation of crystallites along the preferred direction was found to vary between 0.22 and 0.48. In the photoluminescence spectra, ∝595 and ∝613 nm peaks were identified as magnetically driven ({sup 5}D{sub 0} → {sup 7}F{sub 1}) and electrically driven ({sup 5}D{sub 0} → {sup 7}F{sub 2}) transitions with latter (red emission) being strongly manifested with Eu{sup 3+} doping concentration and intrinsic defects. Moreover, several Raman active modes have been probed in the Raman spectra with low frequency peaks (<300 cm{sup -1}) and moderate frequency peaks (∝481 and 567 cm{sup -1}) assigned to observable vibration of heavy atom Gd-Gd pairs and Gd-O groups, respectively. Apart from manifestation of phononic features, inclusion of Eu{sup 3+} in the host lattice would bring new insight on improving the red emission response prior to concentration quenching. (orig.)

  8. Crack growth analysis in a weld-heat-affected zone using S-version FEM

    International Nuclear Information System (INIS)

    Kikuchi, Masanori; Wada, Yoshitaka; Shimizu, Yuto; Li, Yulong

    2012-01-01

    The objective of this study is the prediction of crack propagation under thermal, residual stress fields using S-Version FEM (S-FEM). By using the S-FEM technique, only the local mesh should be re-meshed and it becomes easy to simulate crack growth. By combining with an auto-meshing technique, the local mesh is re-meshed automatically, and a curved crack path is modeled easily. Virtual crack closure integral method (VCCM) is used to evaluate energy release rate at the crack tip. For crack growth analyses, crack growth rate and growth direction are determined using criteria for mixed mode loading condition. In order to confirm the validity of this analysis, some comparisons with previously reported analyses were done, and good agreement obtained. In this study, residual stress data were provided by JAEA, Japan Atomic Energy Agency, based on their numerical simulation. Stress corrosion crack (SCC) growth analyses in a pipe are conducted in two-dimensional and three-dimensional fields. Two cases, for an axi-symmetric distribution of residual stress in the pipe wall and a non-axisymmetric one are assumed. Effects of residual stress distribution patterns on SCC cracking are evaluated and discussed.

  9. Analyzing the fundamental properties of Raman amplification in optical fibers

    DEFF Research Database (Denmark)

    Rottwitt, Karsten; Povlsen, Jørn Hedegaard

    2005-01-01

    The Raman response of germanosilicate fibers is presented. This includes not only the material dependence but also the relation between the spatial-mode profile of the light and the Raman response in the time and frequency domain. From the Raman-gain spectrum, information is derived related...

  10. Raman study of ? crystals

    Science.gov (United States)

    Pimenta, M. A.; Oliveira, M. A. S.; Bourson, P.; Crettez, J. M.

    1997-09-01

    In this work we present a polarized Raman study of 0953-8984/9/37/020/img7 single crystals for several values of the concentration 0953-8984/9/37/020/img8 made using different scattering geometries. The Raman spectra, composed of broad bands, have been fitted in accordance with a symmetry analysis which allowed us to assign the vibrational modes, and determine their frequencies and damping constants. The results are compatible with an average hexagonal symmetry for the solid solutions with x in the range 0953-8984/9/37/020/img9. In each of the spectra we found two bands at about 590 and 0953-8984/9/37/020/img10, probably associated with the existence of 0953-8984/9/37/020/img11 structures in the solid solutions.

  11. CV Raman

    Indian Academy of Sciences (India)

    formatted to take advantage of the changes in publishing methods in the past thirty ..... This work would not have been possible without the support and en- couragement of ..... in which Raman made his decision, have a deeper significance than .... Light in Water and the Colour of the Sea within a month of his return to India ...

  12. Raman Chandrasekar

    Indian Academy of Sciences (India)

    Home; Journals; Resonance – Journal of Science Education. Raman Chandrasekar. Articles written in Resonance – Journal of Science Education. Volume 13 Issue 5 May 2008 pp 430-439 General Article. How Children Learn to Use Language - An Overview of R. Narasimhan's Ideas on Child Language Acquisition.

  13. User's Manual for FEM-BEM Method. 1.0

    Science.gov (United States)

    Butler, Theresa; Deshpande, M. D. (Technical Monitor)

    2002-01-01

    A user's manual for using FORTRAN code to perform electromagnetic analysis of arbitrarily shaped material cylinders using a hybrid method that combines the finite element method (FEM) and the boundary element method (BEM). In this method, the material cylinder is enclosed by a fictitious boundary and the Maxwell's equations are solved by FEM inside the boundary and by BEM outside the boundary. The electromagnetic scattering on several arbitrarily shaped material cylinders using this FORTRAN code is computed to as examples.

  14. Raman tensor elements of β-Ga2O3.

    Science.gov (United States)

    Kranert, Christian; Sturm, Chris; Schmidt-Grund, Rüdiger; Grundmann, Marius

    2016-11-03

    The Raman spectrum and particularly the Raman scattering intensities of monoclinic β-Ga 2 O 3 are investigated by experiment and theory. The low symmetry of β-Ga 2 O 3 results in a complex dependence of the Raman intensity for the individual phonon modes on the scattering geometry which is additionally affected by birefringence. We measured the Raman spectra in dependence on the polarization direction for backscattering on three crystallographic planes of β-Ga 2 O 3 and modelled these dependencies using a modified Raman tensor formalism which takes birefringence into account. The spectral position of all 15 Raman active phonon modes and the Raman tensor elements of 13 modes were determined and are compared to results from ab-initio calculations.

  15. H irradiation effects on the GaAs-like Raman modes in GaAs1-xNx/GaAs1-xNx:H planar heterostructures

    International Nuclear Information System (INIS)

    Giulotto, E.; Geddo, M.; Patrini, M.; Guizzetti, G.; Felici, M.; Capizzi, M.; Polimeni, A.; Martelli, F.; Rubini, S.

    2014-01-01

    The GaAs-like longitudinal optical phonon frequency in two hydrogenated GaAs 1-x N x /GaAs 1-x N x :H microwire heterostructures—with similar N concentration, but different H dose and implantation conditions—has been investigated by micro-Raman mapping. In the case of GaAs 0.991 N 0.009 wires embedded in barriers where GaAs-like properties are recovered through H irradiation, the phonon frequency in the barriers undergoes a blue shift with respect to the wires. In GaAs 0.992 N 0.008 wires embedded in less hydrogenated barriers, the phonon frequency exhibits an opposite behavior (red shift). Strain, disorder, phonon localization effects induced by H-irradiation on the GaAs-like phonon frequency are discussed and related to different types of N-H complexes formed in the hydrogenated barriers. It is shown that the red (blue) character of the frequency shift is related to the dominant N-2H (N-3H) type of complexes. Moreover, for specific experimental conditions, an all-optical determination of the uniaxial strain field is obtained. This may improve the design of recently presented devices that exploit the correlation between uniaxial stress and the degree of polarization of photoluminescence

  16. H irradiation effects on the GaAs-like Raman modes in GaAs1-xNx/GaAs1-xNx:H planar heterostructures

    Science.gov (United States)

    Giulotto, E.; Geddo, M.; Patrini, M.; Guizzetti, G.; Felici, M.; Capizzi, M.; Polimeni, A.; Martelli, F.; Rubini, S.

    2014-12-01

    The GaAs-like longitudinal optical phonon frequency in two hydrogenated GaAs1-xNx/GaAs1-xNx:H microwire heterostructures—with similar N concentration, but different H dose and implantation conditions—has been investigated by micro-Raman mapping. In the case of GaAs0.991N0.009 wires embedded in barriers where GaAs-like properties are recovered through H irradiation, the phonon frequency in the barriers undergoes a blue shift with respect to the wires. In GaAs0.992N0.008 wires embedded in less hydrogenated barriers, the phonon frequency exhibits an opposite behavior (red shift). Strain, disorder, phonon localization effects induced by H-irradiation on the GaAs-like phonon frequency are discussed and related to different types of N-H complexes formed in the hydrogenated barriers. It is shown that the red (blue) character of the frequency shift is related to the dominant N-2H (N-3H) type of complexes. Moreover, for specific experimental conditions, an all-optical determination of the uniaxial strain field is obtained. This may improve the design of recently presented devices that exploit the correlation between uniaxial stress and the degree of polarization of photoluminescence.

  17. Resonance Raman study of benzyl radical

    DEFF Research Database (Denmark)

    Langkilde, F.W.; Bajdor, K.; Wilbrandt, R.

    1992-01-01

    Time-resolved resonance Raman spectra are obtained of benzyl radicals created by laser flash photolysis of benzylchloride and diphenylacetone in solution. The spectra are obtained in resonance with the intense 2 2A2-1 B-2(2) transition of benzyl. The strong Raman bands are assigned to totally...... symmetric a1 modes. The remaining observed bands are tentatively assigned to fundamental modes of b1, a2, and b2 symmetry, and to overtones and combinations. The resonance Raman spectra are found to be quite different from previous fluorescence spectra of benzyl, and the origins of these differences...

  18. CVD diamond Brewster window: feasibility study by FEM analyses

    Directory of Open Access Journals (Sweden)

    Vaccaro A.

    2012-09-01

    Full Text Available Chemical vapor deposition (CVD diamond windows are a crucial component in heating and current drive (H&CD applications. In order to minimize the amount of reflected power from the diamond disc, its thickness must match the desired beam wavelength, thus proper targeting of the plasma requires movable beam reflectors. This is the case, for instance, of the ITER electron cyclotron H&CD system. However, looking at DEMO, the higher heat loads and neutron fluxes could make the use of movable parts close to the plasma difficult. The issue might be solved by using gyrotrons able to tune the beam frequency to the desired resonance, but this concept requires transmission windows that work in a given frequency range, such as the Brewster window. It consists of a CVD diamond disc brazed to two copper cuffs at the Brewster angle. The brazing process is carried out at about 800°C and then the temperature is decreased down to room temperature. Diamond and copper have very different thermal expansion coefficients, therefore high stresses build up during the cool down phase that might lead to failure of the disc. Considering also the complex geometry of the window with the skewed position of the disc, analyses are required in the first place to check its feasibility. The cool down phase was simulated by FEM structural analyses for several geometric and constraint configurations of the window. A study of indirect cooling of the window by water was also performed considering a HE11 mode beam. The results are here reported.

  19. Strain characterization of FinFETs using Raman spectroscopy

    International Nuclear Information System (INIS)

    Kaleli, B.; Hemert, T. van; Hueting, R.J.E.; Wolters, R.A.M.

    2013-01-01

    Metal induced strain in the channel region of silicon (Si) fin-field effect transistor (FinFET) devices has been characterized using Raman spectroscopy. The strain originates from the difference in thermal expansion coefficient of Si and titanium-nitride. The Raman map of the device region is used to determine strain in the channel after preparing the device with the focused ion beam milling. Using the Raman peak shift relative to that of relaxed Si, compressive strain values up to – 0.88% have been obtained for a 5 nm wide silicon fin. The strain is found to increase with reducing fin width though it scales less than previously reported results from holographic interferometry. In addition, finite-element method (FEM) simulations have been utilized to analyze the amount of strain generated after thermal processing. It is shown that obtained FEM simulated strain values are in good agreement with the calculated strain values obtained from Raman spectroscopy. - Highlights: ► Strain is characterized in nanoscale devices with Raman spectroscopy. ► There is a fin width dependence of the originated strain. ► Strain levels obtained from this technique is in correlation with device simulations

  20. Genetic significance of the 867 cm- 1 out-of-plane Raman mode in graphite associated with V-bearing green grossular

    Science.gov (United States)

    Thomas, Rainer; Rericha, Adolf; Pohl, Walter L.; Davidson, Paul

    2018-03-01

    SE Kenya is the world's largest producer of green vanadium grossular gemstones (tsavorite). Samples from one of the mines near Mwatate, and of occurrences in Tanzania yielded remarkable new insights into the genesis of tsavorite. Graphite is intimately associated with V-grossular and is one of the keys to understanding its origin. In the course of this study we found five different types of graphite. Surprisingly, in one graphite type the "Raman-forbidden" and IR-active 867 cm- 1 band was observed. In this communication, we attempt to find an explanation for this unusual phenomenon. Additionally, our observations also address some of the issues pertaining to the origin of the green grossular-dominated rocks (grossularites), as well as the gem quality tsavorite crystals, since we propose that the anomalous spectroscopic behavior of the graphite is related to the unusual conditions during crystallization of both the grossular and graphite from a near-supercritical volatile- and sulfur-rich silicate melt. The massive green vanadium grossular contains abundant unequivocal crystallized melt inclusions, while the transparent gem quality grossular (tsavorite) displays only fluid inclusions. On the basis of inclusion studies we suggest that anatectic melts originated in the peculiar evaporitic host lithology of the tsavorite deposits. Near peak metamorphic temperatures ( 700 °C) these liquids occurred as a supercritical volatile-rich "fluid/melt phase" characterized by complete miscibility between H2O and silicate liquid. Relatively dry liquid batches precipitated non-transparent green grossular, whereas wet batches segregated fluids that formed transparent tsavorite.

  1. Determination of the fatigue behaviour of thin hard coatings using the impact test and a FEM simulation

    Energy Technology Data Exchange (ETDEWEB)

    Bouzakis, K.D. [Aristoteles Univ., Thessaloniki (Greece). Dept. of Mech. Eng.; Vidakis, N. [Aristoteles Univ., Thessaloniki (Greece). Dept. of Mech. Eng.; Leyendecker, T. [CemeCon, 52068 Aachen (Germany); Lemmer, O. [CemeCon, 52068 Aachen (Germany); Fuss, H.G. [CemeCon, 52068 Aachen (Germany); Erkens, G. [CemeCon, 52068 Aachen (Germany)

    1996-12-15

    The impact test, in combination with a finite element method (FEM) simulation, is used to determine stress values that characterise the fatigue behaviour of thin hard coatings, such as TiAlN, TiAlCN, CrN, MoN, etc. The successive impacts of a cemented carbide ball onto a coated probe induce high contact loads, which can vary in amplitude and cause plastic deformation in the substrate. In the present paper FEM calculations are used in order to determine the critical stress values, which lead to coating fatigue failure. The parametric FEM simulation developed considers elastic behaviour for the coating and elastic plastic behaviour for the substrate. The results of the FEM calculations are correlated to experimental data, as well as to SEM observations of the imprints and to microspectrum analyses within the contact region. Herewith, critical values for various stress components, which are responsible for distinctive fatigue failure modes of the coating-substrate compounds can be obtained. (orig.)

  2. Characterization of excited electronic states of naphthalene by resonance Raman and hyper-Raman scattering

    International Nuclear Information System (INIS)

    Bonang, C.C.; Cameron, S.M.

    1992-01-01

    The first resonance Raman and hyper-Raman scattering from naphthalene are reported. Fourth harmonic of a mode-locked Nd:YAG laser is used to resonantly excite the 1 B 1u + transition, producing Raman spectra that confirm the dominance of the vibronically active ν 28 (b 3g ) mode and the Franck--Condon active a g modes, ν 5 and ν 3 . A synchronously pumped stilbene dye laser and its second harmonic are employed as the excitation sources for hyper-Raman and Raman scattering from the overlapping 1 B 2 u + and 1 A g - states. The Raman spectra indicate that the equilibrium geometry of naphthalene is distorted primarily along ν 5 , ν 8 , and ν 7 normal coordinates upon excitation to 1 B 2 u + . The hyper-Raman spectrum shows that ν 25 (b 2u ) is the mode principally responsible for vibronic coupling between the 1 A g - and 1 B 2u + states. The results demonstrate the advantageous features of resonance hyper-Raman scattering for the case of overlapping one- and two-photon allowed transitions. Calculations based on simple molecular orbital configurations are shown to qualitatively agree with the experimental results

  3. Influence of the Resonant Electronic Transition on the Intensity of the Raman Radial Breathing Mode of Single Walled Carbon Nanotubes during Electrochemical Charging

    Czech Academy of Sciences Publication Activity Database

    Kalbáč, Martin; Kavan, Ladislav

    2009-01-01

    Roč. 113, č. 37 (2009), s. 16408-16413 ISSN 1932-7447 R&D Projects: GA ČR GC203/07/J067; GA AV ČR IAA400400911; GA AV ČR IAA400400804; GA AV ČR KAN200100801; GA MŠk LC510 Institutional research plan: CEZ:AV0Z40400503 Keywords : single-walled carbon nanotubes * radial breathing mode * electrochemistry Subject RIV: CG - Electrochemistry Impact factor: 4.224, year: 2009

  4. Experimental study of a high-current FEM with a broadband microwave system

    Energy Technology Data Exchange (ETDEWEB)

    Denisov, G.G.; Bratman, V.L.; Ginzburg, N.S. [Institute of Applied Physics, Nizhny Novgorod (Russian Federation)] [and others

    1995-12-31

    One of the main features of FELs and FEMs is the possibility of fast and wideband tuning of the resonant frequency of active media, which can be provided by changing the particle energy. For a frequency adjustable FEM-oscillator, a broadband microwave system, which is simply combined with an electron-optical FEM system and consists of an oversized waveguide and reflectors based on the microwave beams multiplication effect has been proposed and studied successfully in {open_quotes}cold{close_quotes} measurements. Here, the operating ability of a cavity, that includes some key elements of the broadband microwave system, was tested in the presence of an electron beam. To provide large particle oscillation velocities in a moderate undulator field and the presence of a guide magnetic field, the FEM operating regime of double resonance was chosen. In this regime the cyclotron as well as undulator resonance conditions were satisfied. The FEM-oscillator was investigated experimentally on a high-current accelerator {open_quotes}Sinus-6{close_quotes} that forms an electron beam with particle energy 500keV and pulse duration 25ns. The aperture with a diameter 2.5mm at the center of the anode allows to pass through only the central fraction of the electron beam with a current about 100A and a small spread of longitudinal velocities of the particles. Operating transverse velocity was pumped into the electron beam in the pulse plane undulator of a 2.4cm period. The cavity with a frequency near 45GHz consists of a square waveguide and two reflectors. The broadband up-stream reflector based on the multiplication effect had the power reflectivity coefficient more than 90% in the frequency band 10% for the H{sup 10} wave of the square waveguide with the maximum about 100% at a frequency 45GHz. The down-stream narrow-band Bragg reflector had the power reflection coefficient approximately 80% in the frequency band of 4% near 45GHz for the operating mode.

  5. FEM analysis of impact of external objects to pipelines

    Energy Technology Data Exchange (ETDEWEB)

    Gracie, Robert; Konuk, Ibrahim [Geological Survey of Canada, Ottawa, ON (Canada)]. E-mail: ikonuk@NRCan.gc.ca; Fredj, Abdelfettah [BMT Fleet Technology Limited, Ottawa, ON (Canada)

    2003-07-01

    One of the most common hazards to pipelines is impact of external objects. Earth moving machinery, farm equipment or bullets can dent or fail land pipelines. External objects such as anchors, fishing gear, ice can damage offshore pipelines. This paper develops an FEM model to simulate the impact process and presents investigations using the FEM model to determine the influence of the geometry and velocity of the impacting object and also will study the influence of the pipe diameter, wall thickness, and concrete thickness along with internal pressure. The FEM model is developed by using LS-DYNA explicit FEM software utilizing shell and solid elements. The model allows damage and removal of the concrete and corrosion coating elements during impact. Parametric studies will be presented relating the dent size to pipe diameter, wall thickness and concrete thickness, internal pipe pressure, and impacting object geometry. The primary objective of this paper is to develop and present the FEM model. The model can be applied to both offshore and land pipeline problems. Some examples are used to illustrate how the model can be applied to real life problems. A future paper will present more detailed parametric studies. (author)

  6. Raman bands in Ag nanoparticles obtained in extract of Opuntia ficus-indica plant

    Science.gov (United States)

    Bocarando-Chacon, J.-G.; Cortez-Valadez, M.; Vargas-Vazquez, D.; Rodríguez Melgarejo, F.; Flores-Acosta, M.; Mani-Gonzalez, P. G.; Leon-Sarabia, E.; Navarro-Badilla, A.; Ramírez-Bon, R.

    2014-05-01

    Silver nanoparticles have been obtained in an extract of Opuntia ficus-indica plant. The size and distribution of nanoparticles were quantified by atomic force microscopy (AFM). The diameter was estimated to be about 15 nm. In addition, energy dispersive X-ray spectroscopy (EDX) peaks of silver were observed in these samples. Three Raman bands have been experimentally detected at 83, 110 and 160 cm-1. The bands at 83 and 110 cm-1 are assigned to the silver-silver Raman modes (skeletal modes) and the Raman mode located at 160 cm-1 has been assigned to breathing modes. Vibrational assignments of Raman modes have been carried out based on the Density Functional Theory (DFT) quantum mechanical calculation. Structural and vibrational properties for small Agn clusters with 2≤n≤9 were determined. Calculated Raman modes for small metal clusters have an approximation trend of Raman bands. These Raman bands were obtained experimentally for silver nanoparticles (AgNP).

  7. Raman fiber distributed feedback lasers.

    Science.gov (United States)

    Westbrook, Paul S; Abedin, Kazi S; Nicholson, Jeffrey W; Kremp, Tristan; Porque, Jerome

    2011-08-01

    We demonstrate fiber distributed feedback (DFB) lasers using Raman gain in two germanosilicate fibers. Our DFB cavities were 124 mm uniform fiber Bragg gratings with a π phase shift offset from the grating center. Our pump was at 1480 nm and the DFB lasers operated on a single longitudinal mode near 1584 nm. In a commercial Raman gain fiber, the maximum output power, linewidth, and threshold were 150 mW, 7.5 MHz, and 39 W, respectively. In a commercial highly nonlinear fiber, these figures improved to 350 mW, 4 MHz, and 4.3 W, respectively. In both lasers, more than 75% of pump power was transmitted, allowing for the possibility of substantial amplification in subsequent Raman gain fiber. © 2011 Optical Society of America

  8. Application of FEM flow analysis to environmental engineering. FEM ryutai kaiseki no kankyo gijutsu eno tekiyo

    Energy Technology Data Exchange (ETDEWEB)

    Higuchi, M; Ando, K; Shimada, S; Umetani, H [Toyota Motor Corp., Aichi (Japan)

    1990-04-25

    In order to apply FEM (finite element method) flow analysis to environmental engineering, the two-dimensional analysis system was developed, and applied to the design of plant ventilation and improvement of an enviromental control equipment. Furthermore, the three-dimensional analysis system was developed to extend its application. Since in a large scale model, no enhancement of a processing capacity was expected even by a supercomputer because of longer I/O times between internal and external memories caused by a small internal memory space, the parallel processing system with multiple external memories was introduced to analyze such models. To achieve more efficient processing, multiple series of renumbering codes were also prepared to optimize the processing order of solvers, elements and nodes. As examples, the improvement of a thermal oxidizer and the ventilation design for a forging plant, and as an example of a three-dimensional large scale model, the flow analysis around a plant were presented. 8 refs., 17 figs., 1 tab.

  9. On a Weak Discrete Maximum Principle for hp-FEM

    Czech Academy of Sciences Publication Activity Database

    Šolín, Pavel; Vejchodský, Tomáš

    -, č. 209 (2007), s. 54-65 ISSN 0377-0427 R&D Projects: GA ČR(CZ) GA102/05/0629 Institutional research plan: CEZ:AV0Z20570509; CEZ:AV0Z10190503 Keywords : discrete maximum principle * hp-FEM Subject RIV: JA - Electronics ; Optoelectronics, Electrical Engineering Impact factor: 0.943, year: 2007

  10. The concepts and functions of a FEM workstation

    International Nuclear Information System (INIS)

    Brown, R.R.; Gloudeman, J.F.

    1982-01-01

    Recent advances in microprocessor-based computer hardware and associated software provide a basis for the development of a FEM workstation. The key requirements for such a workstation are reviewed and the recent hardware and software developments are discussed that make such a workstation both technically and economically feasible at this time. (orig.)

  11. Initial experiments with the FOM-Fusion-FEM

    International Nuclear Information System (INIS)

    Verhoeven, A.G.A.; Bongers, W.A.; Caplan, M.; Dijk, G. van; Elzendoorn, B.S.Q.

    1995-01-01

    A Free Electron Maser is being built for ECRH applications on future fusion research devices such as ITER. A unique feature of the Dutch FOM-Fusion-FEM is the possibility to tune the frequency over the entire range from 130 to 260 GHz while the output power exceeds 1 MW

  12. Evaluating DEM results with FEM perspectives of load : soil interaction

    NARCIS (Netherlands)

    Tadesse, D.

    2004-01-01

    Keywords: Load - soil interaction, soil structure, soil mechanical properties, FEM (Finite Element Method), Plaxis (Finite Element Code), granular particles, shear stress, DEM (Distinct Element Method),

  13. FEM growth and yield data monocultures - White willow

    NARCIS (Netherlands)

    Jansen, J.J.; Oosterbaan, A.; Goudzwaard, L.; Oldenburger, J.F.; Mohren, G.M.J.; Ouden, den J.

    2016-01-01

    The current database is part of the FEM growth and yield database, a collection of growth and yield data from even-aged monocultures (douglas fir, common oak, poplar, Japanese Larch, Norway spruce, Scots pine, Corsican pine, Austrian pine, red oak and several other species, with only a few plots,

  14. FEM growth and yield data Monocultures - Poplar (revised version)

    NARCIS (Netherlands)

    Mohren, G.M.J.; Goudzwaard, L.; Jansen, J.J.; Schmidt, P.; Oosterbaan, A.; Oldenburger, J.; Ouden, den J.

    2017-01-01

    The current database is part of the FEM growth and yield database, a collection of growth and yield data from even-aged monocultures (douglas fir, common oak, poplar, Japanese Larch, Norway spruce, Scots pine, Corsican pine, Austrian pine, red oak and several other species with only a few plots,

  15. FEM simulation of multi step forming of thick sheet

    NARCIS (Netherlands)

    Wisselink, H.H.; Huetink, Han

    2004-01-01

    A case study has been performed on the forming of an industrial product. This product, a bracket, is made of 5mm thick sheet in multiple steps. The process exists of a bending step followed by a drawing and a flanging step. FEM simulations have been used to investigate this forming process. First,

  16. FEM simulation of static loading test of the Omega beam

    Science.gov (United States)

    Bílý, Petr; Kohoutková, Alena; Jedlinský, Petr

    2017-09-01

    The paper deals with a FEM simulation of static loading test of the Omega beam. Omega beam is a precast prestressed high-performance concrete element with the shape of Greek letter omega. Omega beam was designed as a self-supporting permanent formwork member for construction of girder bridges. FEM program ATENA Science was exploited for simulation of load-bearing test of the beam. The numerical model was calibrated using the data from both static loading test and tests of material properties. Comparison of load-displacement diagrams obtained from the experiment and the model was conducted. Development of cracks and crack patterns were compared. Very good agreement of experimental data and the FEM model was reached. The calibrated model can be used for design of optimized Omega beams in the future without the need of expensive loading tests. The calibrated material model can be also exploited in other types of FEM analyses of bridges constructed with the use of Omega beams, such as limit state analysis, optimization of shear connectors, prediction of long-term deflections or prediction of crack development.

  17. Modification of the FEM3 model to ensure mass conservation

    International Nuclear Information System (INIS)

    Gresho, P.M.

    1987-01-01

    The problem of global mass conservation (lack thereof) in the current anelastic equations solved by FEM3 is described and its cause explained. The additional equations necessary to solve the problem are presented and methods for their incorporation into the current code are suggested. 14 refs

  18. FEM growth and yield data monocultures - other species

    NARCIS (Netherlands)

    Goudzwaard, L.; Jansen, J.J.; Oosterbaan, A.; Oldenburger, J.F.; Mohren, G.M.J.; Ouden, den J.

    2016-01-01

    The current database is part of the FEM growth and yield database, a collection of growth and yield data from even-aged monocultures (douglas fir, common oak, poplar, Japanese Larch, Norway spruce, Scots pine, Corsican pine, Austrian pine, red oak and several other species, with only a few plots,

  19. FEM effective suggestion of guitar construction

    Directory of Open Access Journals (Sweden)

    Vladimír Dániel

    2006-01-01

    Full Text Available Modal analysis of the whole guitar construction was performed. The results of eigenfrequencies were obtained. Stress in strings affects not only static loading of material, but also shift of eigenfrequencies. From obtained natural frequencies for solved spectrum such frequencies were used which coincides with assumed ribs new positions of ribs were suggested. Other ribs which do not carry out the mechanical function were removed. Also static reaction was evaluated and new position of ribs was adjusted. For final model new eigenfrequencies were computed and compared with previous ones. Significant changes were revealed in low frequencies (bellow 400 Hz where fewer amounts of natural shapes were obtained. Approximately 50% were lost by adding of ribs. For chosen frequencies of equal temperament the harmonic analysis was performed. The analysis proved ability of oscillation for frequencies far of natural frequencies. The final model satisfies the requirement of minimization of static stress in material due to strings and allows very effective oscillation of top the guitar resonance board. In comparison with literature good agreement in amplitude size of front board and amount of modes in appropriate frequencies were achieved. Suggested model even offers higher amount of natural shapes in comparison with literature, namely in high frequencies. From additional comparison of eigenfrequencies and natural shapes the influence of ribs position on natural shapes was approved.

  20. Magnetic soft mode behaviour investigated via multi-spin flip Raman spectroscopy on near surface Cd1-xMnxTe/Cd1-yMgyTe quantum wells

    International Nuclear Information System (INIS)

    Kehl, Christian

    2011-01-01

    The main motivation for this thesis was the experimental confirmation of the theoretically predicted magnetic soft mode and the analysis of its dependence on the hole-concentration and external B-field, as well as its disappearance with increasing sample temperature. For that purpose, CdMnTe/CdMgTe QWs (Mn: 0.6%, 1.0%) positioned close to the sample surface (13-19 nm) were investigated in an in-plane applied external magnetic field (up to 4.5 T in Voigt-geometry) via a two-colour experiment i.e. using two light sources. This allows the spin excitation of Mn-ions by simultaneously tuning the hole-concentration towards the ferromagnetic phase transition by photo-generated carriers. Thus, one tuneable laser is responsible for resonant below-barrier excitation as a probe for Multi-SF Raman scattering. The other laser excites photo-generated carriers from above barrier (2.41 eV) for tuning the hole concentration in the QW. Positioning the QW close to the sample surface causes a surface-induced p-doping of the QW (intrinsic hole concentration in the QW) and enables the active tuning of the hole concentration by photo-generated carriers due to different tunnelling behaviour of electrons and holes from the QW to the surface. The Mn-g-factor was decreased by quasi-continuously increasing the above-barrier illumination, while the below-barrier excitation was kept at a constant low power. This results in a Mn-g-factor reduction starting from its atomic value g=2.01 to lowest evaluated Mn-g-factor in this thesis g=1.77. This is a magnetic softening of 12%. Apart from the general magnetic soft mode behaviour at low temperatures, one of the main experimental results in this thesis is the confirmation of the theoretical prediction that the magnetic soft mode behaviour in the external B-field does not only depend on the carrier concentration but also on the B-field strength itself. An additional aspect is the temperature dependence of the magnetic soft mode. The Mn

  1. Magnetic soft mode behaviour investigated via multi-spin flip Raman spectroscopy on near surface Cd{sub 1-x}Mn{sub x}Te/Cd{sub 1-y}Mg{sub y}Te quantum wells

    Energy Technology Data Exchange (ETDEWEB)

    Kehl, Christian

    2011-03-28

    The main motivation for this thesis was the experimental confirmation of the theoretically predicted magnetic soft mode and the analysis of its dependence on the hole-concentration and external B-field, as well as its disappearance with increasing sample temperature. For that purpose, CdMnTe/CdMgTe QWs (Mn: 0.6%, 1.0%) positioned close to the sample surface (13-19 nm) were investigated in an in-plane applied external magnetic field (up to 4.5 T in Voigt-geometry) via a two-colour experiment i.e. using two light sources. This allows the spin excitation of Mn-ions by simultaneously tuning the hole-concentration towards the ferromagnetic phase transition by photo-generated carriers. Thus, one tuneable laser is responsible for resonant below-barrier excitation as a probe for Multi-SF Raman scattering. The other laser excites photo-generated carriers from above barrier (2.41 eV) for tuning the hole concentration in the QW. Positioning the QW close to the sample surface causes a surface-induced p-doping of the QW (intrinsic hole concentration in the QW) and enables the active tuning of the hole concentration by photo-generated carriers due to different tunnelling behaviour of electrons and holes from the QW to the surface. The Mn-g-factor was decreased by quasi-continuously increasing the above-barrier illumination, while the below-barrier excitation was kept at a constant low power. This results in a Mn-g-factor reduction starting from its atomic value g=2.01 to lowest evaluated Mn-g-factor in this thesis g=1.77. This is a magnetic softening of 12%. Apart from the general magnetic soft mode behaviour at low temperatures, one of the main experimental results in this thesis is the confirmation of the theoretical prediction that the magnetic soft mode behaviour in the external B-field does not only depend on the carrier concentration but also on the B-field strength itself. An additional aspect is the temperature dependence of the magnetic soft mode. The Mn

  2. Preventing Raman Lasing in High-Q WGM Resonators

    Science.gov (United States)

    Savchenkov, Anatoliy; Matsko, Andrey; Strekalov, Dmitry; Maleki, Lute

    2007-01-01

    A generic design has been conceived to suppress the Raman effect in whispering- gallery-mode (WGM) optical resonators that have high values of the resonance quality factor (Q). Although it is possible to exploit the Raman effect (even striving to maximize the Raman gain to obtain Raman lasing), the present innovation is intended to satisfy a need that arises in applications in which the Raman effect inhibits the realization of the full potential of WGM resonators as frequency-selection components. Heretofore, in such applications, it has been necessary to operate high-Q WGM resonators at unattractively low power levels to prevent Raman lasing. (The Raman-lasing thresholds of WGM optical resonators are very low and are approximately proportional to Q(sup -2)). Heretofore, two ways of preventing Raman lasting at high power levels have been known, but both entail significant disadvantages: A resonator can be designed so that the optical field is spread over a relatively large mode volume to bring the power density below the threshold. For any given combination of Q and power level, there is certain mode volume wherein Raman lasing does not start. Unfortunately, a resonator that has a large mode volume also has a high spectral density, which is undesirable in a typical photonic application. A resonator can be cooled to the temperature of liquid helium, where the Raman spectrum is narrower and, therefore, the Raman gain is lower. However, liquid-helium cooling is inconvenient. The present design overcomes these disadvantages, making it possible to operate a low-spectral-density (even a single-mode) WGM resonator at a relatively high power level at room temperature, without risk of Raman lasing.

  3. Electrical performance analysis of HTS synchronous motor based on 3D FEM

    International Nuclear Information System (INIS)

    Baik, S.K.; Kwon, Y.K.; Kim, H.M.; Lee, J.D.; Kim, Y.C.; Park, G.S.

    2010-01-01

    A 1-MW class superconducting motor with High-Temperature Superconducting (HTS) field coil is analyzed and tested. This machine is a prototype to make sure applicability aimed at generator and industrial motor applications such as blowers, pumps and compressors installed in large plants. This machine has the HTS field coil made of Bi-2223 HTS wire and the conventional copper armature (stator) coils cooled by water. The 1-MW class HTS motor is analyzed by 3D electromagnetic Finite Element Method (FEM) to get magnetic field distribution, self and mutual inductance, and so forth. Especially excitation voltage (Back EMF) is estimated by using the mutual inductance between armature and field coils and compared with experimental result. Open and short circuit tests were conducted in generator mode while a 1.1-MW rated induction machine was rotating the HTS machine. Electrical parameters such as mutual inductance and synchronous inductance are deduced from these tests and also compared with the analysis results from FEM.

  4. Structural model of standard ultrasonic transducer array developed for FEM analysis of mechanical crosstalk.

    Science.gov (United States)

    Celmer, M; Opieliński, K J; Dopierała, M

    2018-02-01

    One of the reasons of distortions in ultrasonic imaging are crosstalk effects. They can be divided into groups according to the way of their formation. One of them is constituted by mechanical crosstalk, which is propagated by a construction of a multi-element array of piezoelectric transducers. When an individual transducer is excited, mechanical vibrations are transferred to adjacent construction components, thereby stimulating neighboring transducers to an undesired operation. In order to explore ways of the propagation of such vibrations, the authors developed the FEM model of the array of piezoelectric transducers designed for calculations in COMSOL Multiphysics software. Simulations of activating individual transducers and calculated electrical voltages appearing on transducers unstimulated intentionally, were performed in the time domain in order to assess the propagation velocity of different vibration modes through the construction elements. On this basis, conclusions were drawn in terms of the participation of various construction parts of the array of piezoelectric transducers in the process of creating the mechanical crosstalk. The elaborated FEM model allowed also to examine the ways aimed at reducing the transmission of mechanical crosstalk vibrations through the components of the array. Studies showed that correct cuts in the fasteners and the front layer improve the reduction of the mechanical crosstalk effect. The model can become a helpful tool in the process of design and modifications of manufactured ultrasonic arrays particularly in terms of mechanical crosstalk reduction. Copyright © 2017 Elsevier B.V. All rights reserved.

  5. Improved assignments of the vibrational fundamental modes of ortho -, meta -, and para -xylene using gas- and liquid-phase infrared and Raman spectra combined with ab initio calculations: Quantitative gas-phase infrared spectra for detection

    Energy Technology Data Exchange (ETDEWEB)

    Lindenmaier, Rodica; Scharko, Nicole K.; Tonkyn, Russell G.; Nguyen, Kiet T.; Williams, Stephen D.; Johnson, Timothy J.

    2017-07-25

    Xylenes contain a blend of the ortho-, meta-, and para- isomers, and all are abundant contaminants in the ground, surface waters, and air. To better characterize xylene and to better enable its detection, we report high quality quantitative vapor-phase infrared spectra of all three isomers over the 540-6500 cm-1 range. All fundamental vibrational modes are assigned based on these vapor-phase infrared spectra, liquid-phase infrared and Raman spectra, along with density functional theory (DFT), ab initio MP2 and high energy-accuracy compound theoretical model (W1BD) calculations. Both MP2 and DFT predict a single conformer with C2v symmetry for ortho-xylene, and two conformers each for meta- and para-xylene, depending on the preferred orientations of the methyl groups. For meta-xylene the two conformers have Cs and C2 symmetry, and for para-xylene these conformers have C2v or C2h symmetry. Since the relative population of the two conformers is approximately 50% for both isomers and predicted frequencies and intensities are very similar for each conformer, we made an arbitrary choice to discuss the Cs conformer for meta-xylene and the C2v conformer for para-xylene. We report integrated band intensities for all isomers. Using the quantitative infrared data, we determine the global warming potential values of each isomer and discuss potential bands for atmospheric monitoring.

  6. MAXWELL3, 3-D FEM Electromagnetism

    International Nuclear Information System (INIS)

    Grant, J.B.

    2001-01-01

    1 - Description of program or function: MAXWELL3 is a linear, time domain, finite element code designed for simulation of electromagnetic fields interacting with three-dimensional objects. The simulation region is discretized into 6-sided, 8-nodded elements which need not form a logically regular grid. Scatterers may be perfectly conducting or dielectric. Restart capability and a Muer-type radiating boundary are included. MAXWELL3 can be run in a two-dimensional mode or on infinitesimally thin geometries. The output of time histories on surfaces, or shells, in addition to volumes, is allowed. Two post-processors are included - HIST2XY, which splits the MAXWELL3 history file into simple xy data files, and FFT A BS, which performs fast Fourier transformations on the xy data. 2 - Method of solution: The numerical method requires that the model be discretized with a mesh generator. MAXWELL3 then uses the mesh and computes the time domain electric and magnetic fields by integrating Maxwell's divergence-free curl equations over time. The output from MAXWELL3 can then be used with a post-processor to get the desired information in a graphical form. The explicit time integration is done with a leap-frog technique that alternates evaluating the electric and magnetic fields at half time steps. This allows for centered time differencing accurate in second order. The algorithm is naturally robust and requires no parameters. 3 - Restrictions on the complexity of the problem: MAXWELL3 has no mesh generation capabilities. Anisotropic, nonlinear, and magnetic materials cannot be modeled. Material interfaces only account for dielectric changes and neglect any surface charges that would be present at the surface of a partially conducting material. The radiation boundary algorithm is only accurate for normally incident fields and becomes less accurate as the angle of incidence increases. Thus, only models using scattered fields should use the radiation boundary. This limits MAXWELL3

  7. The intermediate phase and low wave number phonon modes in antiferroelectric (Pb{sub 0.97}La{sub 0.02}) (Zr{sub 0.60}Sn{sub 0.40−y}Ti{sub y})O{sub 3} ceramics discovered from temperature dependent Raman spectra

    Energy Technology Data Exchange (ETDEWEB)

    Ding, Xiaojuan; Guo, Shuang [Department of Electronic Engineering, East China Normal University, Shanghai 200241 (China); Hu, Zhigao, E-mail: zghu@ee.ecnu.edu.cn [Department of Electronic Engineering, East China Normal University, Shanghai 200241 (China); Chen, Xuefeng; Wang, Genshui [Key Laboratory of Inorganic Functional Materials and Devices, Shanghai Institute of Ceramics, Chinese Academy of Sciences, 1295 Dingxi Road, Shanghai 200050 (China); Dong, Xianlin; Chu, Junhao [Department of Electronic Engineering, East China Normal University, Shanghai 200241 (China)

    2016-05-15

    Optical phonons and phase transitions of (Pb{sub 0.97}La{sub 0.02}) (Zr{sub 0.60}Sn{sub 0.40−y}Ti{sub y})O{sub 3} (PLZST 97/2/60/40-100y/100y) ceramics with different compositions have been investigated by x-ray diffraction and temperature dependent Raman spectra. From the temperature dependence of low wavenumber phonon modes, two phase transitions (antiferroelectric orthorhombic to intermediate phase and intermediate phase to paraelectric cubic phase) were detected. The intermediate phase could be the coexistence one of antiferroelectric orthorhombic and ferroelectric rhombohedral phase. In addition, two modes (a soft mode and an anharmonic hopping central mode) were found in the high temperature paraelectric cubic phase. On cooling, the anharmonic hopping central mode splits into two modes in the terahertz range. Moreover, the antiferrodistortive mode appears in the antiferroelectric orthorhombic phase. Based on the analysis, the phase diagram of PLZST ceramics can be well improved. - Highlights: • The evolution of phonon modes in antiferroelectric PLZST ceramics. • An intermediate phase was found between orthorhombic and cubic phase. • The phase diagram of PLZST ceramics can be well improved.

  8. Analytical Calculation And FEM Analysis Main Girder Double Girder Bridge Crane

    Directory of Open Access Journals (Sweden)

    Muamer Delić

    2017-02-01

    Full Text Available The cranes are now not replaceable mode of transport of materials and finished products both in production halls and in the open space. This paper made the whole analytical calculation of double girder bridge cranes to be used in laboratories exclusively for testing, determined by the maximum bending stress and deflection of the main girder. After calculating the dimensions, we created a model cranes in software CATIA V5. The same model was subjected to FEM analysis of the same name software. At the end of the paper comparison has been done. The objective of the calculation and analysis of the model was to develop a model crane and to serve for the next tests. Dimensions of the crane are given according to the laboratory where it will be located.

  9. Stress Characterization of 4H-SiC Metal-Oxide-Semiconductor Field-Effect Transistor (MOSFET) using Raman Spectroscopy and the Finite Element Method.

    Science.gov (United States)

    Yoshikawa, Masanobu; Kosaka, Kenichi; Seki, Hirohumi; Kimoto, Tsunenobu

    2016-07-01

    We measured the depolarized and polarized Raman spectra of a 4H-SiC metal-oxide-semiconductor field-effect transistor (MOSFET) and found that compressive stress of approximately 20 MPa occurs under the source and gate electrodes and tensile stress of approximately 10 MPa occurs between the source and gate electrodes. The experimental result was in close agreement with the result obtained by calculation using the finite element method (FEM). A combination of Raman spectroscopy and FEM provides much data on the stresses in 4H-SiC MOSFET. © The Author(s) 2016.

  10. Utilization of FEM model for steel microstructure determination

    Science.gov (United States)

    Kešner, A.; Chotěborský, R.; Linda, M.; Hromasová, M.

    2018-02-01

    Agricultural tools which are used in soil processing, they are worn by abrasive wear mechanism cases by hard minerals particles in the soil. The wear rate is influenced by mechanical characterization of tools material and wear rate is influenced also by soil mineral particle contents. Mechanical properties of steel can be affected by a technology of heat treatment that it leads to a different microstructures. Experimental work how to do it is very expensive and thanks to numerical methods like FEM we can assumed microstructure at low cost but each of numerical model is necessary to be verified. The aim of this work has shown a procedure of prediction microstructure of steel for agricultural tools. The material characterizations of 51CrV4 grade steel were used for numerical simulation like TTT diagram, heat capacity, heat conduction and other physical properties of material. A relationship between predicted microstructure by FEM and real microstructure after heat treatment shows a good correlation.

  11. An Integrated NDE and FEM Characterization of Composite Rotors

    Science.gov (United States)

    Abdul-Aziz, Ali; Baaklini, George Y.; Trudell, Jeffrey J.

    2000-01-01

    A structural assessment by integrating finite-element methods (FEM) and a nondestructive evaluation (NDE) of two flywheel rotor assemblies is presented. Composite rotor A is pancake like with a solid hub design, and composite rotor B is cylindrical with a hollow hub design. Detailed analyses under combined centrifugal and interference-fit loading are performed. Two- and three-dimensional stress analyses and two-dimensional fracture mechanics analyses are conducted. A comparison of the structural analysis results obtained with those extracted via NDE findings is reported. Contact effects due to press-fit conditions are evaluated. Stress results generated from the finite-element analyses were corroborated with the analytical solution. Cracks due to rotational loading up to 49 000 rpm for rotor A and 34 000 rpm for rotor B were successfully imaged with NDE and predicted with FEM and fracture mechanics analyses. A procedure that extends current structural analysis to a life prediction tool is also defined.

  12. Construction of compact FEM using solenoid-induced helical wiggler

    International Nuclear Information System (INIS)

    Ohigashi, N.; Tsunawaki, Y.; Fujita, M.; Imasaki, K.; Mima, K.; Nakai, S.

    2003-01-01

    A prototype of compact Free-Electron Maser (FEM) has been designed for the operation in a usual small laboratory which does not have electric source capacity available enough. The electron energy is 60-120 keV. As it is lower, stronger guiding magnetic field is necessary in addition to wiggler field. To fulfil this condition a solenoid-induced helical wiggler is applied from the viewpoint of saving the electric power of restricted source capacity. The wiggler, for example, with the period of 12 mm creates the field of 92 G in the guiding field of 3.2 kG. The whole system of FEM has been just constructed in a small-scale laboratory. It is so small to occupy the area of 0.7x2.9 m 2

  13. Comparative FEM-based Analysis of Multiphase Induction Motor

    Directory of Open Access Journals (Sweden)

    Leonard Livadaru

    2014-09-01

    Full Text Available This paper presents a comparative study of multiphase induction motor, which has alternately three-, five- and six-phase stator winding. The machine has been designed particularly for this purpose and has individual ring coils placed in each stator slot. The study consists in FEM analyses and mainly looks for the particularities of magnetic quantities such as air-gap flux density and electromagnetic torque.

  14. Effect of Cervical Lessions on the Tooth FEM Study

    OpenAIRE

    Gabriela Bereşescu; Ligia Brezeanu; Claudia Şoaita

    2010-01-01

    The approach used until recently concerning the phenomena of dental abfraction points to the conclusion that the cervical area of the tooth, were this type of lesion usually occur, concentrates the stress resulted from the action of the forces applied on various areas on the crown. Moreover, any lesion in the cervical area facilitates the possibility of its advance into the tooth, ultimately fracturing it. Our paper presents a FEM (finite element method) study on the results of a mechanical a...

  15. Fracture Capabilities in Grizzly with the extended Finite Element Method (X-FEM)

    Energy Technology Data Exchange (ETDEWEB)

    Dolbow, John [Idaho National Lab. (INL), Idaho Falls, ID (United States); Zhang, Ziyu [Idaho National Lab. (INL), Idaho Falls, ID (United States); Spencer, Benjamin [Idaho National Lab. (INL), Idaho Falls, ID (United States); Jiang, Wen [Idaho National Lab. (INL), Idaho Falls, ID (United States)

    2015-09-01

    Efforts are underway to develop fracture mechanics capabilities in the Grizzly code to enable it to be used to perform deterministic fracture assessments of degraded reactor pressure vessels (RPVs). A capability was previously developed to calculate three-dimensional interaction- integrals to extract mixed-mode stress-intensity factors. This capability requires the use of a finite element mesh that conforms to the crack geometry. The eXtended Finite Element Method (X-FEM) provides a means to represent a crack geometry without explicitly fitting the finite element mesh to it. This is effected by enhancing the element kinematics to represent jump discontinuities at arbitrary locations inside of the element, as well as the incorporation of asymptotic near-tip fields to better capture crack singularities. In this work, use of only the discontinuous enrichment functions was examined to see how accurate stress intensity factors could still be calculated. This report documents the following work to enhance Grizzly’s engineering fracture capabilities by introducing arbitrary jump discontinuities for prescribed crack geometries; X-FEM Mesh Cutting in 3D: to enhance the kinematics of elements that are intersected by arbitrary crack geometries, a mesh cutting algorithm was implemented in Grizzly. The algorithm introduces new virtual nodes and creates partial elements, and then creates a new mesh connectivity; Interaction Integral Modifications: the existing code for evaluating the interaction integral in Grizzly was based on the assumption of a mesh that was fitted to the crack geometry. Modifications were made to allow for the possibility of a crack front that passes arbitrarily through the mesh; and Benchmarking for 3D Fracture: the new capabilities were benchmarked against mixed-mode three-dimensional fracture problems with known analytical solutions.

  16. RF Wave Simulation Using the MFEM Open Source FEM Package

    Science.gov (United States)

    Stillerman, J.; Shiraiwa, S.; Bonoli, P. T.; Wright, J. C.; Green, D. L.; Kolev, T.

    2016-10-01

    A new plasma wave simulation environment based on the finite element method is presented. MFEM, a scalable open-source FEM library, is used as the basis for this capability. MFEM allows for assembling an FEM matrix of arbitrarily high order in a parallel computing environment. A 3D frequency domain RF physics layer was implemented using a python wrapper for MFEM and a cold collisional plasma model was ported. This physics layer allows for defining the plasma RF wave simulation model without user knowledge of the FEM weak-form formulation. A graphical user interface is built on πScope, a python-based scientific workbench, such that a user can build a model definition file interactively. Benchmark cases have been ported to this new environment, with results being consistent with those obtained using COMSOL multiphysics, GENRAY, and TORIC/TORLH spectral solvers. This work is a first step in bringing to bear the sophisticated computational tool suite that MFEM provides (e.g., adaptive mesh refinement, solver suite, element types) to the linear plasma-wave interaction problem, and within more complicated integrated workflows, such as coupling with core spectral solver, or incorporating additional physics such as an RF sheath potential model or kinetic effects. USDoE Awards DE-FC02-99ER54512, DE-FC02-01ER54648.

  17. 3D FEM Simulation of Flank Wear in Turning

    Science.gov (United States)

    Attanasio, Aldo; Ceretti, Elisabetta; Giardini, Claudio

    2011-05-01

    This work deals with tool wear simulation. Studying the influence of tool wear on tool life, tool substitution policy and influence on final part quality, surface integrity, cutting forces and power consumption it is important to reduce the global process costs. Adhesion, abrasion, erosion, diffusion, corrosion and fracture are some of the phenomena responsible of the tool wear depending on the selected cutting parameters: cutting velocity, feed rate, depth of cut, …. In some cases these wear mechanisms are described by analytical models as a function of process variables (temperature, pressure and sliding velocity along the cutting surface). These analytical models are suitable to be implemented in FEM codes and they can be utilized to simulate the tool wear. In the present paper a commercial 3D FEM software has been customized to simulate the tool wear during turning operations when cutting AISI 1045 carbon steel with uncoated tungsten carbide tip. The FEM software was improved by means of a suitable subroutine able to modify the tool geometry on the basis of the estimated tool wear as the simulation goes on. Since for the considered couple of tool-workpiece material the main phenomena generating wear are the abrasive and the diffusive ones, the tool wear model implemented into the subroutine was obtained as combination between the Usui's and the Takeyama and Murata's models. A comparison between experimental and simulated flank tool wear curves is reported demonstrating that it is possible to simulate the tool wear development.

  18. Considerations on FEM modeling in analyzing buckling and plastic collapse of a detection control; Boto panel no zakutsu sosei hokai kaiseki ni okeru FEM model ka ni kansuru kosatsu

    Energy Technology Data Exchange (ETDEWEB)

    Yao, T; Fujikubo, M; Yanagihara, D; Irisawa, M [Hiroshima University, Hiroshima (Japan). Faculty of Engineering

    1997-10-01

    Buckling and plastic collapse of upper decks and bottom outer plates of a hull results directly in longitudinal bending collapse of the hull. Therefore, discussions were given on analysis for pressure destruction strength of a detection control panel which assumes an upper deck and a bottom outer plate. Pressure destruction behavior of the panting panel is a complex phenomenon accompanying non-linearity and geometrical non-linearity of the materials. Its whole phenomenon may be analyzed by using the finite element method (FEM) as a principle, but the analysis is not efficient. Therefore, considerations were given in relation to modeling when using the FEM. The considerations were given on a panel attached with flat steel panting members with respect to the modeling scope which considers the buckling mode according to the aspect ratio of the panel partitioned by the deflection control members. If the local buckling mode of the panel is an even number wave mode in the longitudinal direction, a triple span model is required. A modeling scope for a case of being subjected to water pressure and in-plane compression was considered on a panel attached with angle-type steel members having non-symmetric cross section. In this case, a triple bay model is more preferable to reproduce the behavior under water pressure loading. 1 ref., 6 figs.

  19. Raman spectroscopy of graphene on different substrates and ...

    Indian Academy of Sciences (India)

    We show the evolution of Raman spectra with a number of graphene layers on different substrates, SiO2/Si and conducting indium tin oxide (ITO) plate. The mode peak position and the intensity ratio of and 2 bands depend on the preparation of sample for the same number of graphene layers. The 2 Raman band ...

  20. Introductory Raman spectroscopy

    CERN Document Server

    Ferraro, John R

    2012-01-01

    Praise for Introductory Raman Spectroscopy Highlights basic theory, which is treated in an introductory fashion Presents state-of-the-art instrumentation Discusses new applications of Raman spectroscopy in industry and research.

  1. [Surface-enhanced Raman spectroscopy analysis of thiabendazole pesticide].

    Science.gov (United States)

    Lin, Lei; Wu, Rui-mei; Liu, Mu-hua; Wang, Xiao-bin; Yan, Lin-yuan

    2015-02-01

    Surface-enhanced Raman spectroscopy (SERS) technique was used to analyze the Raman peaks of thiabendazole pesticides in the present paper. Surface enhanced substrates of silver nanoparticle were made based on microwave technology. Raman signals of thiabendazole were collected by laser Micro-Raman spectrometer with 514. 5 and 785 nm excitation wavelengths, respectively. The Raman peaks at different excitation wavelengths were analyzed and compared. The Raman peaks 782 and 1 012 at 785 nm excitation wavelength were stronger, which were C--H out-of-plane vibrations. While 1284, 1450 and 1592 cm(-1) at 514.5 nm excitation wavelength were stronger, which were vng and C==N stretching. The study results showed that the intensity of Raman peak and Raman shift at different excitation wavelengths were different And strong Raman signals were observed at 782, 1012, 1284, 1450 and 1592 cm(-1) at 514.5 and 785 nm excitation wavelengths. These characteristic vibrational modes are characteristic Raman peaks of carbendazim pesticide. The results can provide basis for the rapid screening of pesticide residue in agricultural products and food based on Raman spectrum.

  2. Rapid Identification of Bacterial Pathogens of Military Interest Using Surface-Enhanced Raman Spectroscopy

    Science.gov (United States)

    2014-06-11

    Failloux, N., Bonnet, 1., Baron, M. H., & Perrier, E. (2003). Quantitative analysis of vitamin A degradation by raman spectroscopy. Applied Spectroscopy...analysis of the Raman-active modes of the anti-tumor agent 6- mercaptopurine . Journal of Raman Spectroscopy, 32(1), 1-8. doi: Doi 10.1002/1097- 4555

  3. ORIENTATIONAL MICRO-RAMAN SPECTROSCOPY ON HYDROXYAPATITE SINGLE-CRYSTALS AND HUMAN ENAMEL CRYSTALLITES

    NARCIS (Netherlands)

    TSUDA, H; ARENDS, J

    Single crystals of synthetic hydroxyapatite have been examined by orientational micro-Raman spectroscopy. The observed Raman bands include the PO43-/OH- internal and external. modes over the spectral range from 180 to 3600 cm(-1). The Raman-active symmetry tensors (A, E(1), and E(2)) of

  4. Laser Raman Spectroscopy with Different Excitation Sources and Extension to Surface Enhanced Raman Spectroscopy

    Directory of Open Access Journals (Sweden)

    Md. Wahadoszamen

    2015-01-01

    Full Text Available A dispersive Raman spectrometer was used with three different excitation sources (Argon-ion, He-Ne, and Diode lasers operating at 514.5 nm, 633 nm, and 782 nm, resp.. The system was employed to a variety of Raman active compounds. Many of the compounds exhibit very strong fluorescence while being excited with a laser emitting at UV-VIS region, hereby imposing severe limitation to the detection efficiency of the particular Raman system. The Raman system with variable excitation laser sources provided us with a desired flexibility toward the suppression of unwanted fluorescence signal. With this Raman system, we could detect and specify the different vibrational modes of various hazardous organic compounds and some typical dyes (both fluorescent and nonfluorescent. We then compared those results with the ones reported in literature and found the deviation within the range of ±2 cm−1, which indicates reasonable accuracy and usability of the Raman system. Then, the surface enhancement technique of Raman spectrum was employed to the present system. To this end, we used chemically prepared colloidal suspension of silver nanoparticles as substrate and Rhodamine 6G as probe. We could observe significant enhancement of Raman signal from Rhodamine 6G using the colloidal solution of silver nanoparticles the average magnitude of which is estimated to be 103.

  5. Modified Pippard relationship describing the Raman frequency shifts ...

    Indian Academy of Sciences (India)

    Unknown

    Abstract. We relate in this study the thermal expansivity, αP, to the Raman frequency shift (1/ν)(∂ν/∂P)T for the rotatory lattice (librational) mode in ammonia solid II near its melting point. We have used our calculated Raman frequencies of this mode for pressures of 3⋅65, 5⋅02 and 6⋅57 kbars for this crystalline system.

  6. In vitro toxicity of FemOn, FemOn-SiO2 composite, and SiO2-FemOn core-shell magnetic nanoparticles

    Directory of Open Access Journals (Sweden)

    Toropova YG

    2017-01-01

    of uncoated, FemOn-SiO2 composite flake-like, and SiO2-FemOn core-shell IONPs on cell viability, function, and morphology were tested 48 h postincubation in human umbilical vein endothelial cell culture. Cell viability and apoptosis/necrosis rate were determined using 3-(4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide assay and annexin V-phycoerythrin kit, respectively. Cell morphology was evaluated using bright-field microscopy and forward and lateral light scattering profiles obtained with flow cytometry analysis. All tested IONP types were used at three different doses, that is, 0.7, 7.0, and 70.0 µg. Dose-dependent changes in cell morphology, viability, and apoptosis rate were shown. At higher doses, all types of IONPs caused formation of binucleated cells suggesting impaired cytokinesis. FemOn-SiO2 composite flake-like and SiO2-FemOn core-shell IONPs were characterized by similar profile of cytotoxicity, whereas bare IONPs were shown to be less toxic. The presence of either silica core or silica nanoflakes in composite IONPs can promote cytotoxic effects. Keywords: iron oxide nanoparticles, composite nanoparticles, silica coating, silica nanoflakes, cytotoxicity

  7. Effect of Cervical Lessions on the Tooth FEM Study

    Directory of Open Access Journals (Sweden)

    Gabriela Bereşescu

    2010-12-01

    Full Text Available The approach used until recently concerning the phenomena of dental abfraction points to the conclusion that the cervical area of the tooth, were this type of lesion usually occur, concentrates the stress resulted from the action of the forces applied on various areas on the crown. Moreover, any lesion in the cervical area facilitates the possibility of its advance into the tooth, ultimately fracturing it. Our paper presents a FEM (finite element method study on the results of a mechanical analysis of the phenomena involving the tooth damaged by cervical lesions.

  8. Simulation of ultrasonic and EMAT arrays using FEM and FDTD.

    Science.gov (United States)

    Xie, Yuedong; Yin, Wuliang; Liu, Zenghua; Peyton, Anthony

    2016-03-01

    This paper presents a method which combines electromagnetic simulation and ultrasonic simulation to build EMAT array models. For a specific sensor configuration, Lorentz forces are calculated using the finite element method (FEM), which then can feed through to ultrasonic simulations. The propagation of ultrasound waves is numerically simulated using finite-difference time-domain (FDTD) method to describe their propagation within homogenous medium and their scattering phenomenon by cracks. Radiation pattern obtained with Hilbert transform on time domain waveforms is proposed to characterise the sensor in terms of its beam directivity and field distribution along the steering angle. Copyright © 2015 Elsevier B.V. All rights reserved.

  9. Detection of biologically active diterpenoic acids by Raman Spectroscopy

    DEFF Research Database (Denmark)

    Talian, Ivan; Orinak, Andrej; Efremov, Evtim V.

    2010-01-01

    Three poorly detectable, biologically active diterpenoic acids, kaurenoic, abietic, and gibberellic acid, were studied by using different modes of Raman spectroscopy. Because of their structural similarities, in the absence of strongly polarizable groups, conventional Raman spectroscopy is not su......Three poorly detectable, biologically active diterpenoic acids, kaurenoic, abietic, and gibberellic acid, were studied by using different modes of Raman spectroscopy. Because of their structural similarities, in the absence of strongly polarizable groups, conventional Raman spectroscopy...... few enhanced Raman lines. SERS spectra with 514-nm excitation with Ag colloids were also relatively weak. The best SERS spectrawere obtained with 785-nm excitation on a novel nanostructured substrate, 'black silicon' coated with a 400-nm gold layer. The spectra showed clear differences...

  10. Structural characterization of indium oxide nanostructures: a Raman analysis

    International Nuclear Information System (INIS)

    Berengue, Olivia M; Rodrigues, Ariano D; Chiquito, Adenilson J; Dalmaschio, Cleocir J; Leite, Edson R; Lanfredi, Alexandre J C

    2010-01-01

    In this work we report on structural and Raman spectroscopy measurements of pure and Sn-doped In 2 O 3 nanowires. Both samples were found to be cubic and high quality single crystals. Raman analysis was performed to obtain the phonon modes of the nanowires and to confirm the compositional and structural information given by structural characterization. Cubic-like phonon modes were detected in both samples and their distinct phase was evidenced by the presence of tin doping. As a consequence, disorder effects were detected evidenced by the break of the Raman selection rules.

  11. Polarized hyper-Raman scattering study of the silent F.sub.2u./sub. mode in PbMg.sub.1/3./sub.Nb.sub.2/3./sub.O.sub.3./sub..

    Czech Academy of Sciences Publication Activity Database

    Al-Zein, A.; Hehlen, B.; Rouquette, J.; Hlinka, Jiří

    2008-01-01

    Roč. 78, č. 13 (2008), 134113/1-134113/7 ISSN 1098-0121 R&D Projects: GA ČR GA202/06/0411 Institutional research plan: CEZ:AV0Z10100520 Keywords : hyper -Raman scattering * relaxors * ferroelectrics * phonon * spectroscopy * Burns temperature Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 3.322, year: 2008

  12. Polar modes in relaxor PbMg.sub.1/3./sub.Nb.sub.2/3./sub.O.sub.3./sub. by hyper-Raman scattering

    Czech Academy of Sciences Publication Activity Database

    Hehlen, B.; Simon, G.; Hlinka, Jiří

    2007-01-01

    Roč. 75, č. 5 (2007), 052104/1-052104/3 ISSN 1098-0121 R&D Projects: GA ČR GA202/06/0411 Institutional research plan: CEZ:AV0Z10100520 Keywords : relaxor * hyper -Raman scattering * lattice vibration * phonon spectra Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 3.172, year: 2007

  13. All-in-fibre Rayleigh-rejection filter for raman spectroscopy

    DEFF Research Database (Denmark)

    Brunetti, Anna Chiara; Scolari, L.; Lund-Hansen, T.

    2012-01-01

    An in-line Rayleigh-rejection filter for Raman spectroscopy is demonstrated. The device is based on a solid-core photonic crystal fibre infiltrated with a high-index liquid. At room temperature, the filter exhibits a full width at half maximum bandwidth of 143 nm and an insertion loss of 0.3 d......B. A shift of 32 nm of the central wavelength is demonstrated by increasing the temperature from 22 to 70°C. FEM simulations of the spectra at different temperatures showed good agreement with experimental results. The device was successfully employed to perform Raman spectroscopy of a sample of cyclohexane...

  14. Frequency-asymmetric gain profile in a seeded Raman amplifier

    International Nuclear Information System (INIS)

    Repasky, K.S.; Carlsten, J.L.

    1996-01-01

    This paper examines the effect of index guiding on Raman gain. The slowly varying Maxwell wave equation including both the real and imaginary parts of the Raman susceptibility for a seeded Raman amplifier is explored. Using a Gauss-Laguerre mode expansion for the Stokes field, the output Stokes energy is numerically studied as a function of gain and detuning from the Raman resonance. The calculations indicate that the real part of the Raman susceptibility causes the Raman medium to act as a lens when the Stokes seed is detuned from the Raman resonance. This focusing effect leads to higher peak Stokes energy when the Stokes seed is tuned to the blue side of the Raman resonance. Specifically for Raman scattering in H 2 with a pump laser at 532 nm and an input seed near 683 nm, the peak Stokes energy can shift by as much as 300 MHz from the Raman resonance. An experiment which confirms these predictions is also presented. copyright 1996 The American Physical Society

  15. Numerical Modelling of the Special Light Source with Novel R-FEM Method

    Directory of Open Access Journals (Sweden)

    Pavel Fiala

    2008-01-01

    Full Text Available This paper presents information about new directions in the modelling of lighting systems, and an overview of methods for the modelling of lighting systems. The novel R-FEM method is described, which is a combination of the Radiosity method and the Finite Elements Method (FEM. The paper contains modelling results and their verification by experimental measurements and by the Matlab simulation for this R-FEM method.

  16. A Hybrid FEM-ANN Approach for Slope Instability Prediction

    Science.gov (United States)

    Verma, A. K.; Singh, T. N.; Chauhan, Nikhil Kumar; Sarkar, K.

    2016-09-01

    Assessment of slope stability is one of the most critical aspects for the life of a slope. In any slope vulnerability appraisal, Factor Of Safety (FOS) is the widely accepted index to understand, how close or far a slope from the failure. In this work, an attempt has been made to simulate a road cut slope in a landslide prone area in Rudrapryag, Uttarakhand, India which lies near Himalayan geodynamic mountain belt. A combination of Finite Element Method (FEM) and Artificial Neural Network (ANN) has been adopted to predict FOS of the slope. In ANN, a three layer, feed- forward back-propagation neural network with one input layer and one hidden layer with three neurons and one output layer has been considered and trained using datasets generated from numerical analysis of the slope and validated with new set of field slope data. Mean absolute percentage error estimated as 1.04 with coefficient of correlation between the FOS of FEM and ANN as 0.973, which indicates that the system is very vigorous and fast to predict FOS for any slope.

  17. [Raman spectra of monkey cerebral cortex tissue].

    Science.gov (United States)

    Zhu, Ji-chun; Guo, Jian-yu; Cai, Wei-ying; Wang, Zu-geng; Sun, Zhen-rong

    2010-01-01

    Monkey cerebral cortex, an important part in the brain to control action and thought activities, is mainly composed of grey matter and nerve cell. In the present paper, the in situ Raman spectra of the cerebral cortex of the birth, teenage and aged monkeys were achieved for the first time. The results show that the Raman spectra for the different age monkey cerebral cortex exhibit most obvious changes in the regions of 1000-1400 and 2800-3000 cm(-1). With monkey growing up, the relative intensities of the Raman bands at 1313 and 2885 cm(-1) mainly assigned to CH2 chain vibrational mode of lipid become stronger and stronger whereas the relative intensities of the Raman bands at 1338 and 2932 cm(-1) mainly assigned to CH3 chain vibrational mode of protein become weaker and weaker. In addition, the two new Raman bands at 1296 and 2850 cm(-1) are only observed in the aged monkey cerebral cortex, therefore, the two bands can be considered as a character or "marker" to differentiate the caducity degree with monkey growth In order to further explore the changes, the relative intensity ratios of the Raman band at 1313 cm(-1) to that at 1338 cm(-1) and the Raman band at 2885 cm(-1) to that at 2 932 cm(-1), I1313/I1338 and I2885/I2932, which are the lipid-to-protein ratios, are introduced to denote the degree of the lipid content. The results show that the relative intensity ratios increase significantly with monkey growth, namely, the lipid content in the cerebral cortex increases greatly with monkey growth. So, the authors can deduce that the overmuch lipid is an important cause to induce the caducity. Therefore, the results will be a powerful assistance and valuable parameter to study the order of life growth and diagnose diseases.

  18. Raman spectra of SDW superconductors

    Energy Technology Data Exchange (ETDEWEB)

    Rout, G.C. [Condensed Matter Physics Group, Department of Physics, Government Science College, Chatrapur, Orissa 761 020 (India)]. E-mail: gcr@iopb.res.in; Bishoyi, K.C. [P.G. Department of Physics, F.M. College (Autonomous), Balasore, Orissa 756 001 (India); Behera, S.N. [Institute of Physics, Bhubaneswar 751 005 (India)

    2005-03-15

    We report the calculation of the phonon response of the coexistent spin density wave (SDW) and superconducting (SC) state and predict the observation of SC gap in the Raman spectra of rare-earth nickel borocarbide superconductors. The SDW state normally does not couple to the lattice and hence, the phonons in the system are not expected to be affected by the SDW state. But there is a possibility of observing SC gap mode in the Raman spectra of a SDW superconductor due to the coupling of the SC gap excitation to the Raman active phonons in the system via the electron-phonon (e-p) interaction. A theoretical model is used for the coexistent phase and electron-phonon interaction. Phonon Green's function is calculated by Zubarev's technique and the phonon self-energy due to e-p interaction which is given by electron density response function in the coexistent state corresponding to the SDW wave vector q = Q is evaluated. The results so obtained exhibit agreement with the experimental observations.

  19. Raman spectra of SDW superconductors

    International Nuclear Information System (INIS)

    Rout, G.C.; Bishoyi, K.C.; Behera, S.N.

    2005-01-01

    We report the calculation of the phonon response of the coexistent spin density wave (SDW) and superconducting (SC) state and predict the observation of SC gap in the Raman spectra of rare-earth nickel borocarbide superconductors. The SDW state normally does not couple to the lattice and hence, the phonons in the system are not expected to be affected by the SDW state. But there is a possibility of observing SC gap mode in the Raman spectra of a SDW superconductor due to the coupling of the SC gap excitation to the Raman active phonons in the system via the electron-phonon (e-p) interaction. A theoretical model is used for the coexistent phase and electron-phonon interaction. Phonon Green's function is calculated by Zubarev's technique and the phonon self-energy due to e-p interaction which is given by electron density response function in the coexistent state corresponding to the SDW wave vector q = Q is evaluated. The results so obtained exhibit agreement with the experimental observations

  20. Charge Transfer Effect on Raman and Surface Enhanced Raman Spectroscopy of Furfural Molecules.

    Science.gov (United States)

    Wan, Fu; Shi, Haiyang; Chen, Weigen; Gu, Zhaoliang; Du, Lingling; Wang, Pinyi; Wang, Jianxin; Huang, Yingzhou

    2017-08-02

    The detection of furfural in transformer oil through surface enhanced Raman spectroscopy (SERS) is one of the most promising online monitoring techniques in the process of transformer aging. In this work, the Raman of individual furfural molecules and SERS of furfural-M x (M = Ag, Au, Cu) complexes are investigated through density functional theory (DFT). In the Raman spectrum of individual furfural molecules, the vibration mode of each Raman peak is figured out, and the deviation from experimental data is analyzed by surface charge distribution. In the SERS of furfural-M x complexes, the influence of atom number and species on SERS chemical enhancement factors (EFs) are studied, and are further analyzed by charge transfer effect. Our studies strengthen the understanding of charge transfer effect in the SERS of furfural molecules, which is important in the online monitoring of the transformer aging process through SERS.

  1. Raman spectroscopy of garnet-group minerals

    Science.gov (United States)

    Mingsheng, P.; Mao, Ho-kwang; Dien, L.; Chao, E.C.T.

    1994-01-01

    The Raman spectra of the natural end members of the garnet-group minerals, which include pyrope, almandine and spessarite of Fe-Al garnet series and grossularite, andradite and uvarovite of Ca-Fe garnet series, have been studied. Measured Raman spectra of these minerals are reasonably and qualitatively assigned to the internal modes, translational and rotatory modes of SiO4 tetrahedra, as well as the translational motion of bivalent cations in the X site. The stretch and rotatory Alg modes for the Fe-Al garnet series show obvious Raman shifts as compared with those for the Ca-Fe garnet series, owing to the cations residing in the X site connected with SiO4 tetrahedra by sharing the two edges. The Raman shifts of all members within either of the series are attributed mainly to the properties of cations in the X site for the Fe-Al garnet series and in the Y site for the Ca-Fe garnet series. ?? 1994 Institute of Geochemistry, Chinese Academy of Sciences.

  2. Confocal Raman Microscopy

    CERN Document Server

    Dieing, Thomas; Toporski, Jan

    2011-01-01

    Confocal Raman Microscopy is a relatively new technique that allows chemical imaging without specific sample preparation. By integrating a sensitive Raman spectrometer within a state-of-the-art microscope, Raman microscopy with a spatial resolution down to 200nm laterally and 500nm vertically can be achieved using visible light excitation. Recent developments in detector and computer technology as well as optimized instrument design have reduced integration times of Raman spectra by orders of magnitude, so that complete images consisting of tens of thousands of Raman spectra can be acquired in seconds or minutes rather than hours, which used to be standard just one decade ago. The purpose of this book is to provide the reader a comprehensive overview of the rapidly developing field of Confocal Raman Microscopy and its applications.

  3. CFD-FEM coupling for accurate prediction of thermal fatigue

    International Nuclear Information System (INIS)

    Hannink, M.H.C.; Kuczaj, A.K.; Blom, F.J.; Church, J.M.; Komen, E.M.J.

    2009-01-01

    Thermal fatigue is a safety related issue in primary pipework systems of nuclear power plants. Life extension of current reactors and the design of a next generation of new reactors lead to growing importance of research in this direction. The thermal fatigue degradation mechanism is induced by temperature fluctuations in a fluid, which arise from mixing of hot and cold flows. Accompanied physical phenomena include thermal stratification, thermal striping, and turbulence [1]. Current plant instrumentation systems allow monitoring of possible causes as stratification and temperature gradients at fatigue susceptible locations [1]. However, high-cycle temperature fluctuations associated with turbulent mixing cannot be adequately detected by common thermocouple instrumentations. For a proper evaluation of thermal fatigue, therefore, numerical simulations are necessary that couple instantaneous fluid and solid interactions. In this work, a strategy for the numerical prediction of thermal fatigue is presented. The approach couples Computational Fluid Dynamics (CFD) and the Finite Element Method (FEM). For the development of the computational approach, a classical test case for the investigation of thermal fatigue problems is studied, i.e. mixing in a T-junction. Due to turbulent mixing of hot and cold fluids in two perpendicularly connected pipes, temperature fluctuations arise in the mixing zone downstream in the flow. Subsequently, these temperature fluctuations are also induced in the pipes. The stresses that arise due to the fluctuations may eventually lead to thermal fatigue. In the first step of the applied procedure, the temperature fluctuations in both fluid and structure are calculated using the CFD method. Subsequently, the temperature fluctuations in the structure are imposed as thermal loads in a FEM model of the pipes. A mechanical analysis is then performed to determine the thermal stresses, which are used to predict the fatigue lifetime of the structure

  4. Soft mode doublet in PbMg.sub.1/3./sub.Nb.sub.2/3./sub.O.sub.3./sub. relaxor investigated with hyper-Raman scattering

    Czech Academy of Sciences Publication Activity Database

    Al-Zein, A.; Hlinka, Jiří; Rouquette, J.; Hehlen, B.

    2010-01-01

    Roč. 105, č. 1 (2010), 017601/1-017601/4 ISSN 0031-9007 R&D Projects: GA ČR GAP204/10/0616 Institutional research plan: CEZ:AV0Z10100520 Keywords : PMN * relaxory * fonon * hyper -Raman scattering Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 7.621, year: 2010 http://link.aps.org/doi/10.1103/PhysRevLett.105.017601

  5. Determination of the fatigue properties of multilayer PVD coatings on various substrates, based on the impact test and its FEM simulation

    Energy Technology Data Exchange (ETDEWEB)

    Bouzakis, K.D.; Vidakis, N. [Aristotle Univ., Thessaloniki (Greece). Dept. of Mech. Eng.; Leyendecker, T.; Erkens, G.; Wenke, R.

    1997-10-31

    The coating impact test, in combination with its finite elements method (FEM) simulation, is used to quantitatively characterize the fatigue behaviour of thin hard physical vapour deposited (PVD) coatings as well as of multilayer ones. Successive impacts of a cemented carbide ball onto a plane coated specimen induce severe contact loads and strain superficially the layered compound. The fatigue failure mode of each specimen is classified by means of scanning electron microscope (SEM) observations, microspectral analyses and profilometry. FEM simulating models of the impact test are used to determine the critical stress components, which introduce coating fatigue failure. The FEM computational results are correlated to the experimental ones and used to interpret them quantitatively. Herewith, critical values for stress components, responsible for distinctive fatigue failure modes of the coating substrate compounds are obtained and the fatigue limits of the examined multilayer coatings are inserted in general applicable Smith diagrams. Furthermore, the derived critical stresses are verified by investigating the same multilayer coatings on different substrates. (orig.) 14 refs.

  6. FEM simulation of TBC failure in a model system

    Energy Technology Data Exchange (ETDEWEB)

    Seiler, P; Baeker, M; Roesier, J [Institut fuer Werkstoffe (IfW), Technische Universitaet Braunschweig (Germany); Beck, T; Schweda, M, E-mail: p.seiler@tu-bs.d [Institut fuer Energieforschung/ Werkstoffstruktur und -Eigenschaften (IEF 2), Forschungszentrum Juelich (Germany)

    2010-07-01

    In order to study the behavior of the complex failure mechanisms in thermal barrier coatings on turbine blades, a simplified model system is used to reduce the number of system parameters. The artificial system consists of a bond-coat material (fast creeping Fecralloy or slow creeping MA956) as the substrate with a Y{sub 2}O{sub 3} partially stabilized plasma sprayed zircon oxide TBC on top and a TGO between the two layers. A 2-dimensional FEM simulation was developed to calculate the growth stress inside the simplified coating system. The simulation permits the study of failure mechanisms by identifying compression and tension areas which are established by the growth of the oxide layer. This provides an insight into the possible crack paths in the coating and it allows to draw conclusions for optimizing real thermal barrier coating systems.

  7. FEM Techniques for High Stress Detection in Accelerated Fatigue Simulation

    Science.gov (United States)

    Veltri, M.

    2016-09-01

    This work presents the theory and a numerical validation study in support to a novel method for a priori identification of fatigue critical regions, with the aim to accelerate durability design in large FEM problems. The investigation is placed in the context of modern full-body structural durability analysis, where a computationally intensive dynamic solution could be required to identify areas with potential for fatigue damage initiation. The early detection of fatigue critical areas can drive a simplification of the problem size, leading to sensible improvement in solution time and model handling while allowing processing of the critical areas in higher detail. The proposed technique is applied to a real life industrial case in a comparative assessment with established practices. Synthetic damage prediction quantification and visualization techniques allow for a quick and efficient comparison between methods, outlining potential application benefits and boundaries.

  8. Raman selection rules and tensor elements for PMN-0.3PT single crystal

    International Nuclear Information System (INIS)

    Ge, Wanyin; Zhu, Wenliang; Pezzotti, Giuseppe

    2009-01-01

    Selection rules were put forward theoretically and Raman tensor elements experimentally determined for PMN-0.3PT single-crystal. Such a body of information was then employed to evaluate local domain orientation in a relaxor-based PMN-0.3PT material by means of polarized microprobe Raman spectroscopy. The dependence of Raman spectra upon crystal rotation under different polarized probe configurations was experimentally confirmed by collecting the intensity variation of selected Raman modes on Euler's angle rotation in a poled single-crystal. The periodicity of relative Raman intensity of selected Raman bands revealed symmetry properties. Upon exploiting such properties and with the knowledge of the Raman tensor elements from the A g and E g vibrational modes, a viable path becomes available to determine domain texture in relaxor-based PMN-PT materials with high spatial resolution. (copyright 2009 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  9. Generalized multiscale finite element methods (GMsFEM)

    KAUST Repository

    Efendiev, Yalchin R.; Galvis, Juan; Hou, Thomasyizhao

    2013-01-01

    In this paper, we propose a general approach called Generalized Multiscale Finite Element Method (GMsFEM) for performing multiscale simulations for problems without scale separation over a complex input space. As in multiscale finite element methods (MsFEMs), the main idea of the proposed approach is to construct a small dimensional local solution space that can be used to generate an efficient and accurate approximation to the multiscale solution with a potentially high dimensional input parameter space. In the proposed approach, we present a general procedure to construct the offline space that is used for a systematic enrichment of the coarse solution space in the online stage. The enrichment in the online stage is performed based on a spectral decomposition of the offline space. In the online stage, for any input parameter, a multiscale space is constructed to solve the global problem on a coarse grid. The online space is constructed via a spectral decomposition of the offline space and by choosing the eigenvectors corresponding to the largest eigenvalues. The computational saving is due to the fact that the construction of the online multiscale space for any input parameter is fast and this space can be re-used for solving the forward problem with any forcing and boundary condition. Compared with the other approaches where global snapshots are used, the local approach that we present in this paper allows us to eliminate unnecessary degrees of freedom on a coarse-grid level. We present various examples in the paper and some numerical results to demonstrate the effectiveness of our method. © 2013 Elsevier Inc.

  10. Generalized multiscale finite element methods (GMsFEM)

    KAUST Repository

    Efendiev, Yalchin R.

    2013-10-01

    In this paper, we propose a general approach called Generalized Multiscale Finite Element Method (GMsFEM) for performing multiscale simulations for problems without scale separation over a complex input space. As in multiscale finite element methods (MsFEMs), the main idea of the proposed approach is to construct a small dimensional local solution space that can be used to generate an efficient and accurate approximation to the multiscale solution with a potentially high dimensional input parameter space. In the proposed approach, we present a general procedure to construct the offline space that is used for a systematic enrichment of the coarse solution space in the online stage. The enrichment in the online stage is performed based on a spectral decomposition of the offline space. In the online stage, for any input parameter, a multiscale space is constructed to solve the global problem on a coarse grid. The online space is constructed via a spectral decomposition of the offline space and by choosing the eigenvectors corresponding to the largest eigenvalues. The computational saving is due to the fact that the construction of the online multiscale space for any input parameter is fast and this space can be re-used for solving the forward problem with any forcing and boundary condition. Compared with the other approaches where global snapshots are used, the local approach that we present in this paper allows us to eliminate unnecessary degrees of freedom on a coarse-grid level. We present various examples in the paper and some numerical results to demonstrate the effectiveness of our method. © 2013 Elsevier Inc.

  11. A FEM based methodology to simulate multiple crack propagation in friction stir welds

    DEFF Research Database (Denmark)

    Lepore, Marcello; Carlone, Pierpaolo; Berto, Filippo

    2017-01-01

    . The residual stress field was inferred by a thermo-mechanical FEM simulation of the process, considering temperature dependent elastic-plastic material properties, material softening and isotropic hardening. Afterwards, cracks introduced in the selected location of FEM computational domain allow stress...

  12. Uncertainty assessment of a dike with an anchored sheet pile wall using FEM

    NARCIS (Netherlands)

    Rippi, Aikaterini; Nuttall, Jonathan; Teixeira, Ana; Schweckendiek, T.; Lang, M.; Klijn, F.; Samuels, P.

    2016-01-01

    The Dutch design codes for the dikes with retaining walls rely on Finite Element Analysis (FEM) in combination with partial safety factors. However, this can lead to conservative designs. For this reason, in this study, a reliability analysis is carried out with FEM calculations aiming to

  13. Simulations of e-beam emittance effects on the performance of the fusion-FEM

    NARCIS (Netherlands)

    Tulupov, A. V.; Caplan, M.; Urbanus, W. H.

    1996-01-01

    At the FOM-Institute for Plasma Physics, The Netherlands, the construction of the Fusion Free-Electron Maser (FEM) is nearing completion. The design objective of the FEM is to generate 1 MW of microwave power during long pulses in the frequency range of 130 to 260 GHz [1,2]. Applications are in the

  14. Nonlinear observer design for a nonlinear string/cable FEM model using contraction theory

    DEFF Research Database (Denmark)

    Turkyilmaz, Yilmaz; Jouffroy, Jerome; Egeland, Olav

    model is presented in the form of partial differential equations (PDE). Galerkin's method is then applied to obtain a set of ordinary differential equations such that the cable model is approximated by a FEM model. Based on the FEM model, a nonlinear observer is designed to estimate the cable...

  15. Transmission electron microscopy and Raman characterization of copper (I) oxide microspheres composed of nanoparticles

    International Nuclear Information System (INIS)

    Wang Wenzhong; Tu Ya; Wang Lijuan; Liang Yujie; Shi Honglong

    2013-01-01

    Highlights: ► Raman spectroscopy of copper (I) oxide microspheres were investigated. ► Infrared active mode is greatly activated in Raman scattering spectrum. ► Infrared active mode shows up in Raman spectrum of copper (I) oxide microspheres. ► The defects existed in spheres could be responsible for the observed Raman property. - Abstract: The high-resolution transmission electron microscope and Raman spectroscopy were used to investigate the microstructures and Raman scattering property of copper (I) oxide microspheres composed of nanoparticles. High-resolution transmission electron microscope images indicate that the copper (I) oxide microspheres are composed of nanoparticles with random growth direction, indicating that there are many defects in microspheres. The Raman spectrum shows that infrared active mode, which must be odd parity and is Raman forbidden for bulk crystal due to its inversion symmetry, is activated and shows up in Raman scattering spectrum. On the basis of investigations of the microstructure features of copper (I) oxide microspheres, we attribute the appearance of IR active mode in Raman scattering spectrum to the breakdown of the symmetry of the lattice due to the presence of defects in the prepared copper (I) oxide microspheres as observed in HRTEM images.

  16. Raman scattering of rare earth hexaborides

    International Nuclear Information System (INIS)

    Ogita, Norio; Hasegawa, Takumi; Udagawa, Masayuki; Iga, Fumitoshi; Kunii, Satoru

    2009-01-01

    Raman scattering spectra were measured for the rare-earth hexaborides RB 6 (R = Ce, Gd, or Dy). All Raman-active phonons due to B 6 vibrations were observed in the range 600 - 1400 cm -1 . Anomalous peaks were detected below 200 cm -1 , which correspond to vibrations of rare-earth ion excited by second-order Raman scattering process. The intensity and energy of the rare-earth mode decrease with decreasing temperature. This suggests that the rare-earth ion vibrates in a shallow and anharmonic potential due to the boron cage. Using the reported values of mean square displacement of rare-earth ion, we estimated the anharmonic contribution for the rare-earth vibrations.

  17. Anomalous Polarized Raman Scattering and Large Circular Intensity Differential in Layered Triclinic ReS2.

    Science.gov (United States)

    Zhang, Shishu; Mao, Nannan; Zhang, Na; Wu, Juanxia; Tong, Lianming; Zhang, Jin

    2017-10-24

    The Raman tensor of a crystal is the derivative of its polarizability tensor and is dependent on the symmetries of the crystal and the Raman-active vibrational mode. The intensity of a particular mode is determined by the Raman selection rule, which involves the Raman tensor and the polarization configurations. For anisotropic two-dimensional (2D) layered crystals, polarized Raman scattering has been used to reveal the crystalline orientations. However, due to its complicated Raman tensors and optical birefringence, the polarized Raman scattering of triclinic 2D crystals has not been well studied yet. Herein, we report the anomalous polarized Raman scattering of 2D layered triclinic rhenium disulfide (ReS 2 ) and show a large circular intensity differential (CID) of Raman scattering in ReS 2 of different thicknesses. The origin of CID and the anomalous behavior in polarized Raman scattering were attributed to the appearance of nonzero off-diagonal Raman tensor elements and the phase factor owing to optical birefringence. This can provide a method to identify the vertical orientation of triclinic layered materials. These findings may help to further understand the Raman scattering process in 2D materials of low symmetry and may indicate important applications in chiral recognition by using 2D materials.

  18. Raman spectroscopy in graphene

    International Nuclear Information System (INIS)

    Malard, L.M.; Pimenta, M.A.; Dresselhaus, G.; Dresselhaus, M.S.

    2009-01-01

    Recent Raman scattering studies in different types of graphene samples are reviewed here. We first discuss the first-order and the double resonance Raman scattering mechanisms in graphene, which give rise to the most prominent Raman features. The determination of the number of layers in few-layer graphene is discussed, giving special emphasis to the possibility of using Raman spectroscopy to distinguish a monolayer from few-layer graphene stacked in the Bernal (AB) configuration. Different types of graphene samples produced both by exfoliation and using epitaxial methods are described and their Raman spectra are compared with those of 3D crystalline graphite and turbostratic graphite, in which the layers are stacked with rotational disorder. We show that Resonance Raman studies, where the energy of the excitation laser line can be tuned continuously, can be used to probe electrons and phonons near the Dirac point of graphene and, in particular allowing a determination to be made of the tight-binding parameters for bilayer graphene. The special process of electron-phonon interaction that renormalizes the phonon energy giving rise to the Kohn anomaly is discussed, and is illustrated by gated experiments where the position of the Fermi level can be changed experimentally. Finally, we discuss the ability of distinguishing armchair and zig-zag edges by Raman spectroscopy and studies in graphene nanoribbons in which the Raman signal is enhanced due to resonance with singularities in the density of electronic states.

  19. Raman fiber lasers

    CERN Document Server

    2017-01-01

    This book serves as a comprehensive, up-to-date reference about this cutting-edge laser technology and its many new and interesting developments. Various aspects and trends of Raman fiber lasers are described in detail by experts in their fields. Raman fiber lasers have progressed quickly in the past decade, and have emerged as a versatile laser technology for generating high power light sources covering a spectral range from visible to mid-infrared. The technology is already being applied in the fields of telecommunication, astronomy, cold atom physics, laser spectroscopy, environmental sensing, and laser medicine. This book covers various topics relating to Raman fiber laser research, including power scaling, cladding and diode pumping, cascade Raman shifting, single frequency operation and power amplification, mid-infrared laser generation, specialty optical fibers, and random distributed feedback Raman fiber lasers. The book will appeal to scientists, students, and technicians seeking to understand the re...

  20. Polarization Sensitive Coherent Raman Measurements of DCVJ

    Science.gov (United States)

    Anderson, Josiah; Cooper, Nathan; Lawhead, Carlos; Shiver, Tegan; Ujj, Laszlo

    2014-03-01

    Coherent Raman spectroscopy which recently developed into coherent Raman microscopy has been used to produce label free imaging of thin layers of material and find the spatial distributions of certain chemicals within samples, e.g. cancer cells.(1) Not all aspects of coherent scattering have been used for imaging. Among those for example are special polarization sensitive measurements. Therefore we have investigated the properties of polarization sensitive CARS spectra of a highly fluorescent molecule, DCVJ.(2) Spectra has been recorded by using parallel polarized and perpendicular polarized excitations. A special polarization arrangement was developed to suppress the non-resonant background scattering from the sample. These results can be used to improve the imaging properties of a coherent Raman microscope in the future. This is the first time coherent Raman polarization sensitive measurements have been used to characterize the vibrational modes of DCVJ. 1: K. I. Gutkowski, et al., ``Fluorescence of dicyanovinyl julolidine in a room temperature ionic liquid '' Chemical Physics Letters 426 (2006) 329 - 333 2: Fouad El-Diasty, ``Coherent anti-Stokes Raman scattering: Spectroscopy and microscopy'' Vibrational Spectroscopy 55 (2011) 1-37

  1. Study on vibration characteristics of the shaft system for a dredging pump based on FEM

    International Nuclear Information System (INIS)

    Zhai, L M; Liu, X; He, L Y; Wang, Z W; Qin, L; Liu, C Y; He, Y

    2012-01-01

    The dynamic characteristics of the shaft system for a dredging pump were studied with the Finite Element Method (FEM) by SAMCEF ROTOR. At first, the influence of the fluid-solid coupling interaction of mud water and impeller, water sealing and pump shaft on the lateral critical speeds were analyzed. The results indicated that the mud water must be taken into consideration, while the water sealing need not to. Then the effects of radial and thrust rolling bearings on the lateral critical speeds were discussed, which shows that the radial bearing close to the impeller has greatest impact on the 1st order critical speed. At last, the upper and lower limits of the critical speeds of lateral, axial and torsional vibration were calculated. The rated speed of the dredging pump was far less than the predicted critical speed, which can ensure the safe operation of the unit. Each vibration mode is also shown in this paper. This dynamic analysis method offers some reference value on the research of vibration and stability of the shaft system in dredging pump.

  2. The fusion-FEM: 0,75 MW of mm-wave power

    Energy Technology Data Exchange (ETDEWEB)

    Smeets, P.H.M.; Bongers, W.A.; Brons, S.; Geer, C.A.J. van der; Lingier, K.L.; Manintveld, P.; Plomp, J.; Pluygers, J.; Poelman, A.J.; Sterk, A.B.; Verhoeven, A.G.A.; Urbanus, W.H. [FOM Inst. voor Plasmafysica ' Rijnhuizen' , Nieuwegein (Netherlands); Bratman, V.L.; Denisov, G.G.; Savilov, A.V. [Inst. of Applied Physics, Nizhny Novgorod (Russian Federation); Caplan, M. [Lawrence Livermore National Lab., CA (United States); Varfolomeev, A.A. [Russian Research Center ' Kurchatov Inst.' , Moscow (Russian Federation)

    1998-07-01

    The free-electron maser for fusion applications (Fusion-FEM) is the prototype for a high power, rapid tunable mm-wave source. The basic parameters such as frequency range (130 - 260 GHz) and output power (1 MW) are dedicated to Electron Cyclotron Resonance applications on future plasma fusion research devices, such as ITER. In October 1996 the electron beam was successfully accelerated and transported through the undulator and the mm-wave cavity. Loss currents are below 0.05 %. In October 1997 first lasing was achieved. The mm-wave output power has been measured at various frequencies and for various electron beam currents and energies. The highest output power reached so far is 730 kW at 205 GHz, for an electron beam of 7.2 A and 1.77 MeV. Both output power and start-up time correspond well with simulation results. The output beam has a Gaussian mode content of more than 99.8 % for all operating frequencies. So far, the pulse length was limited to 12{mu}s, because the electron beam recovery system was not yet installed. This system, an electron decelerator and a 3-stage depressed collector, is presently under construction. It serves to recover the charge and energy of the spend electron beam. In this paper we will address some aspects of the design of the collector. (author)

  3. The fusion-FEM: 0,75 MW of mm-wave power

    International Nuclear Information System (INIS)

    Smeets, P.H.M.; Bongers, W.A.; Brons, S.; Geer, C.A.J. van der; Lingier, K.L.; Manintveld, P.; Plomp, J.; Pluygers, J.; Poelman, A.J.; Sterk, A.B.; Verhoeven, A.G.A.; Urbanus, W.H.; Bratman, V.L.; Denisov, G.G.; Savilov, A.V.; Caplan, M.; Varfolomeev, A.A.

    1998-01-01

    The free-electron maser for fusion applications (Fusion-FEM) is the prototype for a high power, rapid tunable mm-wave source. The basic parameters such as frequency range (130 - 260 GHz) and output power (1 MW) are dedicated to Electron Cyclotron Resonance applications on future plasma fusion research devices, such as ITER. In October 1996 the electron beam was successfully accelerated and transported through the undulator and the mm-wave cavity. Loss currents are below 0.05 %. In October 1997 first lasing was achieved. The mm-wave output power has been measured at various frequencies and for various electron beam currents and energies. The highest output power reached so far is 730 kW at 205 GHz, for an electron beam of 7.2 A and 1.77 MeV. Both output power and start-up time correspond well with simulation results. The output beam has a Gaussian mode content of more than 99.8 % for all operating frequencies. So far, the pulse length was limited to 12μs, because the electron beam recovery system was not yet installed. This system, an electron decelerator and a 3-stage depressed collector, is presently under construction. It serves to recover the charge and energy of the spend electron beam. In this paper we will address some aspects of the design of the collector. (author)

  4. A two-step FEM-SEM approach for wave propagation analysis in cable structures

    Science.gov (United States)

    Zhang, Songhan; Shen, Ruili; Wang, Tao; De Roeck, Guido; Lombaert, Geert

    2018-02-01

    Vibration-based methods are among the most widely studied in structural health monitoring (SHM). It is well known, however, that the low-order modes, characterizing the global dynamic behaviour of structures, are relatively insensitive to local damage. Such local damage may be easier to detect by methods based on wave propagation which involve local high frequency behaviour. The present work considers the numerical analysis of wave propagation in cables. A two-step approach is proposed which allows taking into account the cable sag and the distribution of the axial forces in the wave propagation analysis. In the first step, the static deformation and internal forces are obtained by the finite element method (FEM), taking into account geometric nonlinear effects. In the second step, the results from the static analysis are used to define the initial state of the dynamic analysis which is performed by means of the spectral element method (SEM). The use of the SEM in the second step of the analysis allows for a significant reduction in computational costs as compared to a FE analysis. This methodology is first verified by means of a full FE analysis for a single stretched cable. Next, simulations are made to study the effects of damage in a single stretched cable and a cable-supported truss. The results of the simulations show how damage significantly affects the high frequency response, confirming the potential of wave propagation based methods for SHM.

  5. Vibrational modes and Structure of Niobium(V) Oxosulfato Complexes in the Molten Nb2O5-K2S2O7-K2SO4 System Studied by Raman Spectroscopy

    DEFF Research Database (Denmark)

    Paulsen, Andreas L.; Borup, Flemming; Berg, Rolf W.

    2010-01-01

    The structural and vibrational properties of NbV oxosulfato complexes formed in Nb2O5-K2S2O7 and Nb2O5-K2S2O7-K2SO4 molten mixtures with 0 ... for the binary Nb2O5-K2S2O7 molten system indicate that the dissolution of Nb2O5 proceeds with consumption of S2O7 leading to the formation of a NbV oxosulfato complex according to Nb2O5 + nS2O7 --> C2n-; a simple formalism exploiting the relative Raman band intensities is used for determining the stoichiometric...... coefficient, n, pointing to n = 3 and to the following reaction: Nb2O5 + 3S2O7 --> 2NbO(SO4)3, which is consistent with the Raman spectra of the molten mixtures. Nb2O5 could be dissolved much easier when K2SO4 was present in an equimolar (1:1) SO4/Nb ratio; the incremental presence of K2SO4 in Nb2O5-K2S2O7...

  6. Infrared absorption and Raman scattering spectroscopic studies of condensed ions

    International Nuclear Information System (INIS)

    Dao, N.Q.; Knidiri, M.

    1975-01-01

    Infrared and Raman spectra of the complex K 5 (UO 2 ) 2 F 9 were recorded in the region 4000 to 80 cm -1 . Factor group analysis was used to classify the internal vibrations of the binuclear ion (UO 2 ) 2 F 9 5- . Infrared and Raman spectra were assigned and splitting of the internal modes of the (UO 2 ) 2 F 9 5- anion interpreted. (author)

  7. Confocal Raman microscopy

    CERN Document Server

    Dieing, Thomas; Hollricher, Olaf

    2018-01-01

    This second edition provides a cutting-edge overview of physical, technical and scientific aspects related to the widely used analytical method of confocal Raman microscopy. The book includes expanded background information and adds insights into how confocal Raman microscopy, especially 3D Raman imaging, can be integrated with other methods to produce a variety of correlative microscopy combinations. The benefits are then demonstrated and supported by numerous examples from the fields of materials science, 2D materials, the life sciences, pharmaceutical research and development, as well as the geosciences.

  8. A FEM-based method to determine the complex material properties of piezoelectric disks.

    Science.gov (United States)

    Pérez, N; Carbonari, R C; Andrade, M A B; Buiochi, F; Adamowski, J C

    2014-08-01

    Numerical simulations allow modeling piezoelectric devices and ultrasonic transducers. However, the accuracy in the results is limited by the precise knowledge of the elastic, dielectric and piezoelectric properties of the piezoelectric material. To introduce the energy losses, these properties can be represented by complex numbers, where the real part of the model essentially determines the resonance frequencies and the imaginary part determines the amplitude of each resonant mode. In this work, a method based on the Finite Element Method (FEM) is modified to obtain the imaginary material properties of piezoelectric disks. The material properties are determined from the electrical impedance curve of the disk, which is measured by an impedance analyzer. The method consists in obtaining the material properties that minimize the error between experimental and numerical impedance curves over a wide range of frequencies. The proposed methodology starts with a sensitivity analysis of each parameter, determining the influence of each parameter over a set of resonant modes. Sensitivity results are used to implement a preliminary algorithm approaching the solution in order to avoid the search to be trapped into a local minimum. The method is applied to determine the material properties of a Pz27 disk sample from Ferroperm. The obtained properties are used to calculate the electrical impedance curve of the disk with a Finite Element algorithm, which is compared with the experimental electrical impedance curve. Additionally, the results were validated by comparing the numerical displacement profile with the displacements measured by a laser Doppler vibrometer. The comparison between the numerical and experimental results shows excellent agreement for both electrical impedance curve and for the displacement profile over the disk surface. The agreement between numerical and experimental displacement profiles shows that, although only the electrical impedance curve is

  9. Polarized Raman scattering of single ZnO nanorod

    International Nuclear Information System (INIS)

    Yu, J. L.; Lai, Y. F.; Wang, Y. Z.; Cheng, S. Y.; Chen, Y. H.

    2014-01-01

    Polarized Raman scattering measurement on single wurtzite c-plane (001) ZnO nanorod grown by hydrothermal method has been performed at room temperature. The polarization dependence of the intensity of the Raman scattering for the phonon modes A 1 (TO), E 1 (TO), and E 2 high in the ZnO nanorod are obtained. The deviations of polarization-dependent Raman spectroscopy from the prediction of Raman selection rules are observed, which can be attributed to the structure defects in the ZnO nanorod as confirmed by the comparison of the transmission electron microscopy, photoluminescence spectra as well as the polarization dependent Raman signal of the annealed and unannealed ZnO nanorod. The Raman tensor elements of A 1 (TO) and E 1 (TO) phonon modes normalized to that of the E 2 high phonon mode are |a/d|=0.32±0.01, |b/d|=0.49±0.02, and |c/d|=0.23±0.01 for the unannealed ZnO nanorod, and |a/d|=0.33±0.01, |b/d|=0.45±0.01, and |c/d|=0.20±0.01 for the annealed ZnO nanorod, which shows strong anisotropy compared to that of bulk ZnO epilayer

  10. Modelling Sawing of Metal Tubes Through FEM Simulation

    International Nuclear Information System (INIS)

    Bort, C. M. Giorgio; Bosetti, P.; Bruschi, S.

    2011-01-01

    The paper presents the development of a numerical model of the sawing process of AISI 304 thin tubes, which is cut through a circular blade with alternating roughing and finishing teeth. The numerical simulation environment is the three-dimensional FEM software Deform v.10.1. The teeth actual trajectories were determined by a blade kinematics analysis developed in Matlab. Due to the manufacturing rolling steps and subsequent welding stage, the tube material is characterized by a gradient of properties along its thickness. Consequently, a simplified cutting test was set up and carried out in order to identify the values of relevant material parameters to be used in the numerical model. The dedicated test was the Orthogonal Tube Cutting test (OTC), which was performed on an instrumented lathe. The proposed numerical model was validated by comparing numerical results and experimental data obtained from sawing tests carried out on an industrial machine. The following outputs were compared: the cutting force, the chip thickness, and the chip contact area.

  11. Modelling Sawing of Metal Tubes Through FEM Simulation

    Science.gov (United States)

    Bort, C. M. Giorgio; Bosetti, P.; Bruschi, S.

    2011-05-01

    The paper presents the development of a numerical model of the sawing process of AISI 304 thin tubes, which is cut through a circular blade with alternating roughing and finishing teeth. The numerical simulation environment is the three-dimensional FEM software Deform™ v.10.1. The teeth actual trajectories were determined by a blade kinematics analysis developed in Matlab™. Due to the manufacturing rolling steps and subsequent welding stage, the tube material is characterized by a gradient of properties along its thickness. Consequently, a simplified cutting test was set up and carried out in order to identify the values of relevant material parameters to be used in the numerical model. The dedicated test was the Orthogonal Tube Cutting test (OTC), which was performed on an instrumented lathe. The proposed numerical model was validated by comparing numerical results and experimental data obtained from sawing tests carried out on an industrial machine. The following outputs were compared: the cutting force, the chip thickness, and the chip contact area.

  12. Charge-conserving FEM-PIC schemes on general grids

    International Nuclear Information System (INIS)

    Campos Pinto, M.; Jund, S.; Salmon, S.; Sonnendruecker, E.

    2014-01-01

    Particle-In-Cell (PIC) solvers are a major tool for the understanding of the complex behavior of a plasma or a particle beam in many situations. An important issue for electromagnetic PIC solvers, where the fields are computed using Maxwell's equations, is the problem of discrete charge conservation. In this article, we aim at proposing a general mathematical formulation for charge-conserving finite-element Maxwell solvers coupled with particle schemes. In particular, we identify the finite-element continuity equations that must be satisfied by the discrete current sources for several classes of time-domain Vlasov-Maxwell simulations to preserve the Gauss law at each time step, and propose a generic algorithm for computing such consistent sources. Since our results cover a wide range of schemes (namely curl-conforming finite element methods of arbitrary degree, general meshes in two or three dimensions, several classes of time discretization schemes, particles with arbitrary shape factors and piecewise polynomial trajectories of arbitrary degree), we believe that they provide a useful roadmap in the design of high-order charge-conserving FEM-PIC numerical schemes. (authors)

  13. Adaptive stochastic Galerkin FEM with hierarchical tensor representations

    KAUST Repository

    Eigel, Martin

    2016-01-08

    PDE with stochastic data usually lead to very high-dimensional algebraic problems which easily become unfeasible for numerical computations because of the dense coupling structure of the discretised stochastic operator. Recently, an adaptive stochastic Galerkin FEM based on a residual a posteriori error estimator was presented and the convergence of the adaptive algorithm was shown. While this approach leads to a drastic reduction of the complexity of the problem due to the iterative discovery of the sparsity of the solution, the problem size and structure is still rather limited. To allow for larger and more general problems, we exploit the tensor structure of the parametric problem by representing operator and solution iterates in the tensor train (TT) format. The (successive) compression carried out with these representations can be seen as a generalisation of some other model reduction techniques, e.g. the reduced basis method. We show that this approach facilitates the efficient computation of different error indicators related to the computational mesh, the active polynomial chaos index set, and the TT rank. In particular, the curse of dimension is avoided.

  14. Applications of ATILA FEM software to smart materials case studies in designing devices

    CERN Document Server

    Uchino, Kenji

    2013-01-01

    ATILA Finite Element Method (FEM) software facilitates the modelling and analysis of applications using piezoelectric, magnetostrictor and shape memory materials. It allows entire designs to be constructed, refined and optimized before production begins. Through a range of instructive case studies, Applications of ATILA FEM software to smart materials provides an indispensable guide to the use of this software in the design of effective products.Part one provides an introduction to ATILA FEM software, beginning with an overview of the software code. New capabilities and loss integratio

  15. Development of an artificial neural network model integrated with constitutive and FEM models

    International Nuclear Information System (INIS)

    Kong, L.X.; Hodgson, P.D.

    2000-01-01

    Although the standard error of IPANN model developed by Kong and Hodgson is lower than the constitutive model, it is found that the prediction of reaction force and torque during rolling with FEM is less accurate for IPANN model in some deformation regions. It is the summation of the product of the strain and stress in the deformation range, which contributes most to the precise prediction. An ANN model is therefore, developed in this work by integrating both the IPANN and FEM models. It is found that the integrated IPANN and FEM model is the most accurate model. (author)

  16. Coupled FEM-DBEM method to assess crack growth in magnet system of Wendelstein 7-X

    Directory of Open Access Journals (Sweden)

    R. Citarella

    2013-10-01

    Full Text Available The fivefold symmetric modular stellarator Wendelstein 7-X (W7-X is currently under construction in Greifswald, Germany. The superconducting coils of the magnet system are bolted onto a central support ring and interconnected with five so-called lateral support elements (LSEs per half module. After welding of the LSE hollow boxes to the coil cases, cracks were found in the vicinity of the welds that could potentially limit the allowed number N of electromagnetic (EM load cycles of the machine. In response to the appearance of first cracks during assembly, the Stress Intensity Factors (SIFs were calculated and corresponding crack growth rates of theoretical semi-circular cracks of measured sizes in potentially critical position and orientation were predicted using Paris’ law, whose parameters were calibrated in fatigue tests at cryogenic temperature. In this paper the Dual Boundary Element Method (DBEM is applied in a coupled FEM-DBEM approach to analyze the propagation of multiple cracks with different shapes. For this purpose, the crack path is assessed with the Minimum Strain Energy density criterion and SIFs are calculated by the J-integral approach. The Finite Element Method (FEM is adopted to model, using the commercial codes Ansys or Abaqus;, the overall component whereas the submodel analysis, in the volume surrounding the cracked area, is performed by FEM (“FEM-FEM approach” or alternatively by DBEM (“FEM-DBEM approach”. The “FEM-FEM approach” considers a FEM submodel, that is extracted from the FEM global model; the latter provide the boundary conditions for the submodel. Such approach is affected by some restrictions in the crack propagation phase, whereas, with the “FEM-DBEM approach”, the crack propagation simulation is straightforward. In this case the submodel is created in a DBEM environment with boundary conditions provided by the global FEM analysis; then the crack is introduced and a crack propagation analysis

  17. A FEM Modeling of the Concrete Pavement Made of the Recycling Material

    Directory of Open Access Journals (Sweden)

    Šešlija Miloš

    2016-01-01

    Full Text Available Paper is a brief review of the research focused on formulation an numerical model for the concrete pavement which is made by the recycling material. For numerical modeling the finite element model (FEM and the 3D finite element model were applied. The software EverFE 2.25, was used. The results of FEM analysis is in a chapter shape showing move value change, strees and deflections for all layers a construction road model. In the next phase of the research was provided by FEM software with appropriate general purpose non-linear models, which allows the analysis of the real behavior of solid pavement under load.

  18. Bolt-Grout Interactions in Elastoplastic Rock Mass Using Coupled FEM-FDM Techniques

    Directory of Open Access Journals (Sweden)

    Debasis Deb

    2010-01-01

    Full Text Available Numerical procedure based on finite element method (FEM and finite difference method (FDM for the analysis of bolt-grout interactions are introduced in this paper. The finite element procedure incorporates elasto-plastic concepts with Hoek and Brown yield criterion and has been applied for rock mass. Bolt-grout interactions are evaluated based on finite difference method and are embedded in the elasto-plastic procedures of FEM. The experimental validation of the proposed FEM-FDM procedures and numerical examples of a bolted tunnel are provided to demonstrate the efficacy of the proposed method for practical applications.

  19. Differentiating the growth phases of single bacteria using Raman spectroscopy

    Science.gov (United States)

    Strola, S. A.; Marcoux, P. R.; Schultz, E.; Perenon, R.; Simon, A.-C.; Espagnon, I.; Allier, C. P.; Dinten, J.-M.

    2014-03-01

    In this paper we present a longitudinal study of bacteria metabolism performed with a novel Raman spectrometer system. Longitudinal study is possible with our Raman setup since the overall procedure to localize a single bacterium and collect a Raman spectrum lasts only 1 minute. Localization and detection of single bacteria are performed by means of lensfree imaging, whereas Raman signal (from 600 to 3200 cm-1) is collected into a prototype spectrometer that allows high light throughput (HTVS technology, Tornado Spectral System). Accomplishing time-lapse Raman spectrometry during growth of bacteria, we observed variation in the net intensities for some band groups, e.g. amides and proteins. The obtained results on two different bacteria species, i.e. Escherichia coli and Bacillus subtilis clearly indicate that growth affects the Raman chemical signature. We performed a first analysis to check spectral differences and similarities. It allows distinguishing between lag, exponential and stationary growth phases. And the assignment of interest bands to vibration modes of covalent bonds enables the monitoring of metabolic changes in bacteria caused by growth and aging. Following the spectra analysis, a SVM (support vector machine) classification of the different growth phases is presented. In sum this longitudinal study by means of a compact and low-cost Raman setup is a proof of principle for routine analysis of bacteria, in a real-time and non-destructive way. Real-time Raman studies on metabolism and viability of bacteria pave the way for future antibiotic susceptibility testing.

  20. Shot-Noise Limited Time-Encoded Raman Spectroscopy

    Directory of Open Access Journals (Sweden)

    Sebastian Karpf

    2017-01-01

    Full Text Available Raman scattering, an inelastic scattering mechanism, provides information about molecular excitation energies and can be used to identify chemical compounds. Albeit being a powerful analysis tool, especially for label-free biomedical imaging with molecular contrast, it suffers from inherently low signal levels. This practical limitation can be overcome by nonlinear enhancement techniques like stimulated Raman scattering (SRS. In SRS, an additional light source stimulates the Raman scattering process. This can lead to orders of magnitude increase in signal levels and hence faster acquisition in biomedical imaging. However, achieving a broad spectral coverage in SRS is technically challenging and the signal is no longer background-free, as either stimulated Raman gain (SRG or loss (SRL is measured, turning a sensitivity limit into a dynamic range limit. Thus, the signal has to be isolated from the laser background light, requiring elaborate methods for minimizing detection noise. Here, we analyze the detection sensitivity of a shot-noise limited broadband stimulated time-encoded Raman (TICO-Raman system in detail. In time-encoded Raman, a wavelength-swept Fourier domain mode locking (FDML laser covers a broad range of Raman transition energies while allowing a dual-balanced detection for lowering the detection noise to the fundamental shot-noise limit.

  1. RACK1 downregulates levels of the pro-apoptotic protein Fem1b in apoptosis-resistant colon cancer cells.

    Science.gov (United States)

    Subauste, M Cecilia; Ventura-Holman, Tereza; Du, Liqin; Subauste, Jose S; Chan, Shing-Leng; Yu, Victor C; Maher, Joseph F

    2009-12-01

    Evasion of apoptosis plays an important role in colon cancer progression. Following loss of the Apc tumor suppressor gene in mice, the gene encoding Fem1b is upregulated early in neoplastic intestinal epithelium. Fem1b is a pro-apoptotic protein that interacts with Fas, TNFR1 and Apaf-1, and increased expression of Fem1b induces apoptosis of cancer cells. Fem1b is a homolog of FEM-1, a protein in Caenorhabditis elegans that is negatively regulated by ubiquitination and proteasomal degradation. To study Fem1b regulation in colon cancer progression, we used apoptotis-sensitive SW480 cells, derived from a primary colon cancer, and their isogenic, apoptosis-resistant counterparts SW620 cells, derived from a subsequent metastatic lesion in the same patient. Treatment with proteasome inhibitor increased Fem1b protein levels in SW620 cells, but not in SW480 cells. In SW620 cells we found that endogenous Fem1b co-immunoprecipitates in complexes with RACK1, a protein known to mediate ubiquitination and proteasomal degradation of other pro-apoptotic proteins and to be upregulated in colon cancer. Full-length Fem1b, or the N-terminal region of Fem1b, associated with RACK1 when co-expressed in HEK293T cells, and RACK1 stimulated ubiquitination of Fem1b. RACK1 overexpression in SW620 cells led to downregulation of Fem1b protein levels. Conversely, downregulation of RACK1 led to upregulation of Fem1b protein levels, associated with induction of apoptosis, and this apoptosis was inhibited by blocking Fem1b protein upregulation. In conclusion, RACK1 downregulates levels of the pro-apoptotic protein Fem1b in metastatic, apoptosis-resistant colon cancer cells, which may promote apoptosis-resistance during progression of colon cancer.

  2. 3D finite element simulation of optical modes in VCSELs

    OpenAIRE

    Rozova, M.; Pomplun, J.; Zschiedrich, L.; Schmidt, F.; Burger, S.

    2011-01-01

    We present a finite element method (FEM) solver for computation of optical resonance modes in VCSELs. We perform a convergence study and demonstrate that high accuracies for 3D setups can be attained on standard computers. We also demonstrate simulations of thermo-optical effects in VCSELs.

  3. Holographic Raman lidar

    International Nuclear Information System (INIS)

    Andersen, G.

    2000-01-01

    Full text: We have constructed a Raman lidar system that incorporates a holographic optical element. By resolving just 3 nitrogen lines in the Resonance Raman spectroscopy (RRS) spectrum, temperature fits as good as 1% at altitudes of 20km can be made in 30 minutes. Due to the narrowband selectivity of the HOE, the lidar provides measurements over a continuous 24hr period. By adding a 4th channel to capture the Rayleigh backscattered light, temperature profiles can be extended to 80km

  4. Application of multi-thread computing and domain decomposition to the 3-D neutronics Fem code Cronos

    International Nuclear Information System (INIS)

    Ragusa, J.C.

    2003-01-01

    The purpose of this paper is to present the parallelization of the flux solver and the isotopic depletion module of the code, either using Message Passing Interface (MPI) or OpenMP. Thread parallelism using OpenMP was used to parallelize the mixed dual FEM (finite element method) flux solver MINOS. Investigations regarding the opportunity of mixing parallelism paradigms will be discussed. The isotopic depletion module was parallelized using domain decomposition and MPI. An attempt at using OpenMP was unsuccessful and will be explained. This paper is organized as follows: the first section recalls the different types of parallelism. The mixed dual flux solver and its parallelization are then presented. In the third section, we describe the isotopic depletion solver and its parallelization; and finally conclude with some future perspectives. Parallel applications are mandatory for fine mesh 3-dimensional transport and simplified transport multigroup calculations. The MINOS solver of the FEM neutronics code CRONOS2 was parallelized using the directive based standard OpenMP. An efficiency of 80% (resp. 60%) was achieved with 2 (resp. 4) threads. Parallelization of the isotopic depletion solver was obtained using domain decomposition principles and MPI. Efficiencies greater than 90% were reached. These parallel implementations were tested on a shared memory symmetric multiprocessor (SMP) cluster machine. The OpenMP implementation in the solver MINOS is only the first step towards fully using the SMPs cluster potential with a mixed mode parallelism. Mixed mode parallelism can be achieved by combining message passing interface between clusters with OpenMP implicit parallelism within a cluster

  5. Application of multi-thread computing and domain decomposition to the 3-D neutronics Fem code Cronos

    Energy Technology Data Exchange (ETDEWEB)

    Ragusa, J.C. [CEA Saclay, Direction de l' Energie Nucleaire, Service d' Etudes des Reacteurs et de Modelisations Avancees (DEN/SERMA), 91 - Gif sur Yvette (France)

    2003-07-01

    The purpose of this paper is to present the parallelization of the flux solver and the isotopic depletion module of the code, either using Message Passing Interface (MPI) or OpenMP. Thread parallelism using OpenMP was used to parallelize the mixed dual FEM (finite element method) flux solver MINOS. Investigations regarding the opportunity of mixing parallelism paradigms will be discussed. The isotopic depletion module was parallelized using domain decomposition and MPI. An attempt at using OpenMP was unsuccessful and will be explained. This paper is organized as follows: the first section recalls the different types of parallelism. The mixed dual flux solver and its parallelization are then presented. In the third section, we describe the isotopic depletion solver and its parallelization; and finally conclude with some future perspectives. Parallel applications are mandatory for fine mesh 3-dimensional transport and simplified transport multigroup calculations. The MINOS solver of the FEM neutronics code CRONOS2 was parallelized using the directive based standard OpenMP. An efficiency of 80% (resp. 60%) was achieved with 2 (resp. 4) threads. Parallelization of the isotopic depletion solver was obtained using domain decomposition principles and MPI. Efficiencies greater than 90% were reached. These parallel implementations were tested on a shared memory symmetric multiprocessor (SMP) cluster machine. The OpenMP implementation in the solver MINOS is only the first step towards fully using the SMPs cluster potential with a mixed mode parallelism. Mixed mode parallelism can be achieved by combining message passing interface between clusters with OpenMP implicit parallelism within a cluster.

  6. Direct FEM-computation of load carrying capacity of highly loaded passive components; Direkte FEM - Berechnung der Tragfaehigkeit hochbeanspruchter passiver Komponenten

    Energy Technology Data Exchange (ETDEWEB)

    Staat, M; Heitzer, M [Forschungszentrum Juelich GmbH (Germany). Inst. fuer Sicherheitsforschung und Reaktortechnik

    1998-11-01

    Detailed, inelastic FEM analyses yield accurate information about the stresses and deformations in passive components. The local loading conditions, however, cannot be directly compared with a limit load in terms of structural mechanics. Concentration on the load carrying capacity is an approach simplifying the analysis. Based on the plasticity theory, limit and shakedown analyses calculate the load carrying capacities directly and exactly. The paper explains the implementation of the limit and shakedown data sets in a general FEM program and the direct calculation of the load carrying capacities of passive components. The concepts used are explained with respect to common structural analysis. Examples assuming high local stresses illustrate the application of FEM-based limit and shakedown analyses. The calculated interaction diagrams present a good insight into the applicable operational loads of individual passive components. The load carrying analysis also opens up a structure mechanics-based approach to assessing the load-to-collapse of cracked components made of highly ductile fracture-resistant material. (orig./CB) [Deutsch] Genaue Kenntnis der Spannungen und Verformungen in passiven Komponenten gewinnt man mit detailierten inelastischen FEM Analysen. Die lokale Beanspruchung laesst sich aber nicht direkt mit einer Beanspruchbarkeit im strukturmechanischen Sinne vergleichen. Konzentriert man sich auf die Frage nach der Tragfaehigkeit, dann vereinfacht sich die Analyse. Im Rahmen der Plastizitaetstheorie berechnen Traglast- und Einspielanalyse die tragbaren Lasten direkt und exakt. In diesem Beitrag wird eine Implementierung der Traglast- und Einspielsaetze in ein allgemeines FEM Programm vorgestellt, mit der die Tragfaehigkeit passiver Komponenten direkt berechnet wird. Die benutzten Konzepte werden in Bezug auf die uebliche Strukturanalyse erlaeutert. Beispiele mit lokal hoher Beanspruchung verdeutlichen die Anwendung der FEM basierten Traglast- und

  7. Raman spectroscopy of synthetic and natural iowaite.

    Science.gov (United States)

    Frost, Ray L; Adebajo, Moses O; Erickson, Kristy L

    2005-02-01

    The chemistry of a magnesium based hydrotalcite known as iowaite Mg6Fe2Cl2(OH)16.4H2O has been studied using Raman spectroscopy. Iowaite has chloride as the counter anion in the interlayer. The formula of synthetic iowaite was found to be Mg5.78Fe2.09(Cl,(CO3)0.5)(OH)16.4H2O. Oxidation of natural iowaite results in the formation of Mg4FeO(Cl,CO3) (OH)8.4H2O. X-ray diffraction (XRD) shows that the iowaite is a layered structure with a d(001) spacing of 8.0 angtsroms. For synthetic iowaite three Raman bands at 1376, 1194 and 1084 cm(-1) are attributed to CO3 stretching vibrations. These bands are not observed for the natural iowaite but are observed when the natural iowaite is exposed to air. The Raman spectrum of natural iowaite shows three bands at 708, 690 and 620 cm(-1) and upon exposure to air, two broad bands are found at 710 and 648 cm(-1). The Raman spectrum of synthetic iowaite has a very broad band at 712 cm(-1). The Raman spectrum of natural iowaite shows an intense band at 527 cm(-1). The air oxidized iowaite shows two bands at 547 and 484 cm(-1) attributed to the (CO3)(2-)nu2 bending mode. Raman spectroscopy has proven most useful for the study of the chemistry of iowaite and chemical changes induced in natural iowaite upon exposure to air.

  8. Raman Spectroscopy of Carbon Dust Samples from NSTX

    International Nuclear Information System (INIS)

    Raitses, Y.; Skinner, C.H.; Jiang, F.; Duffy, T.S.

    2008-01-01

    The Raman spectrum of dust particles exposed to the NSTX plasma is different from the spectrum of unexposed particles scraped from an unused graphite tile. For the unexposed particles, the high energy G-mode peak (Raman shift ∼1580 cm -1 ) is much stronger than the defect-induced D-mode peak (Raman shift ∼1350 cm -1 ), a pattern that is consistent with Raman spectrum for commercial graphite materials. For dust particles exposed to the plasma, the ratio of G-mode to D-mode peaks is lower and becomes even less than 1. The Raman measurements indicate that the production of carbon dust particles in NSTX involves modifications of the physical and chemical structure of the original graphite material. These modifications are shown to be similar to those measured for carbon deposits from atmospheric pressure helium arc discharge with an ablating anode electrode made from a graphite tile material. We also demonstrate experimentally that heating to 2000-2700 K alone can not explain the observed structural modifications indicating that they must be due to higher temperatures needed for graphite vaporization, which is followed either by condensation or some plasma-induced processes leading to the formation of more disordered forms of carbon material than the original graphite.

  9. Assignment of the Raman lines in single crystal barium metaborate (beta-BaB sub 2 O sub 4)

    CERN Document Server

    Ney, P; Maillard, A; Polgar, K

    1998-01-01

    A Raman-scattering study performed on beta-BaB sub 2 O sub 4 (beta-BBO) at room temperature allows us to assign all the vibrational modes detected in the Raman spectra. The internal and external vibration modes are properly obtained by taking account of the light polarization, mode contamination and isotope effects. A correspondence between the lattice and the free-ring modes is also presented. (author)

  10. Raman Frequencies Calculated at Various Pressures in Phase I of Benzene

    Energy Technology Data Exchange (ETDEWEB)

    Tari, Ozlem; Yurtseven, Hamit [Istanbul Arel Univ., Ankara (Turkmenistan)

    2013-04-15

    We calculate in this study the pressure dependence of the frequencies for the Raman modes of A (A{sub g}), B (A{sub g}, B{sub 2g}) and C (B{sub 1g}, B{sub 3g}) at constant temperatures of 274 and 294K (room temperature) for the solid phase I of benzene. Using the mode Gruneisen parameter of each lattice mode, which correlates the pressure dependence of the crystal volume and the frequency, the Raman frequencies of those modes are computed for phase I of benzene. Our results show that the Raman frequencies of the three lattice modes (A, B and C) increase as the pressure increases, as expected. The temperature effect on the Raman frequencies is not significant, which can be explained by the experimental measurements.

  11. Raman scattering in a two-dimensional Fermi liquid with spin-orbit coupling

    Science.gov (United States)

    Maiti, Saurabh; Maslov, Dmitrii L.

    2017-04-01

    We present a microscopic theory of Raman scattering in a two-dimensional Fermi liquid (FL) with Rashba and Dresselhaus types of spin-orbit coupling and subject to an in-plane magnetic field (B ⃗). In the long-wavelength limit, the Raman spectrum probes the collective modes of such a FL: the chiral spin waves. The characteristic features of these modes are a linear-in-q term in the dispersion and the dependence of the mode frequency on the directions of both q ⃗ and B ⃗. All of these features have been observed in recent Raman experiments on Cd1 -xMnxTe quantum wells.

  12. High-Resolution Infrared and Raman Spectra of the Polycrystalline Sinomenine Hydrochloride

    Directory of Open Access Journals (Sweden)

    Liu Xiao-Dong

    2016-01-01

    Full Text Available High-resolution infrared and Raman spectra of the polycrystalline sinomenine (SM hydrochloride have been measured to work out its whole really existing vibrational spectral bands. Except for the hydroxyl stretching modes and IR active bands less than 400 cm−1, most normal modes (about 34 are both IR and Raman active. In addition, 8 Raman bands less than 400 cm−1 are tentatively assigned, for the first time to our knowledge, to stretching/bending modes of the aromatic-ring−methoxyls and (SMH+–Cl− ions, respectively.

  13. Development of a 2-D Simplified P3 FEM Solver for Arbitrary Geometry Applications

    Energy Technology Data Exchange (ETDEWEB)

    Ryu, Eun Hyun; Joo, Han Gyu [Seoul National University, Seoul (Korea, Republic of)

    2010-10-15

    In the calculation of power distributions and multiplication factors in a nuclear reactor, the Finite Difference Method (FDM) and the nodal methods are primarily used. These methods are, however, limited to particular geometries and lack general application involving arbitrary geometries. The Finite Element Method (FEM) can be employed for arbitrary geometry application and there are numerous FEM codes to solve the neutron diffusion equation or the Sn transport equation. The diffusion based FEM codes have the drawback of inferior accuracy while the Sn based ones require a considerable computing time. This work here is to seek a compromise between these two by employing the simplified P3 (SP3) method for arbitrary geometry applications. Sufficient accuracy with affordable computing time and resources would be achieved with this choice of approximate transport solution when compared to full FEM based Pn or Sn solutions. For now only 2-D solver is considered

  14. Intricate Resonant Raman Response in Anisotropic ReS2.

    Science.gov (United States)

    McCreary, Amber; Simpson, Jeffrey R; Wang, Yuanxi; Rhodes, Daniel; Fujisawa, Kazunori; Balicas, Luis; Dubey, Madan; Crespi, Vincent H; Terrones, Mauricio; Hight Walker, Angela R

    2017-10-11

    The strong in-plane anisotropy of rhenium disulfide (ReS 2 ) offers an additional physical parameter that can be tuned for advanced applications such as logic circuits, thin-film polarizers, and polarization-sensitive photodetectors. ReS 2 also presents advantages for optoelectronics, as it is both a direct-gap semiconductor for few-layer thicknesses (unlike MoS 2 or WS 2 ) and stable in air (unlike black phosphorus). Raman spectroscopy is one of the most powerful characterization techniques to nondestructively and sensitively probe the fundamental photophysics of a 2D material. Here, we perform a thorough study of the resonant Raman response of the 18 first-order phonons in ReS 2 at various layer thicknesses and crystal orientations. Remarkably, we discover that, as opposed to a general increase in intensity of all of the Raman modes at excitonic transitions, each of the 18 modes behave differently relative to each other as a function of laser excitation, layer thickness, and orientation in a manner that highlights the importance of electron-phonon coupling in ReS 2 . In addition, we correct an unrecognized error in the calculation of the optical interference enhancement of the Raman signal of transition metal dichalcogenides on SiO 2 /Si substrates that has propagated through various reports. For ReS 2 , this correction is critical to properly assessing the resonant Raman behavior. We also implemented a perturbation approach to calculate frequency-dependent Raman intensities based on first-principles and demonstrate that, despite the neglect of excitonic effects, useful trends in the Raman intensities of monolayer and bulk ReS 2 at different laser energies can be accurately captured. Finally, the phonon dispersion calculated from first-principles is used to address the possible origins of unexplained peaks observed in the Raman spectra, such as infrared-active modes, defects, and second-order processes.

  15. Fourier transform Raman spectroscopy of synthetic and biological calcium phosphates.

    Science.gov (United States)

    Sauer, G R; Zunic, W B; Durig, J R; Wuthier, R E

    1994-05-01

    Fourier-transform (FT) Raman spectroscopy was used to characterize the organic and mineral components of biological and synthetic calcium phosphate minerals. Raman spectroscopy provides information on biological minerals that is complimentary to more widely used infrared methodologies as some infrared-inactive vibrational modes are Raman-active. The application of FT-Raman technology has, for the first time, enabled the problems of high sample fluorescence and low signal-to-noise that are inherent in calcified tissues to be overcome. Raman spectra of calcium phosphates are dominated by a very strong band near 960 cm-1 that arises from the symmetric stretching mode (v1) of the phosphate group. Other Raman-active phosphate vibrational bands are seen at approximately 1075 (v3), 590 (v4), and 435 cm-1 (v2). Minerals containing acidic phosphate groups show additional vibrational modes. The different calcium phosphate mineral phases can be distinguished from one another by the relative positions and shapes of these bands in the Raman spectra. FT-Raman spectra of nascent, nonmineralized matrix vesicles (MV) show a distinct absence of the phosphate v1 band even though these structures are rich in calcium and phosphate. Similar results were seen with milk casein and synthetic Ca-phosphatidyl-serine-PO4 complexes. Hence, the phosphate and/or acidic phosphate ions in these noncrystalline biological calcium phosphates is in a molecular environment that differs from that in synthetic amorphous calcium phosphate. In MV, the first distinct mineral phase to form contained acidic phosphate bands similar to those seen in octacalcium phosphate. The mineral phase present in fully mineralized MV was much more apatitic, resembling that found in bones and teeth.(ABSTRACT TRUNCATED AT 250 WORDS)

  16. FEM Modelling of Lateral-Torsional Buckling Using Shell and Solid Elements

    DEFF Research Database (Denmark)

    Valeš, Jan; Stan, Tudor-Cristian

    2017-01-01

    The paper describes two methods of FEM modelling of I-section beams loaded by bending moments. Series of random realizations with initial imperfections following the first eigenmode of lateral-torsional buckling were created. Two independent FEM software products were used for analyses of resista...... of resistance. At the end the difference and correlation between the results as well as advantages and disadvantages of both methods are discussed....

  17. Motion Sensorless Control of BLDC PM Motor with Offline FEM Info Assisted State Observer

    DEFF Research Database (Denmark)

    Stirban, Alin; Boldea, Ion; Andreescu, Gheorghe-Daniel

    2010-01-01

    This paper describes a new offline FEM assisted position and speed observer, for brushless dc (BLDC) PM motor drive sensorless control, based on the line-to-line PM flux linkage estimation. The zero-crossing of the line-to-line PM flux linkage occurs right in the middle of two commutation points...... identification. Digital simulations and experimental results are shown, demonstrating the reliability of the FEM assisted position and speed observer for BLDC PM motor sensorless control operation....

  18. A new 2D FEM analysis of a disc machine with offset rotor

    Energy Technology Data Exchange (ETDEWEB)

    Gair, S.; Canova, A. [Napier Univ., Edinburgh (United Kingdom). Dept. of Electrical, Electronic and Computer Engineering; Eastham, J.F.; Betzer, T. [Univ. of Bath (United Kingdom). School of Electronic and Electrical Engineering

    1995-12-31

    The paper presents a new 2-Dimensional Finite Element Method (2D FEM) analysis of a double sided axial field, permanent magnet excited brushless DC motor. The rotor of the machine is free to move in a direction perpendicular to the axis of the shaft. Computed 2D results are compared with 3D FEM analysis and the new analysis method is shown to give close agreement.

  19. Double-wall carbon nanotubes doped with different Br2 doping levels: a resonance Raman study.

    Science.gov (United States)

    do Nascimento, Gustavo M; Hou, Taige; Kim, Yoong Ahm; Muramatsu, Hiroyuki; Hayashi, Takuya; Endo, Morinobu; Akuzawa, Noboru; Dresselhaus, Mildred S

    2008-12-01

    This report focuses on the effects of different Br2 doping levels on the radial breathing modes of "double-wall carbon nanotube (DWNT) buckypaper". The resonance Raman profile of the Br2 bands are shown for different DWNT configurations with different Br2 doping levels. Near the maximum intensity of the resonance Raman profile, mainly the Br2 molecules adsorbed on the DWNT surface contribute strongly to the observed omega(Br-Br) Raman signal.

  20. Temperature dependence Infrared and Raman studies of III-V/II-VI core-shell nanostructures

    Science.gov (United States)

    Manciu, Felicia S.; McCombe, Bruce D.; Lucey, Derrick

    2005-03-01

    The temperature dependence (8 K InP/ZnS sample. Raman scattering (457.9 nm excitation) features were determined without polarization selection in the backscattering geometry. Interesting T-dependent resonant Raman effect of the surface optical phonon modes has been discovered in InP/ZnSe sample. Reasonable agreement is obtained between the Raman and FIR results, as well as with theoretical calculations.

  1. Raman scattering in a nearly resonant density ripple

    International Nuclear Information System (INIS)

    Barr, H.C.; Chen, F.F.

    1987-01-01

    Stimulated Raman scattering of light waves by an underdense plasma is affected by the presence of a density ripple caused by a simultaneously occurring stimulated Brillouin instability. The problem is treated kinetically for the particularly interesting case where the ripple has nearly the same wavelength as the plasma wave. The ripple is found to reduce the growth rate of the usual Raman instability but allows other decay modes to occur. Numerical results for the frequencies, growth rates, and k spectra of these modes are obtained. A physical explanation is given for a baffling result of the calculation. The physical picture is also of interest to particle acceleration by plasma waves

  2. Raman scattering of type-I clathrate compounds

    International Nuclear Information System (INIS)

    Takasu, Y.; Hasegawa, T.; Ogita, N.; Udagawa, M.; Avila, M.A.; Takabatake, T.

    2006-01-01

    Lattice dynamical properties of the type-I clathrate compounds of A 8 Ga 16 Ge 30 (A=Eu, Sr, Ba) have been investigated by Raman scattering. We are successful in the assignment of the observed Raman active phonons to proper symmetry and are able to separate the guest atom origin modes from framework origin modes for the first time experimentally. From the measurements of temperature dependence of the guest origin peaks, we also demonstrate the difference of the behavior of the guest atom at high temperature and low temperature

  3. H irradiation effects on the GaAs-like Raman modes in GaAs{sub 1-x}N{sub x}/GaAs{sub 1-x}N{sub x}:H planar heterostructures

    Energy Technology Data Exchange (ETDEWEB)

    Giulotto, E., E-mail: enricovirgilio.giulotto@unipv.it; Geddo, M.; Patrini, M.; Guizzetti, G. [Dipartimento di Fisica, Università degli studi di Pavia, Via Bassi 6, I-27100 Pavia (Italy); Felici, M.; Capizzi, M.; Polimeni, A. [Dipartimento di Fisica, Sapienza Università di Roma, Piazzale A. Moro 2, I-00185 Roma (Italy); Martelli, F. [Laboratorio Nazionale TASC-IOM-CNR, Area Science Park, S.S. 14, Km. 163.5, 34149 Trieste (Italy); Istituto per la Microelettronica e i Microsistemi, CNR, Via del fosso del cavaliere 100, 00133 Roma (Italy); Rubini, S. [Laboratorio Nazionale TASC-IOM-CNR, Area Science Park, S.S. 14, Km. 163.5, 34149 Trieste (Italy)

    2014-12-28

    The GaAs-like longitudinal optical phonon frequency in two hydrogenated GaAs{sub 1-x}N{sub x}/GaAs{sub 1-x}N{sub x}:H microwire heterostructures—with similar N concentration, but different H dose and implantation conditions—has been investigated by micro-Raman mapping. In the case of GaAs{sub 0.991}N{sub 0.009} wires embedded in barriers where GaAs-like properties are recovered through H irradiation, the phonon frequency in the barriers undergoes a blue shift with respect to the wires. In GaAs{sub 0.992}N{sub 0.008} wires embedded in less hydrogenated barriers, the phonon frequency exhibits an opposite behavior (red shift). Strain, disorder, phonon localization effects induced by H-irradiation on the GaAs-like phonon frequency are discussed and related to different types of N-H complexes formed in the hydrogenated barriers. It is shown that the red (blue) character of the frequency shift is related to the dominant N-2H (N-3H) type of complexes. Moreover, for specific experimental conditions, an all-optical determination of the uniaxial strain field is obtained. This may improve the design of recently presented devices that exploit the correlation between uniaxial stress and the degree of polarization of photoluminescence.

  4. Micro-Raman scattering in ZnTe thin films

    International Nuclear Information System (INIS)

    Larramendi, E. M.; Gutierrez Z-B, K.; Hernandez, E.; Melo, O. de; Berth, G.; Wiedemeier, V.; Lischka, K; Schikora, D.; Woggon, U.

    2008-01-01

    In this work we present micro-raman measurements on ZnTe thin films grown by isothermal closed space sublimation on GaAs(001) substrates in helium and nitrogen atmospheres. Micro-raman spectra were recorded at room temperature using the backscattering geometry (illuminated spot: 3 μm2, 0.3 cm-1 of resolution and the line 532 nm of a DPSSL as power excitation). Up to four order LO-phonon replicas and no peak from TO phonon were observed in the micro-raman spectra as evidence of the epitaxial character and good quality of the films (the TO mode is forbidden according to the selection rules for backscattering along [001] of this heterostructure). The micro-raman spectra also revealed two features at low energy, which have been assigned incorrectly in recent works. We demonstrate that these raman peaks can be associated to the presence of few monolayers of crystalline tellurium or its oxides on the surface of the films. These features were not observed in micro-raman spectra of as grown ZnTe films terminated in a Zn surface. However, they were detected after a prolonged exposure of the samples to air. In addition, it is shown that this effect is accelerated under a high power laser excitation (laser annealing) as used in conventional micro-Raman measurement setups. Preliminary results that suggest the inclusion of nitrogen in ZnTe structure are also shown. (Full text)

  5. Fem1b, a proapoptotic protein, mediates proteasome inhibitor-induced apoptosis of human colon cancer cells.

    Science.gov (United States)

    Subauste, M Cecilia; Sansom, Owen J; Porecha, Nehal; Raich, Natacha; Du, Liqin; Maher, Joseph F

    2010-02-01

    In the treatment of colon cancer, the development of resistance to apoptosis is a major factor in resistance to therapy. New molecular approaches to overcome apoptosis resistance, such as selectively upregulating proapoptotic proteins, are needed in colon cancer therapy. In a mouse model with inactivation of the adenomatous polyposis coli (Apc) tumor suppressor gene, reflecting the pathogenesis of most human colon cancers, the gene encoding feminization-1 homolog b (Fem1b) is upregulated in intestinal epithelium following Apc inactivation. Fem1b is a proapoptotic protein that interacts with apoptosis-inducing proteins Fas, tumor necrosis factor receptor-1 (TNFR1), and apoptotic protease activating factor-1 (Apaf-1). Increasing Fem1b expression induces apoptosis of cancer cells, but effects on colon cancer cells have not been reported. Fem1b is a homolog of feminization-1 (FEM-1), a protein in Caenorhabditis elegans that is regulated by proteasomal degradation, but whether Fem1b is likewise regulated by proteasomal degradation is unknown. Herein, we found that Fem1b protein is expressed in primary human colon cancer specimens, and in malignant SW620, HCT-116, and DLD-1 colon cancer cells. Increasing Fem1b expression, by transfection of a Fem1b expression construct, induced apoptosis of these cells. We found that proteasome inhibitor treatment of SW620, HCT-116, and DLD-1 cells caused upregulation of Fem1b protein levels, associated with induction of apoptosis. Blockade of Fem1b upregulation with morpholino antisense oligonucleotide suppressed the proteasome inhibitor-induced apoptosis of these cells. In conclusion, the proapoptotic protein Fem1b is downregulated by the proteasome in malignant colon cancer cells and mediates proteasome inhibitor-induced apoptosis of these cells. Therefore, Fem1b could represent a novel molecular target to overcome apoptosis resistance in therapy of colon cancer.

  6. Raman spectrum of asphaltene

    KAUST Repository

    Abdallah, Wael A.; Yang, Yang

    2012-01-01

    Asphaltenes extracted from seven different crude oils representing different geological formations from around the globe were analyzed using the Raman spectroscopic technique. Each spectrum is fitted with four main peaks using the Gaussian function. On the basis of D1 and G bands of the Raman spectrum, asphaltene indicated an ordered structure with the presence of boundary defected edges. The average aromatic sheet size of the asphaltene molecules is estimated within the range of 1.52-1.88 nm, which represents approximately seven to eight aromatic fused rings. This estimation is based on the integrated intensity of D1 and G bands, as proposed by Tunistra and Koenig. The results here are in perfect agreement with so many other used techniques and indicate the potential applicability of Raman measurements to determine the average aromatic ring size and its boundary. © 2012 American Chemical Society.

  7. Raman spectrum of asphaltene

    KAUST Repository

    Abdallah, Wael A.

    2012-11-05

    Asphaltenes extracted from seven different crude oils representing different geological formations from around the globe were analyzed using the Raman spectroscopic technique. Each spectrum is fitted with four main peaks using the Gaussian function. On the basis of D1 and G bands of the Raman spectrum, asphaltene indicated an ordered structure with the presence of boundary defected edges. The average aromatic sheet size of the asphaltene molecules is estimated within the range of 1.52-1.88 nm, which represents approximately seven to eight aromatic fused rings. This estimation is based on the integrated intensity of D1 and G bands, as proposed by Tunistra and Koenig. The results here are in perfect agreement with so many other used techniques and indicate the potential applicability of Raman measurements to determine the average aromatic ring size and its boundary. © 2012 American Chemical Society.

  8. Conservation laws, vertex corrections, and screening in Raman spectroscopy

    Science.gov (United States)

    Maiti, Saurabh; Chubukov, Andrey V.; Hirschfeld, P. J.

    2017-07-01

    We present a microscopic theory for the Raman response of a clean multiband superconductor, with emphasis on the effects of vertex corrections and long-range Coulomb interaction. The measured Raman intensity, R (Ω ) , is proportional to the imaginary part of the fully renormalized particle-hole correlator with Raman form factors γ (k ⃗) . In a BCS superconductor, a bare Raman bubble is nonzero for any γ (k ⃗) and diverges at Ω =2 Δmax , where Δmax is the largest gap along the Fermi surface. However, for γ (k ⃗) = constant, the full R (Ω ) is expected to vanish due to particle number conservation. It was sometimes stated that this vanishing is due to the singular screening by long-range Coulomb interaction. In our general approach, we show diagrammatically that this vanishing actually holds due to vertex corrections from the same short-range interaction that gives rise to superconductivity. We further argue that long-range Coulomb interaction does not affect the Raman signal for any γ (k ⃗) . We argue that vertex corrections eliminate the divergence at 2 Δmax . We also argue that vertex corrections give rise to sharp peaks in R (Ω ) at Ω <2 Δmin (the minimum gap along the Fermi surface), when Ω coincides with the frequency of one of the collective modes in a superconductor, e.g., Leggett and Bardasis-Schrieffer modes in the particle-particle channel, and an excitonic mode in the particle-hole channel.

  9. Surface-Enhanced Raman Spectroscopy

    Indian Academy of Sciences (India)

    IAS Admin

    weak Raman signal, which facilitates identification in chemi- cal and biological systems. Recently, single-molecule Raman scattering has enhanced the detection sensitivity limit of ... was working on the molecular diffraction of light, which ulti-.

  10. Surface-Enhanced Raman Spectroscopy

    Indian Academy of Sciences (India)

    Home; Journals; Resonance – Journal of Science Education; Volume 15; Issue 2. Surface-Enhanced Raman Spectroscopy - Recent Advancement of Raman Spectroscopy. Ujjal Kumar Sur. General Article Volume 15 Issue 2 February 2010 pp 154-164 ...

  11. Development of Raman spectrophotometer

    International Nuclear Information System (INIS)

    Adam, A.I.

    2008-05-01

    In this work, the Raman spectrophotometer HG.2S Jobin Yvon rebuilt and developed, the Raman setup provided as a gift for Neelian University from Amsterdam University. The main parts, which were replaced, include monochromator, an air-cooled photomultiplier tube RCA IP 28, log amplifier, hand scanning lab VIEW card for computer interfacing. The components assembled and the whole device was tested successfully. The developed setup was checked using some standard solutions, which showed perfect consistency with literature in the references and published papers. Solutions included hexane, cyclohexane, carbon tetrachloride, benzene and sodium sulfate.(Author)

  12. Raman spectra of graphene ribbons

    International Nuclear Information System (INIS)

    Saito, R; Furukawa, M; Dresselhaus, G; Dresselhaus, M S

    2010-01-01

    Raman spectra of graphene nanoribbons with zigzag and armchair edges are calculated within non-resonant Raman theory. Depending on the edge structure and polarization direction of the incident and scattered photon beam relative to the edge direction, a symmetry selection rule for the phonon type appears. These Raman selection rules will be useful for the identification of the edge structure of graphene nanoribbons.

  13. Raman spectroscopy of triolein under high pressures

    Science.gov (United States)

    Tefelski, D. B.; Jastrzębski, C.; Wierzbicki, M.; Siegoczyński, R. M.; Rostocki, A. J.; Wieja, K.; Kościesza, R.

    2010-03-01

    This article presents results of the high pressure Raman spectroscopy of triolein. Triolein, a triacylglyceride (TAG) of oleic acid, is an unsaturated fat, present in natural oils such as olive oil. As a basic food component and an energy storage molecule, it has considerable importance for food and fuel industries. To generate pressure in the experiment, we used a high-pressure cylindrical chamber with sapphire windows, presented in (R.M. Siegoczyński, R. Kościesza, D.B. Tefelski, and A. Kos, Molecular collapse - modification of the liquid structure induced by pressure in oleic acid, High Press. Res. 29 (2009), pp. 61-66). Pressure up to 750 MPa was applied. A Raman spectrometer in "macro"-configuration was employed. Raman spectroscopy provides information on changes of vibrational modes related to structural changes of triolein under pressure. Interesting changes in the triglyceride C‒H stretching region at 2650-3100 cm-1 were observed under high-pressures. Changes were also observed in the ester carbonyl (C˭ O) stretching region 1700-1780 cm-1 and the C‒C stretching region at 1050-1150 cm-1. The overall luminescence of the sample decreased under pressure, making it possible to set longer spectrum acquisition time and obtain more details of the spectrum. The registered changes suggest that the high-pressure solid phase of triolein is organized as β-polymorphic, as was reported in (C. Akita, T. Kawaguchi, and F. Kaneko, Structural study on polymorphism of cis-unsaturated triacylglycerol: Triolein, J. Phys. Chem. B 110 (2006), pp. 4346-4353; E. Da Silva and D. Rousseau, Molecular order and thermodynamics of the solid-liquid transition in triglycerides via Raman spectroscopy, Phys. Chem. Chem. Phys. 10 (2008), pp. 4606-4613) (with temperature-induced phase transitions). The research has shown that Raman spectroscopy in TAGs under pressure reveals useful information about its structural changes.

  14. Spectroscopy and Raman imaging of inhomogeneous materials

    International Nuclear Information System (INIS)

    Maslova, Olga

    2014-01-01

    This thesis is aimed at developing methodologies in Raman spectroscopy and imaging. After reviewing the statistical instruments which allow treating giant amount of data (multivariate analysis and classification), the study is applied to two families of well-known materials which are used as models for testing the limits of the implemented developments. The first family is a series of carbon materials pyrolyzed at various temperatures and exhibiting inhomogeneities at a nm scale which is suitable for Raman-X-ray diffraction combination. Another results concern the polishing effect on carbon structure. Since it is found to induce Raman artifacts leading to the overestimation of the local structural disorder, a method based on the use of the G band width is therefore proposed in order to evaluate the crystallite size in both unpolished and polished nano-graphites. The second class of materials presents inhomogeneities at higher (micrometric) scales by the example of uranium dioxide ceramics. Being well adapted in terms of spatial scale, Raman imaging is thus used for probing their surfaces. Data processing is implemented via an approach combining the multivariate (principal component) analysis and the classical fitting procedure with Lorentzian profiles. The interpretation of results is supported via electron backscattering diffraction (EBSD) analysis which enables us to distinguish the orientation effects of ceramic grains from other underlying contributions. The last ones are mainly localized at the grain boundaries, that is testified by the appearance of a specific Raman mode. Their origin seems to be caused by stoichiometric oxygen variations or impurities, as well as strain inhomogeneities. The perspectives of this work include both the implementation of other mathematical methods and in-depth analysis of UO 2 structure damaged by irradiation (anisotropic effects, role of grain boundaries). (author) [fr

  15. Raman scattering studies on PEG functionalized hydroxyapatite nanoparticles

    Science.gov (United States)

    Yamini, D.; Devanand Venkatasubbu, G.; Kumar, J.; Ramakrishnan, V.

    2014-01-01

    The pure hydroxyapatite (HAP) nanoparticles (NPs) have been synthesized by wet chemical precipitation method. Raman spectral measurements have been made for pure HAP, pure Polyethylene glycol (PEG) 6000 and PEG coated HAP in different mass ratios (sample 1, sample 2 and sample 3). The peaks observed in Raman spectrum of pure HAP and the XRD pattern have confirmed the formation of HAP NPs. Vibrational modes have been assigned for pure HAP and pure PEG 6000. The observed variation in peak position of Raman active vibrational modes of PEG in PEG coated HAP has been elucidated in this work, in terms of intermolecular interactions between PEG and HAP. Further these results suggest that the functionalization of nanoparticles may be independent of PEG mass.

  16. What can we learn from Raman Spectroscopy on irradiation-induced defects in UO2?

    International Nuclear Information System (INIS)

    Desgranges, L.; Martin, Ph.; Simon, P.; Guimbretiere, G.; Baldinozzi, G.

    2014-01-01

    Recent results on irradiated UO 2 by Raman spectroscopy evidenced Raman lines that are characteristic of irradiation-induced defects. Three main mechanisms are identified to explain their origin: resonant Raman, formation of new molecular entities, or breakdown in symmetry. Arguments are given to consider breakdown in symmetry as the predominant mechanism. A tentative description of the defects at the origin of this symmetry breakdown is proposed in terms of coordination polyhedrons of uranium. This discussion led us to consider that the Raman defect modes could be related to area with different stoichiometry. (authors)

  17. Designing of Raman laser

    International Nuclear Information System (INIS)

    Zidan, M. D.; Al-Awad, F.; Alsous, M. B.

    2005-01-01

    In this work, we describe the design of the Raman laser pumped by Frequency doubled Nd-YAG laser (λ=532 nm) to generate new laser wavelengths by shifting the frequency of the Nd-YAG laser to Stokes region (λ 1 =683 nm, λ 2 =953.6 nm, λ 3 =1579.5 nm) and Antistokes region (λ ' 1 =435 nm, λ ' 2 =369.9 nm, λ ' 3=319.8 nm). Laser resonator has been designed to increase the laser gain. It consists of two mirrors, the back mirror transmits the pump laser beam (λ=532 nm) through the Raman tube and reflects all other generated Raman laser lines. Four special front mirrors were made to be used for the four laser lines λ 1 =683 nm, λ 2 =953.6 nm and λ ' 1 = 435 nm, λ ' 2 =369.9 nm. The output energy for the lines υ 1 s, υ 2 s, υ 1 as,υ 2 as was measured. The output energy of the Raman laser was characterized for different H 2 pressure inside the tube. (Author)

  18. Confocal Raman microspectroscopy

    International Nuclear Information System (INIS)

    Puppels, G.J.

    1991-01-01

    Raman spectroscopy is a technique that provides detailed structural information about molecules studied. In the field of molecular biophysics it has been extensively used for characterization of nucleic acids and proteins and for investigation of interactions between these molecules. It was felt that this technique would have great potential if it could be applied for in situ study of these molecules and their interactions, at the level of single living cell or a chromosome. To make this possible a highly sensitive confocal Raman microspectrometer (CRM) was developed. The instrument is described in detail in this thesis. It incorporates a number of recent technological developments. First, it employs a liquid nitrogen cooled CCD-camera. This type of detector, first used in astronomy, is the ultimate detector for Raman spectroscopy because it combines high quantum efficiency light detection with photon-noise limited operation. Second, an important factor in obtaining a high signal throughput of the spectrometer was the development of a new type of Raman notch filter. In the third place, the confocal detection principle was applied in the CRM. This limits the effective measuring volume to 3 . (author). 279 refs., 48 figs., 11 tabs

  19. All-solid-state, synchronously pumped, ultrafast BaWO4 Raman laser with long and short Raman shifts generating at 1180, 1225, and 1323 nm

    Science.gov (United States)

    Frank, Milan; Jelínek, Michal; Kubeček, Václav; Ivleva, Lyudmila I.; Zverev, Petr G.; Smetanin, Sergei

    2017-12-01

    A lot of attention is currently focused on synchronously pumped, extra-cavity crystalline Raman lasers generating one or two Stokes Raman components in KGW or diamond Raman-active crystals, and also generating additional components of stimulated polariton scattering in lithium niobate crystal having both cubic and quadratic nonlinearities. In this contribution we report on generation of more than two Stokes components of stimulated Raman scattering with different Raman shifts in the all-solid-state, synchronously pumped, extra-cavity Raman laser based on the Raman-active a-cut BaWO4 crystal excited by a mode-locked, 220 nJ, 36 ps, 150 MHz diode sidepumped Nd:GdVO4 laser generating at the wavelength of 1063 nm. Excitation by the pumping radiation polarized along the BaWO4 crystal optical axis resulted in the Raman generation with not only usual (925cm - 1), but also additional (332cm - 1) Raman shift. Besides the 1180-nm first and 1323 nm second Stokes components with the Raman shift of 925cm - 1 from the 1063nm fundamental laser wavelength, we have achieved generation of the additional 1227 nm Raman component with different Raman shift of 332cm - 1 from the 1180nm component. At the 1227 nm component the strongest 12-times pulse shortening from 36ps down to 3ps was obtained due to shorter dephasing time of this additional Raman line (3ps for the 332-cm - 1 line instead of 6.5ps for the 925cm - 1 line). It has to be also noted that the 1225 nm generation is intracavity pumped by the 1179 nm first Stokes component resulting in the strongest pulse shortening close to the 332cm -1 line dephasing time (3ps). Slope efficiency of three Stokes components generation exceeded 20%.

  20. Raman Imaging Techniques and Applications

    CERN Document Server

    2012-01-01

    Raman imaging has long been used to probe the chemical nature of a sample, providing information on molecular orientation, symmetry and structure with sub-micron spatial resolution. Recent technical developments have pushed the limits of micro-Raman microscopy, enabling the acquisition of Raman spectra with unprecedented speed, and opening a pathway to fast chemical imaging for many applications from material science and semiconductors to pharmaceutical drug development and cell biology, and even art and forensic science. The promise of tip-enhanced raman spectroscopy (TERS) and near-field techniques is pushing the envelope even further by breaking the limit of diffraction and enabling nano-Raman microscopy.

  1. Lattice modes of the chirally pure and racemic phases of tyrosine crystals

    Energy Technology Data Exchange (ETDEWEB)

    Belyanchikov, M. A. [Moscow Institute of Physics and Technology (Russian Federation); Gorelik, V. S., E-mail: gorelik@sci.lebedev.ru [Russian Academy of Sciences, Lebedev Physical Institute (Russian Federation); Gorshunov, B. P. [Moscow Institute of Physics and Technology (Russian Federation); Pyatyshev, A. Yu., E-mail: jb-valensia@mail.ru [Bauman Moscow State Technical University (Russian Federation)

    2017-01-15

    High-Q librational modes have been found to be present in the infrared absorption and Raman spectra of chirally pure L-tyrosine. Such modes can serve as terahertz radiation detectors and generators in chirally pure biostructures.

  2. Raman spectroscopy of lithographically defined graphene nanoribbons - influence of size and defects

    Energy Technology Data Exchange (ETDEWEB)

    Kampmann, Felix; Scheuschner, Nils [Institut fuer Festkoerperphysik, Technical University Berlin (Germany); Terres, Bernat; Stampfer, Christoph [JARA-FIT and 2nd Institute of Physics, RWTH Aachen University (Germany); Peter Gruenberg Institute (PGI), Forschungszentrum Juelich (Germany); Joerger, Danny [JARA-FIT and 2nd Institute of Physics, RWTH Aachen University (Germany); Maultzsch, Janina [Institut fuer Festkoerperphysik, Technical University Berlin (Germany); Lehrstuhl fuer Experimentalphysik, Department Physik, Friedrich-Alexander-Universitaet Erlangen-Nuernberg, Erlangen (Germany)

    2017-11-15

    Graphene nanostructures are an important building block to make use of the properties of graphene for applications in integrated devices. It is important to study edge roughness and defects in such nanostructures for further device improvement as they become important when downscaling structures. Recent Raman studies focused mainly on the D mode to characterize the defects in graphene and graphene nanoribbons (GNR) whereas not much attention has been paid to the D' mode that is smaller in Raman intensity. In this work we show by comparison with AFM measurements of the GNR width that both defect-induced Raman modes have different scattering length scales. Furthermore the size and quality of lithographically defined GNRs can be estimated by a close analysis of the defect-induced Raman modes and the width of the well-studied 2D mode of graphene. The findings are explained by the different vibration pattern for both Raman modes and the differences in the matrix elements determining the Raman intensity, i.e. the electron-phonon coupling and the phonon density of states. (copyright 2017 by WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  3. Raman spectroscopy of lithographically defined graphene nanoribbons - influence of size and defects

    International Nuclear Information System (INIS)

    Kampmann, Felix; Scheuschner, Nils; Terres, Bernat; Stampfer, Christoph; Joerger, Danny; Maultzsch, Janina

    2017-01-01

    Graphene nanostructures are an important building block to make use of the properties of graphene for applications in integrated devices. It is important to study edge roughness and defects in such nanostructures for further device improvement as they become important when downscaling structures. Recent Raman studies focused mainly on the D mode to characterize the defects in graphene and graphene nanoribbons (GNR) whereas not much attention has been paid to the D' mode that is smaller in Raman intensity. In this work we show by comparison with AFM measurements of the GNR width that both defect-induced Raman modes have different scattering length scales. Furthermore the size and quality of lithographically defined GNRs can be estimated by a close analysis of the defect-induced Raman modes and the width of the well-studied 2D mode of graphene. The findings are explained by the different vibration pattern for both Raman modes and the differences in the matrix elements determining the Raman intensity, i.e. the electron-phonon coupling and the phonon density of states. (copyright 2017 by WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  4. Resonance effects in Raman scattering of quantum dots formed by the Langmuir-Blodgett method

    Energy Technology Data Exchange (ETDEWEB)

    Milekhin, A G; Sveshnikova, L L; Duda, T A [Institute of Semiconductor Physics, Lavrentjev av.13, 630090, Novosibirsk (Russian Federation); Surovtsev, N V; Adichtchev, S V [Institute of Automation and Electrometry, Koptyug av.1, 630090, Novosibirsk (Russian Federation); Azhniuk, Yu M [Institute of Electron Physics, Universytetska Str. 21, 88017, Uzhhorod (Ukraine); Himcinschi, C [Institut fuer Theoretische Physik, TU Bergakademie Freiberg, Leipziger Str. 23, 09596, Freiberg (Germany); Kehr, M; Zahn, D R T, E-mail: milekhin@thermo.isp.nsc.r [Semiconductor Physics, Chemnitz University of Technology, Chemnitz (Germany)

    2010-09-01

    The enhancement of Raman scattering by optical phonon modes in quantum dots was achieved in resonant and surface-enhanced Raman scattering experiments by approaching the laser energy to the energy of either the interband transitions or the localized surface plasmons in silver nanoclusters deposited onto the nanostructures. Resonant Raman scattering by TO, LO, and SO phonons as well as their overtones was observed for PbS, ZnS, and ZnO quantum dots while enhancement for LO and SO modes in CdS quantum dots with a factor of about 700 was measured in surface enhanced Raman scattering experiments. Multiple phonon Raman scattering observed up to 5th and 7th order for CdS and ZnO, respectively, confirms the high crystalline quality of the grown QDs.

  5. Raman study of electronic excitations in MgB2 with application of high magnetic field

    International Nuclear Information System (INIS)

    Machtoub, L.; Takano, Y.; Kito, H.

    2006-01-01

    We present the first results of Raman scattering with application of magnetic field on magnesium diboride (MgB 2 ). In this work, we have investigated the magnetic field dependence of the 72 meV (E 2g mode) and the pair-breaking peak around 100 cm -1 which corresponds to σ-band gap. Intensity enhancement of Raman features around 800 cm -1 accompanied with broadening in the line shape of E 2g mode has been observed in some polycrystalline samples at 0 GPa. Results are compared with previous Raman study under hydrostatic pressure

  6. Three-dimensional FEM model of FBGs in PANDA fibers with experimentally determined model parameters

    Science.gov (United States)

    Lindner, Markus; Hopf, Barbara; Koch, Alexander W.; Roths, Johannes

    2017-04-01

    A 3D-FEM model has been developed to improve the understanding of multi-parameter sensing with Bragg gratings in attached or embedded polarization maintaining fibers. The material properties of the fiber, especially Young's modulus and Poisson's ratio of the fiber's stress applying parts, are crucial for accurate simulations, but are usually not provided by the manufacturers. A methodology is presented to determine the unknown parameters by using experimental characterizations of the fiber and iterative FEM simulations. The resulting 3D-Model is capable of describing the change in birefringence of the free fiber when exposed to longitudinal strain. In future studies the 3D-FEM model will be employed to study the interaction of PANDA fibers with the surrounding materials in which they are embedded.

  7. Application of an enriched FEM technique in thermo-mechanical contact problems

    Science.gov (United States)

    Khoei, A. R.; Bahmani, B.

    2018-02-01

    In this paper, an enriched FEM technique is employed for thermo-mechanical contact problem based on the extended finite element method. A fully coupled thermo-mechanical contact formulation is presented in the framework of X-FEM technique that takes into account the deformable continuum mechanics and the transient heat transfer analysis. The Coulomb frictional law is applied for the mechanical contact problem and a pressure dependent thermal contact model is employed through an explicit formulation in the weak form of X-FEM method. The equilibrium equations are discretized by the Newmark time splitting method and the final set of non-linear equations are solved based on the Newton-Raphson method using a staggered algorithm. Finally, in order to illustrate the capability of the proposed computational model several numerical examples are solved and the results are compared with those reported in literature.

  8. Investigation of Ice-PVC separation under Flexural Loading using FEM Analysis

    Directory of Open Access Journals (Sweden)

    H Xue

    2016-08-01

    Full Text Available This paper presents the FEM technique applied in the study of ice separation over a polyvinyl chloride (PVC surface. A two layer model of ice and PVC is analysed theoretically using Euler-Bernoulli beam theory and the rule of mixtures. The physical samples are prepared by freezing ice over the PVC surfaces. The samples are tested experimentally in a four-point loading setup. The experimental results contain strain data gathered through a data acquisition system using the LabView software. The data is collected at the rate of 1 kHz per load step. A model is also coded in MATLAB® and simulated using the finite element method (FEM in ANSYS® Multiphysics. The FEM model of the ice and PVC sample is built using solid elements. The mesh is tested for sensitively. A good agreement is found between the theoretical, experimental and numerical simulation results.

  9. Vibrational properties of epitaxial Bi4Te3 films as studied by Raman spectroscopy

    Directory of Open Access Journals (Sweden)

    Hao Xu

    2015-08-01

    Full Text Available Bi4Te3, as one of the phases of the binary Bi–Te system, shares many similarities with Bi2Te3, which is known as a topological insulator and thermoelectric material. We report the micro-Raman spectroscopy study of 50 nm Bi4Te3 films on Si substrates prepared by molecular beam epitaxy. Raman spectra of Bi4Te3 films completely resolve the six predicted Raman-active phonon modes for the first time. Structural features and Raman tensors of Bi4Te3 films are introduced. According to the wavenumbers and assignments of the six eigenpeaks in the Raman spectra of Bi4Te3 films, it is found that the Raman-active phonon oscillations in Bi4Te3 films exhibit the vibrational properties of those in both Bi and Bi2Te3 films.

  10. High pressure Raman scattering study on the phase stability of LuVO4

    International Nuclear Information System (INIS)

    Rao, Rekha; Garg, Alka B.; Sakuntala, T.; Achary, S.N.; Tyagi, A.K.

    2009-01-01

    High pressure Raman spectroscopic investigations have been carried out on rare earth orthovanadate LuVO 4 upto 26 GPa. Changes in the Raman spectrum around 8 GPa across the reported zircon to scheelite transition are investigated in detail and compared with those observed in other vanadates. Co-existence of the zircon and scheelite phases is observed over a pressure range of about 8-13 GPa. The zircon to scheelite transition is irreversible upon pressure release. Subtle changes are observed in the Raman spectrum above 16 GPa which could be related to scheelite ↔ fergusonite transition. Pressure dependencies of the Raman active modes in the zircon and the scheelite phases are reported. - Graphical abstract: Study of scheelite-fergusonite transition in RVO 4 by Raman spectroscopy is rare. Here we report Raman spectroscopic investigations of LuVO 4 at high pressure to obtain insight into nature of post-scheelite phases.

  11. Vibration analysis of gas turbine blade using FEM

    International Nuclear Information System (INIS)

    Iqbal, M.J.; Chohan, G.Y.; Khusnood, S.; Khan, M.A.

    2003-01-01

    In a typical turbo-machine, there is a stator row of blades, which guide the gases onto a rotor row of blades, to extract the mechanical power from the machine. A typical rotor blade was sees upstream disturbance from the stator row and as it rotates, receive a corresponding number of increasing and decreasing lift and moment forces alternating periodically, depending on the number of stator blades/nozzles/guide vanes. Thus all the blades in a turbo-machine receiver their major periodic excitation at a frequency equal to nozzle passing frequency. Since these forces are periodic, one has to consider several number of these harmonics in determining whether resonance takes place, when one of these harmonics coincides with any of the natural frequencies of the blades. Turbine blades have a variety of natural modes of vibration, predominantly as blade alone but also in combination with flexing of the disc rim. These mode occur at characteristic frequencies, which are determined by the distribution of mass and stiffness (in bending or torsion), resulting from the variable thickness over the blade area. Since the advent of steam turbines and their application in various sectors of industry, it is a common experience that a blade failure is a major cause of breakdown in these machines. Blade failures due to fatigue are predominantly vibration related. The dynamic loads on the blading can arise from many sources, the predominant being the source of the operation principles on which the machine is designed. This work deals with vibration analysis of a gas turbine blade using a finite element package ANSYS. Determined the natural frequencies and mode shapes for a turbine blade and a rectangular blade. Results have been validated experimentally using a rectangular blade. ANSYS results have also been compared against published results. (author)

  12. An adaptive singular ES-FEM for mechanics problems with singular field of arbitrary order

    OpenAIRE

    Nguyen-Xuan, H.; Liu, G. R.; Bordas, Stéphane; Natarajan, S.; Rabczuk, T.

    2013-01-01

    This paper presents a singular edge-based smoothed finite element method (sES-FEM) for mechanics problems with singular stress fields of arbitrary order. The sES-FEM uses a basic mesh of three-noded linear triangular (T3) elements and a special layer of five-noded singular triangular elements (sT5) connected to the singular-point of the stress field. The sT5 element has an additional node on each of the two edges connected to the singular-point. It allows us to represent simple and efficient ...

  13. Analysis of polyethylene terephthalate PET plastic bottle jointing system using finite element method (FEM)

    Science.gov (United States)

    Zaidi, N. A.; Rosli, Muhamad Farizuan; Effendi, M. S. M.; Abdullah, Mohamad Hariri

    2017-09-01

    For almost all injection molding applications of Polyethylene Terephthalate (PET) plastic was analyzed the strength, durability and stiffness of properties by using Finite Element Method (FEM) for jointing system of wood furniture. The FEM was utilized for analyzing the PET jointing system for Oak and Pine as wood based material of furniture. The difference pattern design of PET as wood jointing furniture gives the difference value of strength furniture itself. The results show the wood specimen with grooves and eclipse pattern design PET jointing give lower global estimated error is 28.90%, compare to the rectangular and non-grooves wood specimen of global estimated error is 63.21%.

  14. Surface enhanced Raman scattering

    CERN Document Server

    Furtak, Thomas

    1982-01-01

    In the course of the development of surface science, advances have been identified with the introduction of new diagnostic probes for analytical characterization of the adsorbates and microscopic structure of surfaces and interfaces. Among the most recently de­ veloped techniques, and one around which a storm of controversy has developed, is what has now been earmarked as surface enhanced Raman scattering (SERS). Within this phenomenon, molecules adsorbed onto metal surfaces under certain conditions exhibit an anomalously large interaction cross section for the Raman effect. This makes it possible to observe the detailed vibrational signature of the adsorbate in the ambient phase with an energy resolution much higher than that which is presently available in electron energy loss spectroscopy and when the surface is in contact with a much larger amount of material than that which can be tolerated in infrared absorption experiments. The ability to perform vibrational spectroscopy under these conditions would l...

  15. Raman spectroscopy of glasses in the As–Te system

    International Nuclear Information System (INIS)

    Tverjanovich, A.; Rodionov, K.; Bychkov, E.

    2012-01-01

    For the first time, the Raman spectra of As x Te 1−x glasses, 0.2≤x≤0.6, have been measured over the entire glass-forming range. The spectra exhibit three broad spectral features attributed to vibrations of structural units having Te–Te, As–Te and As–As bonds. The observed chemical disorder in the glasses is discussed on the basis of partial bond fractions derived from the integrated intensity of the Raman modes. The underlying structural model suggests a dissociation of AsTe- or As 2 Te 3 -related units in the glass melt. The spectra of glasses quenched from different temperatures, as well as those of the annealed vitreous alloys, are consistent with predictions of the model. - Graphical abstract: Raman spectra of the As x Te 1−x glasses (0.2≤x≤0.4 and 0.4≤x≤0.6). Fractional concentrations of Te–Te, As–Te and As–As bonds in the As x Te 1−x glasses calculated using experimental Raman data. The solid lines represent predictions of the dissociation model assuming that the main chemically ordered structural units are related to AsTe. Highlights: ► For the first time, the Raman spectra of As x Te 1−x glasses, 0.2≤x≤0.6, were measured. ► The partial bond fractions were derived from the integrated intensity of the Raman modes. ► An empirical quantitative approach to the Raman data was proposed for the reaction modeling.

  16. Raman Plus X: Biomedical Applications of Multimodal Raman Spectroscopy.

    Science.gov (United States)

    Das, Nandan K; Dai, Yichuan; Liu, Peng; Hu, Chuanzhen; Tong, Lieshu; Chen, Xiaoya; Smith, Zachary J

    2017-07-07

    Raman spectroscopy is a label-free method of obtaining detailed chemical information about samples. Its compatibility with living tissue makes it an attractive choice for biomedical analysis, yet its translation from a research tool to a clinical tool has been slow, hampered by fundamental Raman scattering issues such as long integration times and limited penetration depth. In this review we detail the how combining Raman spectroscopy with other techniques yields multimodal instruments that can help to surmount the translational barriers faced by Raman alone. We review Raman combined with several optical and non-optical methods, including fluorescence, elastic scattering, OCT, phase imaging, and mass spectrometry. In each section we highlight the power of each combination along with a brief history and presentation of representative results. Finally, we conclude with a perspective detailing both benefits and challenges for multimodal Raman measurements, and give thoughts on future directions in the field.

  17. Enhancement of Raman scattering from monolayer graphene by photonic crystal nanocavities

    Science.gov (United States)

    Kimura, Issei; Yoshida, Masahiro; Sota, Masaki; Inoue, Taiki; Chiashi, Shohei; Maruyama, Shigeo; Kato, Yuichiro K.

    Monolayer graphene is an atomically thin two-dimensional material that shows strong Raman scattering, while photonic crystal nanocavities with small mode volumes allow for efficient optical coupling at the nanoscale. Here we demonstrate resonant enhancement of graphene Raman G' band by coupling to photonic crystal cavity modes. Hexagonal-lattice photonic crystal L3 cavities are fabricated from silicon-on-insulator substrates. and monolayer graphene sheets grown by chemical vapor deposition are transferred onto the nanocavities. Excitation wavelength dependence of Raman spectra show that the Raman intensity is enhanced when the G' peak is in resonance with the cavity mode. By performing imaging measurements, we confirm that such an enhancement is only observed at the cavity position. Work supported by JSPS KAKENHI Grant Numbers JP16K13613, JP25107002 and MEXT (Photon Frontier Network Program, Nanotechnology Platform).

  18. Interference-free optical detection for Raman spectroscopy

    Science.gov (United States)

    Fischer, David G (Inventor); Kojima, Jun (Inventor); Nguyen, Quang-Viet (Inventor)

    2012-01-01

    An architecture for spontaneous Raman scattering (SRS) that utilizes a frame-transfer charge-coupled device (CCD) sensor operating in a subframe burst gating mode to realize time-resolved combustion diagnostics is disclosed. The technique permits all-electronic optical gating with microsecond shutter speeds (<5 .mu.s), without compromising optical throughput or image fidelity. When used in conjunction with a pair of orthogonally-polarized excitation lasers, the technique measures time-resolved vibrational Raman scattering that is minimally contaminated by problematic optical background noise.

  19. Ring cavity for a Raman capillary waveguide amplifier

    Science.gov (United States)

    Kurnit, N.A.

    1981-01-27

    A regenerative ring amplifier and regenerative ring oscillator are described which function to feed back a portion of the Stokes signal to complete the ring cavity. The ring cavity configuration allows the CO/sub 2/ laser pump signal and Stokes signal to copropagate through the Raman capillary waveguide amplifier. A Raman capillary waveguide amplifier is also provided in the return leg of the ring cavity to increase gain without increasing the round trip time. Additionally, the ring cavity can be designed such that the amplified Stokes signal is synchronous with the mode-locked spikes of the incoming CO/sub 2/ laser pump signal.

  20. Ring cavity for a Raman capillary waveguide amplifir

    Science.gov (United States)

    Kurnit, N.A.

    1981-01-27

    A regenerative ring amplifier and regenerative ring oscillator are described which function to feed back a portion of the Stokes signal to complete the ring cavity. The ring cavity configuration allows the CO/sub 2/ laser pump signal and Stokes signal to copropagate through the Raman capillary waveguide amplifier. A Raman capillary waveguide amplifier is also provided in the return leg of the ring cavity to increase gain without increasing the round trip time. Additionally, the ring cavity can be designed such that the amplified Stokes signal is synchronous with the mode-locked spikes of the incoming CO/sub 2/ laser pump signal.

  1. Near-infrared-excited confocal Raman spectroscopy advances in vivo diagnosis of cervical precancer.

    Science.gov (United States)

    Duraipandian, Shiyamala; Zheng, Wei; Ng, Joseph; Low, Jeffrey J H; Ilancheran, Arunachalam; Huang, Zhiwei

    2013-06-01

    Raman spectroscopy is a unique optical technique that can probe the changes of vibrational modes of biomolecules associated with tissue premalignant transformation. This study evaluates the clinical utility of confocal Raman spectroscopy over near-infrared (NIR) autofluorescence (AF) spectroscopy and composite NIR AF/Raman spectroscopy for improving early diagnosis of cervical precancer in vivo at colposcopy. A rapid NIR Raman system coupled with a ball-lens fiber-optic confocal Raman probe was utilized for in vivo NIR AF/Raman spectral measurements of the cervix. A total of 1240 in vivo Raman spectra [normal (n=993), dysplasia (n=247)] were acquired from 84 cervical patients. Principal components analysis (PCA) and linear discriminant analysis (LDA) together with a leave-one-patient-out, cross-validation method were used to extract the diagnostic information associated with distinctive spectroscopic modalities. The diagnostic ability of confocal Raman spectroscopy was evaluated using the PCA-LDA model developed from the significant principal components (PCs) [i.e., PC4, 0.0023%; PC5, 0.00095%; PC8, 0.00022%, (p<0.05)], representing the primary tissue Raman features (e.g., 854, 937, 1095, 1253, 1311, 1445, and 1654 cm(-1)). Confocal Raman spectroscopy coupled with PCA-LDA modeling yielded the diagnostic accuracy of 84.1% (a sensitivity of 81.0% and a specificity of 87.1%) for in vivo discrimination of dysplastic cervix. The receiver operating characteristic curves further confirmed that the best classification was achieved using confocal Raman spectroscopy compared to the composite NIR AF/Raman spectroscopy or NIR AF spectroscopy alone. This study illustrates that confocal Raman spectroscopy has great potential to improve early diagnosis of cervical precancer in vivo during clinical colposcopy.

  2. Combining Raman and laser induced breakdown spectroscopy by double pulse lasing.

    Science.gov (United States)

    Lednev, Vasily N; Pershin, Sergey M; Sdvizhenskii, Pavel A; Grishin, Mikhail Ya; Fedorov, Alexander N; Bukin, Vladimir V; Oshurko, Vadim B; Shchegolikhin, Alexander N

    2018-01-01

    A new approach combining Raman spectrometry and laser induced breakdown spectrometry (LIBS) within a single laser event was suggested. A pulsed solid state Nd:YAG laser running in double pulse mode (two frequency-doubled sequential nanosecond laser pulses with dozens microseconds delay) was used to combine two spectrometry methods within a single instrument (Raman/LIBS spectrometer). First, a low-energy laser pulse (power density far below ablation threshold) was used for Raman measurements while a second powerful laser pulse created the plasma suitable for LIBS analysis. A short time delay between two successive pulses allows measuring LIBS and Raman spectra at different moments but within a single laser flash-lamp pumping. Principal advantages of the developed instrument include high quality Raman/LIBS spectra acquisition (due to optimal gating for Raman/LIBS independently) and absence of target thermal alteration during Raman measurements. A series of high quality Raman and LIBS spectra were acquired for inorganic salts (gypsum, anhydrite) as well as for pharmaceutical samples (acetylsalicylic acid). To the best of our knowledge, the quantitative analysis feasibility by combined Raman/LIBS instrument was demonstrated for the first time by calibration curves construction for acetylsalicylic acid (Raman) and copper (LIBS) in gypsum matrix. Combining ablation pulses and Raman measurements (LIBS/Raman measurements) within a single instrument makes it an efficient tool for identification of samples hidden by non-transparent covering or performing depth profiling analysis including remote sensing. Graphical abstract Combining Raman and laser induced breakdown spectroscopy by double pulse lasing.

  3. X-ray strain tensor imaging: FEM simulation and experiments with a micro-CT.

    Science.gov (United States)

    Kim, Jae G; Park, So E; Lee, Soo Y

    2014-01-01

    In tissue elasticity imaging, measuring the strain tensor components is necessary to solve the inverse problem. However, it is impractical to measure all the tensor components in ultrasound or MRI elastography because of their anisotropic spatial resolution. The objective of this study is to compute 3D strain tensor maps from the 3D CT images of a tissue-mimicking phantom. We took 3D micro-CT images of the phantom twice with applying two different mechanical compressions to it. Applying the 3D image correlation technique to the CT images under different compression, we computed 3D displacement vectors and strain tensors at every pixel. To evaluate the accuracy of the strain tensor maps, we made a 3D FEM model of the phantom, and we computed strain tensor maps through FEM simulation. Experimentally obtained strain tensor maps showed similar patterns to the FEM-simulated ones in visual inspection. The correlation between the strain tensor maps obtained from the experiment and the FEM simulation ranges from 0.03 to 0.93. Even though the strain tensor maps suffer from high level noise, we expect the x-ray strain tensor imaging may find some biomedical applications such as malignant tissue characterization and stress analysis inside the tissues.

  4. Analysis of the deep rolling process on turbine blades using the FEM/BEM-coupling

    International Nuclear Information System (INIS)

    Baecker, V; Klocke, F; Wegner, H; Timmer, A; Grzhibovskis, R; Rjasanow, S

    2010-01-01

    Highly stressed components of aircraft engines, like turbine blades, have to satisfy stringent requirements regarding durability and reliability. The induction of compressive stresses and strain hardening in their surface layer has proven as a promising method to significantly increase their fatigue resistance. The required surface layer properties can be achieved by deep rolling. The determination of optimal process parameters still requires elaborate experimental set-up and subsequent time- and cost-extensive measurements. In previous works the application of the Finite Element Method (FEM) was proposed as an effective and cost reducing alternative to predict the surface layer state for given process parameters. However, FEM requires very fine mesh in the surface layer to resolve the high stress gradients with sufficient accuracy. The hereby caused high time and memory requirements render an efficient simulation of complete turbine components as impossible. In this article a solution is offered by coupling the FEM with the Boundary Elements Method (BEM). It enables the computing of large scale models at low computational cost and high result accuracy. Different approaches of the FEM/BEM-coupling for the simulation of deep rolling are examined with regard to their stability and required computing time.

  5. An effective FEM-based approach for discrete 3D crack growth

    DEFF Research Database (Denmark)

    Nielsen, Morten Eggert; Lambertsen, Søren Heide; Pedersen, Erik B.

    2015-01-01

    A new geometric approach for discrete crack growth modeling is proposed and implemented in a commercial FEM software. The basic idea is to model the crack growth by removing volumes of material as the crack front advances. Thereby, adaptive meshing techniques, found in commercial software, is wel...

  6. Fem Dewey-begreber til analyse af Facilitated Work Based Learning

    DEFF Research Database (Denmark)

    Thomassen, Anja Overgaard

    teoretiske ramme er helt overvejende baseret på John Deweys (1859-1952) pragmatisme og herudfra er der udviklet modeller, som anvendes i analysen af de empiriske data. Det fremlægges i paperet, hvorledes disse modeller er blevet udviklet og anvendt i ph.d.-afhandlingen, og hvorledes de centrale fem begreber...

  7. Mixed FEM for Second Order Elliptic Problems on Polygonal Meshes with BEM-Based Spaces

    KAUST Repository

    Efendiev, Yalchin; Galvis, Juan; Lazarov, Raytcho; Weiß er, Steffen

    2014-01-01

    We present a Boundary Element Method (BEM)-based FEM for mixed formulations of second order elliptic problems in two dimensions. The challenge, we would like to address, is a proper construction of H(div)-conforming vector valued trial functions

  8. hp-FEM electromechanical transduction model of ionic polymer metal composites

    Czech Academy of Sciences Publication Activity Database

    Pugal, D.; Šolín, Pavel; Kim, K.; Aabloo, A.

    2014-01-01

    Roč. 260, April (2014), s. 135-148 ISSN 0377-0427 R&D Projects: GA ČR(CZ) GAP102/11/0498 Institutional support: RVO:61388998 Keywords : hp-FEM * Nernst-Planck * Poisson Subject RIV: JA - Electronics ; Optoelectronics, Electrical Engineering Impact factor: 1.266, year: 2014

  9. FEM Analysis and Measurement of Residual Stress by Neutron Diffraction on the Dissimilar Overlay Weld Pipe

    International Nuclear Information System (INIS)

    Kim, Kang Soo; Lee, Ho Jin; Woo, Wan Chuck; Seong, Baek Seok; Byeon, Jin Gwi; Park, Kwang Soo; Jung, In Chul

    2010-01-01

    Much research has been done to estimate the residual stress on a dissimilar metal weld. There are many methods to estimate the weld residual stress and FEM (Finite Element Method) is generally used due to the advantage of the parametric study. And the X-ray method and a Hole Drilling technique for an experimental method are also usually used. The aim of this paper is to develop the appropriate FEM model to estimate the residual stresses of the dissimilar overlay weld pipe. For this, firstly, the specimen of the dissimilar overlay weld pipe was manufactured. The SA 508 Gr3 nozzle, the SA 182 safe end and SA376 pipe were welded by the Alloy 182. And the overlay weld by the Alloy 52M was performed. The residual stress of this specimen was measured by using the Neutron Diffraction device in the HANARO (High-flux Advanced Neutron Application ReactOr) research reactor, KAERI (Korea Atomic Energy Research Institute). Secondly, FEM Model on the dissimilar overlay weld pipe was made and analyzed by the ABAQUS Code (ABAQUS, 2004). Thermal analysis and stress analysis were performed, and the residual stress was calculated. Thirdly, the results of the FEM analysis were compared with those of the experimental methods

  10. Space-time adaptive hp-FEM for problems with traveling sharp fronts

    Czech Academy of Sciences Publication Activity Database

    Šolín, Pavel; Korous, L.

    2013-01-01

    Roč. 95, č. 1 (2013), S709-S722 ISSN 0010-485X Institutional support: RVO:61388998 Keywords : adaptive hp-FEM * transient problems * sharp fronts Subject RIV: BA - General Mathematics Impact factor: 1.055, year: 2013

  11. Influence of seed layer moduli on FEM based modulus backcalculation results

    CSIR Research Space (South Africa)

    Matsui, K

    2006-01-01

    Full Text Available This paper presents recentupdates of DBALM (Dynamic Back Analysis for Layer Moduli) software whose solver is based on exi-symmetric FEM and was first developed in 1993. Examples of airfield pavement application are also presented. The results...

  12. Efficient preconditioning of hphp-FEM matrix sequences with slowly-varying coefficients

    DEFF Research Database (Denmark)

    Gatto, P.; Hesthaven, J. S.; Christiansen, Rasmus Ellebæk

    2017-01-01

    We previously introduced a preconditioner that has proven effective for hphp-FEM discretizations of various challenging elliptic and hyperbolic problems. The construction is inspired by standard nested dissection, and relies on the assumption that the Schur complements can be approximated, to hig...

  13. Evaluation of fracture mode for local wall-thinned pipes

    International Nuclear Information System (INIS)

    Herman, Irwan; Suzuki, Tomohisa; Sato, Yasumoto; Meshii, Toshiyuki

    2007-01-01

    In this study, by referring to our burst pressure tests results, firstly, the effects of flaw length δ z and pipe size (mean radius R) on burst pressure p f were investigated by using Finite Element Method (FEM). Then, fracture mode evaluation was made by using history data of strain ratio ε z /ε θ along with load increment. Furthermore, the effect of flaw depth t 1 on fracture mode was studied and finally, the evaluation method of fracture mode for local wall-thinned pipes was introduced. (author)

  14. Prediction of the properties of PVD/CVD coatings with the use of FEM analysis

    International Nuclear Information System (INIS)

    Śliwa, Agata; Mikuła, Jarosław; Gołombek, Klaudiusz; Tański, Tomasz; Kwaśny, Waldemar; Bonek, Mirosław; Brytan, Zbigniew

    2016-01-01

    Highlights: • Prediction of the properties of PVD/CVD coatings with the use of (FEM) analysis. • Stress distribution in multilayer Ti/Ti(C,N)/CrN, Ti/Ti(C,N)/(Ti,Al)N coatings. • The experimental values of stresses were determined on X-ray diffraction patterns. • An FEM model was established for the purpose of building a computer simulation. - Abstract: The aim of this paper is to present the results of the prediction of the properties of PVD/CVD coatings with the use of finite element method (FEM) analysis. The possibility of employing the FEM in the evaluation of stress distribution in multilayer Ti/Ti(C,N)/CrN, Ti/Ti(C,N)/(Ti,Al)N, Ti/(Ti,Si)N/(Ti,Si)N, and Ti/DLC/DLC coatings by taking into account their deposition conditions on magnesium alloys has been discussed in the paper. The difference in internal stresses in the zone between the coating and the substrate is caused by, first of all, the difference between the mechanical and thermal properties of the substrate and the coating, and also by the structural changes that occur in these materials during the fabrication process, especially during the cooling process following PVD and CVD treatment. The experimental values of stresses were determined based on X-ray diffraction patterns that correspond to the modelled values, which in turn can be used to confirm the correctness of the accepted mathematical model for testing the problem. An FEM model was established for the purpose of building a computer simulation of the internal stresses in the coatings. The accuracy of the FEM model was verified by comparing the results of the computer simulation of the stresses with experimental results. A computer simulation of the stresses was carried out in the ANSYS environment using the FEM method. Structure observations, chemical composition measurements, and mechanical property characterisations of the investigated materials has been carried out to give a background for the discussion of the results that were

  15. Prediction of the properties of PVD/CVD coatings with the use of FEM analysis

    Energy Technology Data Exchange (ETDEWEB)

    Śliwa, Agata; Mikuła, Jarosław; Gołombek, Klaudiusz; Tański, Tomasz; Kwaśny, Waldemar; Bonek, Mirosław, E-mail: miroslaw.bonek@polsl.pl; Brytan, Zbigniew

    2016-12-01

    Highlights: • Prediction of the properties of PVD/CVD coatings with the use of (FEM) analysis. • Stress distribution in multilayer Ti/Ti(C,N)/CrN, Ti/Ti(C,N)/(Ti,Al)N coatings. • The experimental values of stresses were determined on X-ray diffraction patterns. • An FEM model was established for the purpose of building a computer simulation. - Abstract: The aim of this paper is to present the results of the prediction of the properties of PVD/CVD coatings with the use of finite element method (FEM) analysis. The possibility of employing the FEM in the evaluation of stress distribution in multilayer Ti/Ti(C,N)/CrN, Ti/Ti(C,N)/(Ti,Al)N, Ti/(Ti,Si)N/(Ti,Si)N, and Ti/DLC/DLC coatings by taking into account their deposition conditions on magnesium alloys has been discussed in the paper. The difference in internal stresses in the zone between the coating and the substrate is caused by, first of all, the difference between the mechanical and thermal properties of the substrate and the coating, and also by the structural changes that occur in these materials during the fabrication process, especially during the cooling process following PVD and CVD treatment. The experimental values of stresses were determined based on X-ray diffraction patterns that correspond to the modelled values, which in turn can be used to confirm the correctness of the accepted mathematical model for testing the problem. An FEM model was established for the purpose of building a computer simulation of the internal stresses in the coatings. The accuracy of the FEM model was verified by comparing the results of the computer simulation of the stresses with experimental results. A computer simulation of the stresses was carried out in the ANSYS environment using the FEM method. Structure observations, chemical composition measurements, and mechanical property characterisations of the investigated materials has been carried out to give a background for the discussion of the results that were

  16. Investigation of Ferroelectric Domain Walls by Raman Spectroscopy

    Science.gov (United States)

    Stone, Gregory A.

    Ferroelectric materials are characterized by an intrinsic spontaneous electric dipole moment that can be manipulated by the application of an electric field. Regions inside the crystal, known as domains, can have the spontaneous dipole moments oriented in a different direction than the surrounding crystal. Due to favorable piezoelectric, pyroelectric, electro-optic, and nonlinear optical properties, ferroelectric materials are attractive for commercial applications. Many devices, such as nonlinear frequency converters, require precisely engineered domain patterns. The properties of domains and their boundaries, known as domain walls, are vital to the performance and limitations of these devices. As a result, ferroelectric domains and the domain walls have been the focus of many scientific studies. Despite all this work, questions remain regarding their properties. This work is aimed at developing a better understanding of the properties of the domain wall using confocal Raman spectroscopy. Raman spectra taken from domain walls in Lithium Niobate and Lithium Tantalate reveal two distinct changes in the Raman spectra: (1) Shifts in frequency of the bulk Raman modes, which persists over a range of 0.2-0.5 mu m from the domain wall. The absence of this effect in defect free stoichiometric Lithium Tantalate indicates that the shifts are related to defects inside the crystal. (2) The presence of Raman modes corresponding to phonons propagating orthogonal to the laser beam axis, which are not collected in the bulk crystal. The phonons also preferential propagate normal to the domain wall. These modes are detected up to 0.35 mum from the domain wall. The observation and separation of these effects was made possible by the optimized spatial resolution (0.23 mum) of a home-built scanning confocal microscope and the fact that degeneracy of the transverse and longitudinal phonon polarization is lifted by polar phonons in Lithium Niobate and Lithium Tantalate. Raman

  17. Prediction of the properties of PVD/CVD coatings with the use of FEM analysis

    Science.gov (United States)

    Śliwa, Agata; Mikuła, Jarosław; Gołombek, Klaudiusz; Tański, Tomasz; Kwaśny, Waldemar; Bonek, Mirosław; Brytan, Zbigniew

    2016-12-01

    The aim of this paper is to present the results of the prediction of the properties of PVD/CVD coatings with the use of finite element method (FEM) analysis. The possibility of employing the FEM in the evaluation of stress distribution in multilayer Ti/Ti(C,N)/CrN, Ti/Ti(C,N)/(Ti,Al)N, Ti/(Ti,Si)N/(Ti,Si)N, and Ti/DLC/DLC coatings by taking into account their deposition conditions on magnesium alloys has been discussed in the paper. The difference in internal stresses in the zone between the coating and the substrate is caused by, first of all, the difference between the mechanical and thermal properties of the substrate and the coating, and also by the structural changes that occur in these materials during the fabrication process, especially during the cooling process following PVD and CVD treatment. The experimental values of stresses were determined based on X-ray diffraction patterns that correspond to the modelled values, which in turn can be used to confirm the correctness of the accepted mathematical model for testing the problem. An FEM model was established for the purpose of building a computer simulation of the internal stresses in the coatings. The accuracy of the FEM model was verified by comparing the results of the computer simulation of the stresses with experimental results. A computer simulation of the stresses was carried out in the ANSYS environment using the FEM method. Structure observations, chemical composition measurements, and mechanical property characterisations of the investigated materials has been carried out to give a background for the discussion of the results that were recorded during the modelling process.

  18. Quantum Theory of Conditional Phonon States in a Dual-Pumped Raman Optical Frequency Comb

    Science.gov (United States)

    Mondloch, Erin

    In this work, we theoretically and numerically investigate nonclassical phonon states created in the collective vibration of a Raman medium by the generation of a dual-pumped Raman optical frequency comb in an optical cavity. This frequency comb is generated by cascaded Raman scattering driven by two phase-locked pump lasers that are separated in frequency by three times the Raman phonon frequency. We characterize the variety of conditioned phonon states that are created when the number of photons in all optical frequency modes except the pump modes are measured. Almost all of these conditioned phonon states are extremely well approximated as three-phonon-squeezed states or Schrodinger-cat states, depending on the outcomes of the photon number measurements. We show how the combinations of first-, second-, and third-order Raman scattering that correspond to each set of measured photon numbers determine the fidelity of the conditioned phonon state with model three-phonon-squeezed states and Schrodinger-cat states. All of the conditioned phonon states demonstrate preferential growth of the phonon mode along three directions in phase space. That is, there are three preferred phase values that the phonon state takes on as a result of Raman scattering. We show that the combination of Raman processes that produces a given set of measured photon numbers always produces phonons in multiples of three. In the quantum number-state representation, these multiples of three are responsible for the threefold phase-space symmetry seen in the conditioned phonon states. With a semiclassical model, we show how this three-phase preference can also be understood in light of phase correlations that are known to spontaneously arise in single-pumped Raman frequency combs. Additionally, our semiclassical model predicts that the optical modes also grow preferentially along three phases, suggesting that the dual-pumped Raman optical frequency comb is partially phase-stabilized.

  19. Raman scattering investigation of Bi2Te3 hexagonal nanoplates prepared by a solvothermal process in the absence of NaOH

    International Nuclear Information System (INIS)

    Liang Yujie; Wang Wenzhong; Zeng Baoqing; Zhang Guling; Huang Jing; Li Jin; Li Te; Song Yangyang; Zhang Xiuyu

    2011-01-01

    Research highlights: → Hexagonal Bi 2 Te 3 thin nanoplates were synthesized by a simple solvothermal method. → Optical properties of the nanoplates were investigated by micro-Raman spectroscopy. → Infrared (IR) active mode (A 1u ) is greatly activated in Raman scattering spectrum. → Infrared (IR) active mode (A 1u ) shows up in Raman spectrum of hexagonal nanoplates. → Raman spectrum clearly shows crystal symmetry breaking of hexagonal nanoplates. - Abstract: Hexagonal Bi 2 Te 3 nanoplates were synthesized by a simple solvothermal process in the absence of NaOH. The composition, morphology and size of the as-prepared products were characterized by powder X-ray diffraction (XRD) and transmission electron microscopy (TEM). Raman scattering optical properties of the as-prepared Bi 2 Te 3 nanoplates were investigated by micro-Raman spectroscopy. The Raman spectrum shows that infrared (IR) active mode (A 1u ), which must be odd parity and is Raman forbidden for bulk crystal due to its inversion symmetry, is greatly activated and shown up clearly in Raman scattering spectrum. We attribute the appearance of infrared active (A 1u ) in Raman spectrum to crystal symmetry breaking of Bi 2 Te 3 hexagonal nanoplates. The as-grown Bi 2 Te 3 hexagonal nanoplates, exhibiting novel Raman optical properties compared with bulk crystals, may find potential applications in thermoelectric devices.

  20. Raman spectroscopic study of plasma-treated salmon DNA

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Geon Joon; Kim, Yong Hee; Choi, Eun Ha [Plasma Bioscience Research Center, Kwangwoon University, Seoul 139-701 (Korea, Republic of); Kwon, Young-Wan [Department of Chemistry, Korea University, Seoul 136-701 (Korea, Republic of)

    2013-01-14

    In this research, we studied the effect of plasma treatment on the optical/structural properties of the deoxyribonucleic acid (DNA) extracted from salmon sperm. DNA-cetyltrimethylammonium (CTMA) films were obtained by complexation of DNA with CTMA. Circular dichroism (CD) and Raman spectra indicated that DNA retained its double helical structure in the solid film. The Raman spectra exhibited several vibration modes corresponding to the nuclear bases and the deoxyribose-phosphate backbones of the DNA, as well as the alkylchains of CTMA. Dielectric-barrier-discharge (DBD) plasma treatment induced structural modification and damage to the DNA, as observed by changes in the ultraviolet-visible absorption, CD, and Raman spectra. The optical emission spectra of the DBD plasma confirmed that DNA modification was induced by plasma ions such as reactive oxygen species and reactive nitrogen species.

  1. Raman study of Ba-doped ceria nanopowders

    Directory of Open Access Journals (Sweden)

    Radović M.

    2007-01-01

    Full Text Available A series of Ce1-xBaxO2-y (5£x£0.20 nanometric powders were synthesized by selfpropagating room temperature synthesis. XRD and Raman scattering measurements were used to characterize the samples at room temperature. All the samples are solid solutions with fluorite type structure with an average crystallite size about 5 nm. The redshift and asymmetric broadening of the Raman F2g mode can be well explained with combined confinement and strain effects because of the nanocrystalline powders nature. The appearance of the additional peaks at ~ 560 cm-1 and ~ 600 cm-1, are attributed to extrinsic and intrinsic O2- vacancies in ceria lattice. Raman spectra of temperature treated Ce0.80Ba0.20O2-d sample revealed the instability of this system.

  2. Resonant Raman spectroscopy of PAH-Os self-assembled multilayers

    International Nuclear Information System (INIS)

    Tognalli, N.; Fainstein, A.; Bonazzola, C.; Calvo, E.

    2004-01-01

    We present a resonant Raman scattering study of (PAH-Os/PVS) n and (PAH-Os/GOx) m self-assembled multilayers (n=1-11 and m=1-3). These Os polymer multilayers can be used in electrodes as efficient molecular wires for biomolecular recognition. The Raman intensity dependence on the number of self-assembly cycles provides information on the deposition process. The spectra are identical to that observed for PAH-Os in aqueous solution, indicating that the PAH-Os metal complex structure is conserved in the multilayers. We observe at ∼500 nm incoming and outgoing Raman resonances of osmium and bipyridine vibrational modes. These resonances are associated to the metal-to-ligand charge transfer (MLCT) transition. We study the evolution of these Raman modes as a function of the Os oxidation state during in situ electrochemistry. During the oxidation process, Os(II)→Os(III), the Raman resonance related to the MLCT disappears and the bipyridine related modes harden by ∼10 cm-1. These results are correlated with optical transmission measurements which show the disappearance of the visible region absorption when the Os complex is oxidized. We also find partial quenching of the Raman mode intensity after in situ voltamperometric cycles which demonstrates the existence of photo-electro-chemical processes

  3. Significant Contributions of the Albrecht's A Term to Nonresonant Raman Scattering Processes.

    Science.gov (United States)

    Gong, Zu-Yong; Tian, Guangjun; Duan, Sai; Luo, Yi

    2015-11-10

    The Raman intensity can be well described by the famous Albrecht's Raman theory that consists of A and B terms. It is well-known that the contribution from Albrecht's A term can be neglected without any loss of accuracy for far-off resonant Raman scattering processes. However, as demonstrated in this study, we have found that this widely accepted long-standing assumption fails drastically for totally symmetric vibration modes of molecules in general off-resonant Raman scattering. Perturbed first-principles calculations for water molecule show that strong constructive interference between the A and B terms occurs for the Raman intensity of the symmetric O-H stretching mode, which can account for ∼40% of the total intensity. Meanwhile, a minor destructive interference is found for the angle bending mode. The state-to-state mapping between Albrecht's theory and perturbation theory allows us to verify the accuracy of the widely employed perturbation method for the dynamic/resonant Raman intensities. The model calculations rationalized from water molecule with the bending mode show that the perturbation method is a good approximation only when the absolute energy difference between the first excited state and the incident light is more than five times greater than the vibrational energy in the ground state.

  4. Diffusion measurements by Raman spectroscopy

    DEFF Research Database (Denmark)

    Hansen, Susanne Brunsgaard; Shapiro, Alexander; Berg, Rolf W.

    Poster "Diffusion measurements by Raman spectroscopy", See poster at http://www.kemi.dtu.dk/~ajo/rolf/petroday2004.ppt......Poster "Diffusion measurements by Raman spectroscopy", See poster at http://www.kemi.dtu.dk/~ajo/rolf/petroday2004.ppt...

  5. Imaging with extrinsic Raman labels

    NARCIS (Netherlands)

    Sijtsema, N M; Duindam, J J; Puppels, G J; Otto, C; Greve, J

    1996-01-01

    In two separate examples we demonstrate the use of extrinsic Raman scattering probes for imaging of biological samples. First, the distribution of cholesterol in a rat eye Lens is determined with the use of the Raman scattered light from filipin, a molecule which binds specifically to cholesterol.

  6. Miniature Raman spectrometer development

    Science.gov (United States)

    Bonvallet, Joseph; Auz, Bryan; Rodriguez, John; Olmstead, Ty

    2018-02-01

    The development of techniques to rapidly identify samples ranging from, molecule and particle imaging to detection of high explosive materials, has surged in recent years. Due to this growing want, Raman spectroscopy gives a molecular fingerprint, with no sample preparation, and can be done remotely. These systems can be small, compact, lightweight, and with a user interface that allows for easy use and sample identification. Ocean Optics Inc. has developed several systems that would meet all these end user requirements. This talk will describe the development of different Ocean Optics Inc miniature Raman spectrometers. The spectrometer on a phone (SOAP) system was designed using commercial off the shelf (COTS) components, in a rapid product development cycle. The footprint of the system measures 40x40x14 mm (LxWxH) and was coupled directly to the cell phone detector camera optics. However, it gets roughly only 40 cm-1 resolution. The Accuman system is the largest (290x220X100 mm) of the three, but uses our QEPro spectrometer and get 7-11 cm-1 resolution. Finally, the HRS-30 measuring 165x85x40 mm is a combination of the other two systems. This system uses a modified EMBED spectrometer and gets 7-12 cm-1 resolution. Each of these units uses a peak matching algorithm that then correlates the results to the pre-loaded and customizable spectral libraries.

  7. Extremely low-loss single-mode photonic crystal fiber in the terahertz regime

    DEFF Research Database (Denmark)

    Islam, Raonaqul; Hasanuzzaman, G. K M; Sadath, Md Anwar

    2015-01-01

    This paper presents an updated design and numerical characterization of a rotated porous-core hexagonal photonic crystal fiber (PCF) for single-mode terahertz (THz) wave guidance. The simulation results are found using an efficient finite element method (FEM) which show a better and ultra-low eff...

  8. Femtosecond Broadband Stimulated Raman Spectroscopy

    International Nuclear Information System (INIS)

    Lee, Soo-Y; Yoon, Sagwoon; Mathies, Richard A

    2006-01-01

    Femtosecond broadband stimulated Raman spectroscopy (FSRS) is a new technique where a narrow bandwidth picosecond Raman pump pulse and a red-shifted broadband femtosecond Stokes probe pulse (with or without time delay between the pulses) act on a sample to produce a high resolution Raman gain spectrum with high efficiency and speed, free from fluorescence background interference. It can reveal vibrational structural information and dynamics of stationary or transient states. Here, the quantum picture for femtosecond broadband stimulated Raman spectroscopy (FSRS) is used to develop the semiclassical coupled wave theory of the phenomenon and to derive an expression for the measurable Raman gain in FSRS. The semiclassical theory is applied to study the dependence of lineshapes in FSRS on the pump-probe time delay and to deduce vibrational dephasing times in cyclohexane in the ground state

  9. Blood analysis by Raman spectroscopy.

    Science.gov (United States)

    Enejder, Annika M K; Koo, Tae-Woong; Oh, Jeankun; Hunter, Martin; Sasic, Slobodan; Feld, Michael S; Horowitz, Gary L

    2002-11-15

    Concentrations of multiple analytes were simultaneously measured in whole blood with clinical accuracy, without sample processing, using near-infrared Raman spectroscopy. Spectra were acquired with an instrument employing nonimaging optics, designed using Monte Carlo simulations of the influence of light-scattering-absorbing blood cells on the excitation and emission of Raman light in turbid medium. Raman spectra were collected from whole blood drawn from 31 individuals. Quantitative predictions of glucose, urea, total protein, albumin, triglycerides, hematocrit, and hemoglobin were made by means of partial least-squares (PLS) analysis with clinically relevant precision (r(2) values >0.93). The similarity of the features of the PLS calibration spectra to those of the respective analyte spectra illustrates that the predictions are based on molecular information carried by the Raman light. This demonstrates the feasibility of using Raman spectroscopy for quantitative measurements of biomolecular contents in highly light-scattering and absorbing media.

  10. Anharmonic effects in IR, Raman, and Raman optical activity spectra of alanine and proline zwitterions.

    Science.gov (United States)

    Danecek, Petr; Kapitán, Josef; Baumruk, Vladimír; Bednárová, Lucie; Kopecký, Vladimír; Bour, Petr

    2007-06-14

    The difference spectroscopy of the Raman optical activity (ROA) provides extended information about molecular structure. However, interpretation of the spectra is based on complex and often inaccurate simulations. Previously, the authors attempted to make the calculations more robust by including the solvent and exploring the role of molecular flexibility for alanine and proline zwitterions. In the current study, they analyze the IR, Raman, and ROA spectra of these molecules with the emphasis on the force field modeling. Vibrational harmonic frequencies obtained with 25 ab initio methods are compared to experimental band positions. The role of anharmonic terms in the potential and intensity tensors is also systematically explored using the vibrational self-consistent field, vibrational configuration interaction (VCI), and degeneracy-corrected perturbation calculations. The harmonic approach appeared satisfactory for most of the lower-wavelength (200-1800 cm(-1)) vibrations. Modern generalized gradient approximation and hybrid density functionals, such as the common B3LYP method, provided a very good statistical agreement with the experiment. Although the inclusion of the anharmonic corrections still did not lead to complete agreement between the simulations and the experiment, occasional enhancements were achieved across the entire region of wave numbers. Not only the transitional frequencies of the C-H stretching modes were significantly improved but also Raman and ROA spectral profiles including N-H and C-H lower-frequency bending modes were more realistic after application of the VCI correction. A limited Boltzmann averaging for the lowest-frequency modes that could not be included directly in the anharmonic calculus provided a realistic inhomogeneous band broadening. The anharmonic parts of the intensity tensors (second dipole and polarizability derivatives) were found less important for the entire spectral profiles than the force field anharmonicities (third

  11. Determining Gender by Raman Spectroscopy of a Bloodstain.

    Science.gov (United States)

    Sikirzhytskaya, Aliaksandra; Sikirzhytski, Vitali; Lednev, Igor K

    2017-02-07

    The development of novel methods for forensic science is a constantly growing area of modern analytical chemistry. Raman spectroscopy is one of a few analytical techniques capable of nondestructive and nearly instantaneous analysis of a wide variety of forensic evidence, including body fluid stains, at the scene of a crime. In this proof-of-concept study, Raman microspectroscopy was utilized for gender identification based on dry bloodstains. Raman spectra were acquired in mapping mode from multiple spots on a bloodstain to account for intrinsic sample heterogeneity. The obtained Raman spectroscopic data showed highly similar spectroscopic features for female and male blood samples. Nevertheless, support vector machines (SVM) and artificial neuron network (ANN) statistical methods applied to the spectroscopic data allowed for differentiating between male and female bloodstains with high confidence. More specifically, the statistical approach based on a genetic algorithm (GA) coupled with an ANN classification showed approximately 98% gender differentiation accuracy for individual bloodstains. These results demonstrate the great potential of the developed method for forensic applications, although more work is needed for method validation. When this method is fully developed, a portable Raman instrument could be used for the infield identification of traces of body fluids and to obtain phenotypic information about the donor, including gender and race, as well as for the analysis of a variety of other types of forensic evidence.

  12. Cell Imaging by Spontaneous and Amplified Raman Spectroscopies

    Directory of Open Access Journals (Sweden)

    Giulia Rusciano

    2017-01-01

    Full Text Available Raman spectroscopy (RS is a powerful, noninvasive optical technique able to detect vibrational modes of chemical bonds. The high chemical specificity due to its fingerprinting character and the minimal requests for sample preparation have rendered it nowadays very popular in the analysis of biosystems for diagnostic purposes. In this paper, we first discuss the main advantages of spontaneous RS by describing the study of a single protozoan (Acanthamoeba, which plays an important role in a severe ophthalmological disease (Acanthamoeba keratitis. Later on, we point out that the weak signals that originated from Raman scattering do not allow probing optically thin samples, such as cellular membrane. Experimental approaches able to overcome this drawback are based on the use of metallic nanostructures, which lead to a huge amplification of the Raman yields thanks to the excitation of localized surface plasmon resonances. Surface-enhanced Raman scattering (SERS and tip-enhanced Raman scattering (TERS are examples of such innovative techniques, in which metallic nanostructures are assembled on a flat surface or on the tip of a scanning probe microscope, respectively. Herein, we provide a couple of examples (red blood cells and bacterial spores aimed at studying cell membranes with these techniques.

  13. Multi-mode vibration control of piping system

    International Nuclear Information System (INIS)

    Minowa, Takeshi; Seto, Kazuto; Iiyama, Fumiya; Sodeyama, Hiroshi

    1999-01-01

    In this paper, dual dynamic absorbers are applied to the piping system in order to control the multiple vibration modes. ANSYS, which is one of the software based on FEM(finite element method), is used for the design of dual dynamic absorbers as well as for the determination of their optimum installing positions. The dual dynamic absorbers designed optimally for controlling the first three vibration modes perform just like a houde damper in higher frequency and have an effect on controlling higher modes. To use this advantage, three dual dynamic absorbers are installed in positions where they influence higher modes, and not only the first three modes of the piping system but also the extensive modes are controlled. Practical experimental study has also been carried out and it is shown that a dual dynamic absorber is suitable for controlling the vibration of the piping system. (author)

  14. Soliton-effect generation of Raman pulses in optical fibers with slowly decreasing dispersion

    International Nuclear Information System (INIS)

    Wenhua Cao; Youwei Zhang

    1995-01-01

    We suggested that single-mode fibers with slowly decreasing dispersion (FSDD) should be used for the generation of tunable ultrashort RAman pulses. A mathematical model is obtained for the description of ultrafast stimulated Raman scattering in optical fibers with slowly decreasing dispersion. Numerical simulations show that, under identical pump conditions, Raman pulse generated from this kind of fiber is shorter with a higher peak power than that generated from conventional fibers. This means that the Raman threshold of fibers with slowly decreasing dispersion may be lower than that of conventional fibers. Given pump conditions, we found that the highest peak power and narrowest width of the Raman pulse correspond to an optimal decrement velocity of the fiber dispersion

  15. Coupled wave equations theory of surface-enhanced femtosecond stimulated Raman scattering.

    Science.gov (United States)

    McAnally, Michael O; McMahon, Jeffrey M; Van Duyne, Richard P; Schatz, George C

    2016-09-07

    We present a coupled wave semiclassical theory to describe plasmonic enhancement effects in surface-enhanced femtosecond stimulated Raman scattering (SE-FSRS). A key result is that the plasmon enhanced fields which drive the vibrational equation of motion for each normal mode results in dispersive lineshapes in the SE-FSRS spectrum. This result, which reproduces experimental lineshapes, demonstrates that plasmon-enhanced stimulated Raman methods provide unique sensitivity to a plasmonic response. Our derived SE-FSRS theory shows a plasmonic enhancement of |gpu|(2)ImχR(ω)gst (2)/ImχR(ω), where |gpu|(2) is the absolute square of the plasmonic enhancement from the Raman pump, χR(ω) is the Raman susceptibility, and gst is the plasmonic enhancement of the Stokes field in SE-FSRS. We conclude with a discussion on potential future experimental and theoretical directions for the field of plasmonically enhanced coherent Raman scattering.

  16. Review on Raman scattering in semiconductor nanowires: I. theory

    Science.gov (United States)

    Cantarero, Andrés

    2013-01-01

    Raman scattering is a nondestructive technique that is able to supply information on the crystal and electronic structures, strain, temperature, phonon-phonon, and electron-phonon interaction. In the particular case of semiconductor nanowires, Raman scattering provides additional information related to surfaces. Although correct, a theoretical approach to analyze the surface optical modes loses critical information when retardation is neglected. A comparison of the retarded and unretarded approaches clarifies the role of the electric and magnetic polarization in the Raman selection rules. Since most III-V compounds growing in the zincblende phase change their crystal structure to wurtzite when growing as nanowires, the polariton description will be particularized for these two important crystal phases. Confined phonons exist in cylindrical nanowires and couple with longitudinal and transverse modes due to the presence of the nanowire's surface. This coupling vanishes in the case of rotational symmetry. The boundary conditions of the electromagnetic fields on small-size nanowires (antenna effect) have a dramatic effect on the polarization properties of a Raman spectrum.

  17. Integrated FEM-DBEM simulation of crack propagation in AA2024-T3 FSW butt joints considering manufacturing effects

    DEFF Research Database (Denmark)

    Sonne, Mads Rostgaard; Carlone, P.; Citarella, R.

    2015-01-01

    This paper deals with a numerical and experimental investigation on the influence of residual stresses on fatigue crack growth in AA2024-T3 friction stir welded butt joints. An integrated FEM-DBEM procedure for the simulation of crack propagation is proposed and discussed. A numerical FEM model...... of the welding process of precipitation hardenable AA2024-T3 aluminum alloy is employed to infer the process induced residual stress field. The reliability of the FEM simulations with respect to the induced residual stresses is assessed comparing numerical outcomes with experimental data obtained by means...

  18. Use of low-frequency Raman spectroscopy and chemometrics for the quantification of crystallinity in amorphous griseofulvin tablets

    DEFF Research Database (Denmark)

    Mah, Pei T.; Fraser, Sara J.; Reish, Matthew E.

    2015-01-01

    in stored amorphous samples earlier than the mid-frequency 785 nm Raman system. Overall, this study suggests that low-frequency Raman spectroscopy has at least equally good performance compared to mid-frequency Raman for quantitative analysis of crystallinity in the pharmaceutical setting. More generally......Low-frequency Raman spectroscopy, which directly probes phonon lattice modes of crystal structures, has much unexplored potential for sensitive qualitative and quantitative analysis of crystallinity in drugs and excipients. In this study, the level of crystallinity in tablets containing amorphous...

  19. Femtosecond stimulated Raman spectroscopy as a tool to detect molecular vibrations in ground and excited electronic states

    Energy Technology Data Exchange (ETDEWEB)

    Gelin, Maxim F.; Domcke, Wolfgang [Department of Chemistry, Technische Universität München, D-85747 Garching (Germany); Rao, B. Jayachander [Departamento de Química and Centro de Química, Universidade de Coimbra, 3004-535 Coimbra (Portugal)

    2016-05-14

    We give a detailed theoretical analysis of the simplest variant of femtosecond stimulated Raman spectroscopy, where a picosecond Raman pump pulse and a femtosecond Raman probe pulse are applied resonantly to a chromophore in thermal equilibrium in the ground electronic state. We demonstrate that this technique is capable of the detection of dephasing-free Raman-like lines revealing vibrational modes not only in the electronic ground state but also in the excited electronic state of the chromophore. The analytical results obtained with simplifying assumptions for the shape of the laser pulses are substantiated by numerical simulations with realistic laser pulses, employing the equation-of-motion phase-matching approach.

  20. A pseudo-Voigt component model for high-resolution recovery of constituent spectra in Raman spectroscopy

    DEFF Research Database (Denmark)

    Alstrøm, Tommy Sonne; Schmidt, Mikkel Nørgaard; Rindzevicius, Tomas

    2017-01-01

    Raman spectroscopy is a well-known analytical technique for identifying and analyzing chemical species. Since Raman scattering is a weak effect, surface-enhanced Raman spectroscopy (SERS) is often employed to amplify the signal. SERS signal surface mapping is a common method for detecting trace...... to directly and reliably identify the Raman modes, with overall performance similar to the state of the art non-negative matrix factorization approach. However, the model provides better interpretation and is a step towards enabling the use of SERS in detection of trace amounts of molecules in real-life...

  1. Polarized and resonant Raman spectroscopy on single InAs nanowires

    Science.gov (United States)

    Möller, M.; de Lima, M. M., Jr.; Cantarero, A.; Dacal, L. C. O.; Madureira, J. R.; Iikawa, F.; Chiaramonte, T.; Cotta, M. A.

    2011-08-01

    We report polarized Raman scattering and resonant Raman scattering studies on single InAs nanowires. Polarized Raman experiments show that the highest scattering intensity is obtained when both the incident and analyzed light polarizations are perpendicular to the nanowire axis. InAs wurtzite optical modes are observed. The obtained wurtzite modes are consistent with the selection rules and also with the results of calculations using an extended rigid-ion model. Additional resonant Raman scattering experiments reveal a redshifted E1 transition for InAs nanowires compared to the bulk zinc-blende InAs transition due to the dominance of the wurtzite phase in the nanowires. Ab initio calculations of the electronic band structure for wurtzite and zinc-blende InAs phases corroborate the observed values for the E1 transitions.

  2. FEM-DEM coupling simulations of the tool wear characteristics in prestressed machining superalloy

    Directory of Open Access Journals (Sweden)

    Ruitao Peng

    2016-01-01

    Full Text Available Due to the complicated contact loading at the tool-chip interface, ceramic tool wear in prestressed machining superalloy is rare difficult to evaluate only by experimental approaches. This study aims to develop a methodology to predict the tool wear evolution by using combined FEM and DEM numerical simulations. Firstly, a finite element model for prestressed cutting is established, subsequently a discrete element model to describe the tool-chip behaviour is established based on the obtained boundary conditions by FEM simulations, finally, simulated results are experimentally validated. The predicted tool wear results show nice agreement with experiments, the simulation indicates that, within a certain range, higher cutting speed effectively results in slighter wear of Sialon ceramic tools, and deeper depth of cut leads to more serious tool wear.

  3. First lasing of the Dutch Fusion-FEM: 730 kW, 200 GHz

    Energy Technology Data Exchange (ETDEWEB)

    Urbanus, W.H. E-mail: urbanus@rijnh.nl; Bongers, W.A.; Geer, C.A.J. van der; Manintveld, P.; Plomp, J.; Pluygers, J.; Poelman, A.J.; Smeets, P.H.M.; Schueller, F.C.; Verhoeven, A.G.A.; Bratman, V.L.; Denisov, G.G.; Savilov, A.V.; Shmelyov, M.Yu.; Caplan, M.; Varfolomeev, A.A

    1999-06-01

    A high-power electrostatic free-electron maser is operated at various frequencies. An output power of 730 kW at 206 GHz is generated with a 7.2 A, 1.77 MeV electron beam, and 360 kW at 167 GHz is generated with a 7.0 A, 1.61 MeV electron beam. It is shown experimentally and by simulations that, depending on the electron beam energy, the FEM can operate in single-frequency regime. First experiments were done without electron beam energy recovery system, and the pulse length was limited to 12 {mu}s. Nevertheless, many aspects of generation of mm-wave power have been explored, such as the dependency on the electron beam energy and beam current and cavity settings such as the feedback coefficient. The achieved parameters and the FEM dynamics are in good accordance with simulations.

  4. FEM × DEM: a new efficient multi-scale approach for geotechnical problems with strain localization

    Directory of Open Access Journals (Sweden)

    Nguyen Trung Kien

    2017-01-01

    Full Text Available The paper presents a multi-scale modeling of Boundary Value Problem (BVP approach involving cohesive-frictional granular materials in the FEM × DEM multi-scale framework. On the DEM side, a 3D model is defined based on the interactions of spherical particles. This DEM model is built through a numerical homogenization process applied to a Volume Element (VE. It is then paired with a Finite Element code. Using this numerical tool that combines two scales within the same framework, we conducted simulations of biaxial and pressuremeter tests on a cohesive-frictional granular medium. In these cases, it is known that strain localization does occur at the macroscopic level, but since FEMs suffer from severe mesh dependency as soon as shear band starts to develop, the second gradient regularization technique has been used. As a consequence, the objectivity of the computation with respect to mesh dependency is restored.

  5. New progress of FEM simulation and AI application in rolling at RAL

    International Nuclear Information System (INIS)

    Liu Xianghua; Wang Guodong; Zhao Kun

    2000-01-01

    New progresses on FEM simulation and AI application in rolling have been achieved at RAL recently. The existence and uniqueness of the extreme point of total functional for rolling problem has been proved. Different rolling processes, such as H-beam rolling, ribbing strip rolling, slab sizing, have been solved by our in-house FEM software package. The simulation results have been put into production use to improve the precision of math models. The Artificial Neural Network has been used to predict rolling force, coiling temperature, microstructure and properties of the rolled products. An expert system for deviation diagnoses of strip thickness has been developed for industry use. Synergetic Artificial Intelligence has also been applied to rolling scheduling. We are making continuous efforts to develop AI applications for rolling line co-operating in China steel industry. (author)

  6. Fluxball magnetic field analysis using a hybrid analytical/FEM/BEM with equivalent currents

    International Nuclear Information System (INIS)

    Fernandes, João F.P.; Camilo, Fernando M.; Machado, V. Maló

    2016-01-01

    In this paper, a fluxball electric machine is analyzed concerning the magnetic flux, force and torque. A novel method is proposed based in a special hybrid FEM/BEM (Finite Element Method/Boundary Element Method) with equivalent currents by using an analytical treatment for the source field determination. The method can be applied to evaluate the magnetic field in axisymmetric problems, in the presence of several magnetic materials. Same results obtained by a commercial Finite Element Analysis tool are presented for validation purposes with the proposed method. - Highlights: • The Fluxball machine magnetic field is analyzed by a new FEM/BEM/Analytical method. • The method is adequate for axisymmetric non homogeneous magnetic field problems. • The source magnetic field is evaluated considering a non-magnetic equivalent problem. • Material magnetization vectors are accounted by using equivalent currents. • A strong reduction of the finite element domain is achieved.

  7. 3D FEM Geometry and Material Flow Optimization of Porthole-Die Extrusion

    International Nuclear Information System (INIS)

    Ceretti, Elisabetta; Mazzoni, Luca; Giardini, Claudio

    2007-01-01

    The aim of this work is to design and to improve the geometry of a porthole-die for the production of aluminum components by means of 3D FEM simulations. In fact, the use of finite element models will allow to investigate the effects of the die geometry (webs, extrusion cavity) on the material flow and on the stresses acting on the die so to reduce the die wear and to improve the tool life. The software used to perform the simulations was a commercial FEM code, Deform 3D. The technological data introduced in the FE model have been furnished by METRA S.p.A. Company, partner in this research. The results obtained have been considered valid and helpful by the Company for building a new optimized extrusion porthole-die

  8. AN APPROACH TO EFFICIENT FEM SIMULATIONS ON GRAPHICS PROCESSING UNITS USING CUDA

    Directory of Open Access Journals (Sweden)

    Björn Nutti

    2014-04-01

    Full Text Available The paper presents a highly efficient way of simulating the dynamic behavior of deformable objects by means of the finite element method (FEM with computations performed on Graphics Processing Units (GPU. The presented implementation reduces bottlenecks related to memory accesses by grouping the necessary data per node pairs, in contrast to the classical way done per element. This strategy reduces the memory access patterns that are not suitable for the GPU memory architecture. Furthermore, the presented implementation takes advantage of the underlying sparse-block-matrix structure, and it has been demonstrated how to avoid potential bottlenecks in the algorithm. To achieve plausible deformational behavior for large local rotations, the objects are modeled by means of a simplified co-rotational FEM formulation.

  9. Three-dimensional Reconstruction and Homogenization of Heterogeneous Materials Using Statistical Correlation Functions and FEM

    Energy Technology Data Exchange (ETDEWEB)

    Baniassadi, Majid; Mortazavi, Behzad; Hamedani, Amani; Garmestani, Hamid; Ahzi, Said; Fathi-Torbaghan, Madjid; Ruch, David; Khaleel, Mohammad A.

    2012-01-31

    In this study, a previously developed reconstruction methodology is extended to three-dimensional reconstruction of a three-phase microstructure, based on two-point correlation functions and two-point cluster functions. The reconstruction process has been implemented based on hybrid stochastic methodology for simulating the virtual microstructure. While different phases of the heterogeneous medium are represented by different cells, growth of these cells is controlled by optimizing parameters such as rotation, shrinkage, translation, distribution and growth rates of the cells. Based on the reconstructed microstructure, finite element method (FEM) was used to compute the effective elastic modulus and effective thermal conductivity. A statistical approach, based on two-point correlation functions, was also used to directly estimate the effective properties of the developed microstructures. Good agreement between the predicted results from FEM analysis and statistical methods was found confirming the efficiency of the statistical methods for prediction of thermo-mechanical properties of three-phase composites.

  10. Optical phonon modes of wurtzite InP

    Science.gov (United States)

    Gadret, E. G.; de Lima, M. M.; Madureira, J. R.; Chiaramonte, T.; Cotta, M. A.; Iikawa, F.; Cantarero, A.

    2013-03-01

    Optical vibration modes of InP nanowires in the wurtzite phase were investigated by Raman scattering spectroscopy. The wires were grown along the [0001] axis by the vapor-liquid-solid method. The A1(TO), E2h, and E1(TO) phonon modes of the wurtzite symmetry were identified by using light linearly polarized along different directions in backscattering configuration. Additionally, forbidden longitudinal optical modes have also been observed. Furthermore, by applying an extended 11-parameter rigid-ion model, the complete dispersion relations of InP in the wurtzite phase have been calculated, showing a good agreement with the Raman experimental data.

  11. Arbitrary-Level Hanging Nodes and Automatic Adaptivity in the hp-FEM

    Czech Academy of Sciences Publication Activity Database

    Šolín, Pavel; Červený, Jakub; Doležel, Ivo

    2008-01-01

    Roč. 77, č. 1 (2008), s. 117-132 ISSN 0378-4754 R&D Projects: GA ČR(CZ) GA102/07/0496; GA ČR GA102/05/0629; GA AV ČR IAA100760702 Institutional research plan: CEZ:AV0Z20570509 Keywords : constrained approximation * hanging nodes * hp-FEM Subject RIV: JA - Electronics ; Optoelectronics, Electrical Engineering Impact factor: 0.930, year: 2008

  12. Discrete maximum principle for Poisson equation with mixed boundary conditions solved by hp-FEM

    Czech Academy of Sciences Publication Activity Database

    Vejchodský, Tomáš; Šolín, P.

    2009-01-01

    Roč. 1, č. 2 (2009), s. 201-214 ISSN 2070-0733 R&D Projects: GA AV ČR IAA100760702; GA ČR(CZ) GA102/07/0496; GA ČR GA102/05/0629 Institutional research plan: CEZ:AV0Z10190503 Keywords : discrete maximum principle * hp-FEM * Poisson equation * mixed boundary conditions Subject RIV: BA - General Mathematics

  13. Discrete conservation of nonnegativity for elliptic problems solved by the hp-FEM

    Czech Academy of Sciences Publication Activity Database

    Šolín, P.; Vejchodský, Tomáš; Araiza, R.

    2007-01-01

    Roč. 76, 1-3 (2007), s. 205-210 ISSN 0378-4754 R&D Projects: GA ČR GP201/04/P021 Institutional research plan: CEZ:AV0Z10190503 Keywords : discrete nonnegativity conservation * discrete Green's function * elliptic problems * hp-FEM * higher-order finite element methods * Poisson equation * numerical experimetns Subject RIV: BA - General Mathematics Impact factor: 0.738, year: 2007

  14. NDE (Nondestructive examination) by ultrasonic, photo-elastic, strain measuring and FEM (Finite Element Method)

    International Nuclear Information System (INIS)

    Gu Fangyu; Zeng Xiao

    1990-01-01

    It is considered impossible to inspect flaw by using ordinary mechanical measuring methods. In this paper, it is found that the stree and strain distortions of pressure vessel with 2D linear shape crack in the deep location appear the 'cat effect' on the surface of stracture, and that the location and size of the crack can be determined with strain measuring and FEM according to 'cat effect' of strain distortion

  15. Heat Generation Effects on U-Mo/Al through ABAQUS FEM Simulation

    Energy Technology Data Exchange (ETDEWEB)

    Cho, Taewon; Jeong, Gwan Yoon; Lee, Cheol Min; Sohn Dongseong [Ulsan National Institute of Science and Technology, Ulsan (Korea, Republic of)

    2014-05-15

    U-Mo/Al dispersion fuels have been considered a most promising candidate for a replacement of Highly Enriched Uranium (HEU) fuel in many research reactors. Coulson developed a FEM model which show the fuel meat realistically and compared the thermal conductivity results of two and three dimensional model. Williams also developed a FEM model which are different from the former in that it use regularly meshed unit cells. He showed a heat generation effects through FEM simulation and the effective thermal conductivity of the fuel with heat generated in the fuel particles is a little lower than that of the fuel with no heat generated. In the current work, the heat generation effects are analyzed and discussed in a wider range of volume fraction with more realistic models by using ABAQUS finite element package. The FEM model is used to determine the effective thermal conductivity of U-Mo/Al and to simulate the heat generation effects in the study. This model reflected the microscopic morphology of the fuel very well by making random distribution particles although the particle shape is considered as sphere. All simulation results show the heat generation effects although the effects are small when the volume fraction of fuels are high. When the particles are surrounded with interaction layers, the heat transfer from the particle to matrix is disturbed by interaction layers due to the low thermal conductivity of interaction layers. However this effects decreases when the sum of the volume fraction of fuels and interaction layers exceeds 40-50 vol% because a great portion of the heat must pass through fuels and interaction layers although the heat is applied on the surface. Therefore particle size and initial particle volume fractions will be the important factors for the heat generation effects when interaction layers grow during irradiations.

  16. On Scientific Data and Image Compression Based on Adaptive Higher-Order FEM

    Czech Academy of Sciences Publication Activity Database

    Šolín, Pavel; Andrš, David

    2009-01-01

    Roč. 1, č. 1 (2009), s. 56-68 ISSN 2070-0733 R&D Projects: GA ČR(CZ) GA102/07/0496; GA AV ČR IAA100760702 Institutional research plan: CEZ:AV0Z20570509 Keywords : data compress ion * image compress ion * adaptive hp-FEM Subject RIV: JA - Electronics ; Optoelectronics, Electrical Engineering http://www.global-sci.org/aamm

  17. Modular hp-FEM system HERMES and its application to Maxwell´s equations

    Czech Academy of Sciences Publication Activity Database

    Vejchodský, Tomáš; Šolín, P.; Zítka, M.

    2007-01-01

    Roč. 76, č. 2 (2007), s. 223-228 ISSN 0378-4754. [MODELLING 2005. Plzeň, 04.06.2005-08.06.2005] R&D Projects: GA ČR GP201/04/P021 Institutional research plan: CEZ:AV0Z10190503 Keywords : hp-FEM * time-harmonic Maxwell´s equations * hierarchic higher-order edge elements Subject RIV: BA - General Mathematics Impact factor: 0.738, year: 2007

  18. The Raman spectrum of LaFeO3

    International Nuclear Information System (INIS)

    Tompsett, G.A.; Phillips, R.J.; Sammes, N.M.

    1998-01-01

    LaFeO 3 was prepared using a reverse-strike coprecipitation method and compacts of the calcined powder were sintered at 1350, 1400 and 1450 deg C for 6 h. The Raman spectra of LaFeO 3 were obtained at both low-temperature and room-temperature, with 9 bands observed of predicted 24 Raman active modes. Mode assignment is determined from comparison with perovskites with the same structure, namely, SmAlO 3 and LaGaO 3 and are as follows: 102 (B 1g ), ca.140 (B 2g ), 150 (B 1g ), 176 (A g ), 227 (B 3g ), 261 (A g ), 289 (A g ), 429 (B 3g ). Copyright (1998) Australasian Ceramic Society

  19. High-pressure Raman investigation of the semiconductor antimony oxide

    Energy Technology Data Exchange (ETDEWEB)

    Geng, Aihui; Cao, Lihua [State Key Lab on High Power Semiconductor Laser, Changchun University of Science and Technology, 130022 Changchun (China); Changchun Institute of Optics, Fine Mechanics and Physics, Chinese Academy of Sciences, 130012 Changchun (China); Wan, Chunming [State Key Lab on High Power Semiconductor Laser, Changchun University of Science and Technology, 130022 Changchun (China); Ma, Yanmei [Department of Agronomy, Jilin University, 130062 Changchun (China)

    2011-05-15

    The in situ high-pressure behavior of the semiconductor antimony trioxide (Sb{sub 2}O{sub 3}) has been investigated by Raman spectroscopy techniques in a diamond anvil cell up to 20 GPa at room temperature. New peaks in the external lattice mode range emerged at a pressure above 8.6-15 GPa, suggesting that the structural phase transition occurred. The pressure dependence of Raman frequencies was obtained. The band at 139 cm{sup -1} (assigned to group mode) has a pressure dependence of -0.475 cm{sup -1}/GPa and reveals significant softening at high pressure. (copyright 2011 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  20. Strain Assessment in Graphene Through the Raman 2D′ Mode

    Czech Academy of Sciences Publication Activity Database

    del Corro, Elena; Kavan, Ladislav; Kalbáč, Martin; Frank, Otakar

    2015-01-01

    Roč. 119, č. 45 (2015), s. 25651-25656 ISSN 1932-7447 R&D Projects: GA ČR GA14-15357S; GA MŠk LL1301 Institutional support: RVO:61388955 Keywords : Charge transfer doping * graphene * Charge transfer Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 4.509, year: 2015

  1. Raman-Assisted Passively Mode-Locked Fiber Laser

    Science.gov (United States)

    Zhao, Lei; Yao, Pei-Jun; Gu, Chun; Xu, Li-Xin

    2018-04-01

    Not Available Supported by the National Natural Science Foundation of China under Grant No 61675188, and the Open Fund of Key Laboratory Pulse Power Laser Technology of China under Grant No SKL2016KF03.

  2. Scanning angle Raman spectroscopy: Investigation of Raman scatter enhancement techniques for chemical analysis

    Energy Technology Data Exchange (ETDEWEB)

    Meyer, Matthew W. [Iowa State Univ., Ames, IA (United States)

    2013-01-01

    This thesis outlines advancements in Raman scatter enhancement techniques by applying evanescent fields, standing-waves (waveguides) and surface enhancements to increase the generated mean square electric field, which is directly related to the intensity of Raman scattering. These techniques are accomplished by employing scanning angle Raman spectroscopy and surface enhanced Raman spectroscopy. A 1064 nm multichannel Raman spectrometer is discussed for chemical analysis of lignin. Extending dispersive multichannel Raman spectroscopy to 1064 nm reduces the fluorescence interference that can mask the weaker Raman scattering. Overall, these techniques help address the major obstacles in Raman spectroscopy for chemical analysis, which include the inherently weak Raman cross section and susceptibility to fluorescence interference.

  3. Investigation of load transfer efficiency in jointed plain concrete pavements (JPCP using FEM

    Directory of Open Access Journals (Sweden)

    Vahid Sadeghi

    2018-05-01

    Full Text Available Owing to heavy traffic loads, rigid pavements encounter various types of failures at transverse joints during their lifetime. Three-dimensional finite-element method (3D-FEM was used to assess the structural response of jointed concrete pavement under moving tandem axle loads. In this study, 3D FEM was verified using an existing numerical model and field measurement of the concrete slab traversed by a moving truck. This paper also investigated the effects of multiple parameters: material properties, slab geometry, load magnitude and frictional status of the slab and base layer on load transfer efficiency (LTE of the transverse joints. Further study has been done to investigate the slab performance without the dowel bars which occurs when parts of the pavement needed to be repaired using precast slabs. The aggregate interlock between the new slab and the existing slab is simulated by frictional interface. In 3D FEM model, the load transfer efficiency has been improved by increasing the elasticity modules of the concrete slab and the base layer or increasing the slab thickness. This can decrease the joints' deflections, reduces the damages on pavement joints. Removing dowel bars adversely affected the load transfer. Keywords: Concrete pavement, Load transfer, Finite-element method, Dowel bar, Structural behavior

  4. Welding distortion analysis of multipass joint combination with different sequences using 3D FEM and experiment

    International Nuclear Information System (INIS)

    Manurung, Yupiter H.P.; Lidam, Robert Ngendang; Rahim, M. Ridzwan; Zakaria, M. Yusof; Redza, M. Ridhwan; Sulaiman, M. Shahar; Tham, Ghalib; Abas, Sunhaji K.

    2013-01-01

    This paper presents an investigation of the welding sequence effect on induced angular distortion using FEM and experiments. The specimen of a combined joint geometry was modeled and simulated using Multipass Welding Advisor (MWA) in SYSWELD 2010 based on the thermal-elastic-plastic approach with low manganese carbon steel S3355J2G3 as specimen material and Goldak's double ellipsoid as heat source model. To validate the simulation results, a series of experiments was conducted with two different welding sequences using automated welding process, low carbon steel as parent metal, digital GMAW power source with premixed shielding gas and both-sided clamping technique. Based on the results, it was established that the thermo-elastic-plastic 3D FEM analysis shows good agreement with experimental results and the welding sequence “from outside to inside” induced less angular distortion compared to “from inside to outside”. -- Highlights: • 3D FEM was used to analyze the welding distortion on two different sequences. • Simulation results were validated with experiments using automated welding system. • Simulation results and experiments showed acceptable accuracy. • Welding sequence “outside–inside” showed less distortion than “inside–outside”

  5. Uncertainty assessment of a dike with an anchored sheet pile wall using FEM

    Directory of Open Access Journals (Sweden)

    Rippi Aikaterini

    2016-01-01

    Full Text Available The Dutch design codes for the dikes with retaining walls rely on Finite Element Analysis (FEM in combination with partial safety factors. However, this can lead to conservative designs. For this reason, in this study, a reliability analysis is carried out with FEM calculations aiming to demonstrate the feasibility of reliability analysis for a dike with an anchored sheet pile wall modelled in the 2D FEM, Plaxis. Sensitivity and reliability analyses were carried out and enabled by coupling the uncertainty package, OpenTURNS and Plaxis. The most relevant (ultimate limit states concern the anchor, the sheet pile wall, the soil body failure (global instability and finally the system. The case was used to investigate the applicability of the First Order Reliability Method (FORM and Directional Sampling (DS to analysing these limit states. The final goal is to estimate the probability of failure and identify the most important soil properties that affect the behaviour of each component and the system as a whole. The results of this research can be used to assess and optimize the current design procedure for dikes with retaining walls.

  6. Experiment study and FEM simulation on erythrocytes under linear stretching of optical micromanipulation

    Science.gov (United States)

    Liu, Ying; Song, Huadong; Zhu, Panpan; Lu, Hao; Tang, Qi

    2017-08-01

    The elasticity of erythrocytes is an important criterion to evaluate the quality of blood. This paper presents a novel research on erythrocytes' elasticity with the application of optical tweezers and the finite element method (FEM) during blood storage. In this work, the erythrocytes with different in vitro times were linearly stretched by trapping force using optical tweezers and the time dependent elasticity of erythrocytes was investigated. The experimental results indicate that the membrane shear moduli of erythrocytes increased with the increasing in vitro time, namely the elasticity was decreasing. Simultaneously, an erythrocyte shell model with two parameters (membrane thickness h and membrane shear modulus H) was built to simulate the linear stretching states of erythrocytes by the FEM, and the simulations conform to the results obtained in the experiment. The evolution process was found that the erythrocytes membrane thicknesses were decreasing. The analysis assumes that the partial proteins and lipid bilayer of erythrocyte membrane were decomposed during the in vitro preservation of blood, which results in thin thickness, weak bending resistance, and losing elasticity of erythrocyte membrane. This study implies that the FEM can be employed to investigate the inward mechanical property changes of erythrocyte in different environments, which also can be a guideline for studying the erythrocyte mechanical state suffered from different diseases.

  7. Efficiency improvement and torque ripple minimization of Switched Reluctance Motor using FEM and Seeker Optimization Algorithm

    International Nuclear Information System (INIS)

    Navardi, Mohammad Javad; Babaghorbani, Behnaz; Ketabi, Abbas

    2014-01-01

    Highlights: • This paper proposes a new method to optimize a Switched Reluctance Motor (SRM). • A combination of SOA and GA with Finite Element Method (FEM) analysis is employed to solve the SRM design optimization. • The results show that optimized SRM obtains higher average torque and higher efficiency. - Abstract: In this paper, performance optimization of Switched Reluctance Motor (SRM) was determined using Seeker Optimization Algorithm (SOA). The most efficient aim of the algorithm was found for maximum torque value at a minimum mass of the entire construction, following changing the geometric parameters. The optimization process was carried out using a combination of Seeker Optimization Algorithm and Finite Element Method (FEM). Fitness value was calculated by FEM analysis using COMSOL3.4, and the SOA was realized by MATLAB. The proposed method has been applied for a case study and it has been also compared with Genetic Algorithm (GA). The results show that the optimized motor using SOA had higher torque value and efficiency with lower mass and torque ripple, exhibiting the validity of this methodology for SRM design

  8. Numerical calculation of acoustic radiation from band-vibrating structures via FEM/FAQP method

    Directory of Open Access Journals (Sweden)

    GAO Honglin

    2017-08-01

    Full Text Available The Finite Element Method (FEM combined with the Frequency Averaged Quadratic Pressure method (FAQP are used to calculate the acoustic radiation of structures excited in the frequency band. The surface particle velocity of stiffened cylindrical shells under frequency band excitation is calculated using finite element software, the normal vibration velocity is converted from the surface particle velocity to calculate the average energy source (frequency averaged across intensity, frequency averaged across pressure and frequency averaged across velocity, and the FAQP method is used to calculate the average sound pressure level within the bandwidth. The average sound pressure levels are then compared with the bandwidth using finite element and boundary element software, and the results show that FEM combined with FAQP is more suitable for high frequencies and can be used to calculate the average sound pressure level in the 1/3 octave band with good stability, presenting an alternative to applying frequency-by-frequency calculation and the average frequency process. The FEM/FAQP method can be used as a prediction method for calculating acoustic radiation while taking the randomness of vibration at medium and high frequencies into consideration.

  9. An eddy current vector potential formulation for estimating hysteresis losses of superconductors with FEM

    International Nuclear Information System (INIS)

    Stenvall, A; Tarhasaari, T

    2010-01-01

    Many people these days employ only commercial finite element method (FEM) software when solving for the hysteresis losses of superconductors. Thus, the knowledge of a modeller is in the capability of using the black boxes of software efficiently. This has led to a relatively superficial examination of different formulations while the discussion stays mainly on the usage of the user interfaces of these programs. Also, if we stay only at the mercy of commercial software producers, we end up having less and less knowledge on the details of solvers. Then, it becomes more and more difficult to conceptually solve new kinds of problem. This may prevent us finding new kinds of method to solve old problems more efficiently, or finding a solution for a problem that was considered almost impossible earlier. In our earlier research, we presented the background of a co-tree gauged T-ψ FEM solver for computing the hysteresis losses of superconductors. In this paper, we examine the feasibility of FEM and eddy current vector potential formulation in the same problem.

  10. Raman Spectroscopic Studies of YBa2Cu3O7 Coated Conductors

    International Nuclear Information System (INIS)

    Choi, Mi Kyeung; Mnh, Nguyen Van; Bae, J. S.; Jo, William; Yang, In Sang; Ko, Rock Kil; Ha, Hong Soo; Park, Chan

    2005-01-01

    We present results of Raman spectroscopic studies of superconducting YBa 2 Cu 3 O 7 (YBCO) coated conductors. Raman scattering is used to characterize optical phonon modes, oxygen content, c-axis misalignment, and second phases of the YBCO coated conductors at a micro scale. A two-dimensional mapping of Raman spectra with transport properties has been performed to elucidate the effect of local propertied on current path and superconducting phase. The information taken from the local measurement will be useful for optimizing the process condition.

  11. Detection of latent prints by Raman imaging

    Science.gov (United States)

    Lewis, Linda Anne [Andersonville, TN; Connatser, Raynella Magdalene [Knoxville, TN; Lewis, Sr., Samuel Arthur

    2011-01-11

    The present invention relates to a method for detecting a print on a surface, the method comprising: (a) contacting the print with a Raman surface-enhancing agent to produce a Raman-enhanced print; and (b) detecting the Raman-enhanced print using a Raman spectroscopic method. The invention is particularly directed to the imaging of latent fingerprints.

  12. Frequency shifts in stimulated Raman scattering

    International Nuclear Information System (INIS)

    Zinth, W.; Kaiser, W.

    1980-01-01

    The nonresonant contributions to the nonlinear susceptibility chisup(()3) produce a frequency chirp during stimulated Raman scattering. In the case of transient stimulated Raman scattering, the spectrum of the generated Stokes pulse is found at higher frequencies than expected from spontaneous Raman data. The frequency difference can be calculated from the theory of stimulated Raman scattering. (orig.)

  13. Raman spectroscopy study of the doping effect of the encapsulated terbium halogenides on single-walled carbon nanotubes

    Energy Technology Data Exchange (ETDEWEB)

    Kharlamova, M.V.; Kramberger, C.; Mittelberger, A. [University of Vienna, Faculty of Physics, Vienna (Austria)

    2017-04-15

    In the present work, the doping effect of terbium chloride, terbium bromide, and terbium iodide on single-walled carbon nanotubes (SWCNTs) was compared by Raman spectroscopy. A precise investigation of the doping-induced alterations of the Raman modes of the filled SWCNTs was conducted. The shifts of the components of the Raman modes and modification of their profiles allowed concluding that the inserted terbium halogenides have acceptor doping effect on the SWCNTs, and the doping efficiency increases in the line with terbium iodide, terbium bromide, and terbium chloride. (orig.)

  14. Numerical simulation of the solitary wave interacting with an elastic structure using MPS-FEM coupled method

    Science.gov (United States)

    Rao, Chengping; Zhang, Youlin; Wan, Decheng

    2017-12-01

    Fluid-Structure Interaction (FSI) caused by fluid impacting onto a flexible structure commonly occurs in naval architecture and ocean engineering. Research on the problem of wave-structure interaction is important to ensure the safety of offshore structures. This paper presents the Moving Particle Semi-implicit and Finite Element Coupled Method (MPS-FEM) to simulate FSI problems. The Moving Particle Semi-implicit (MPS) method is used to calculate the fluid domain, while the Finite Element Method (FEM) is used to address the structure domain. The scheme for the coupling of MPS and FEM is introduced first. Then, numerical validation and convergent study are performed to verify the accuracy of the solver for solitary wave generation and FSI problems. The interaction between the solitary wave and an elastic structure is investigated by using the MPS-FEM coupled method.

  15. Verification of a three-dimensional FEM model for FBGs in PANDA fibers by transversal load experiments

    Science.gov (United States)

    Fischer, Bennet; Hopf, Barbara; Lindner, Markus; Koch, Alexander W.; Roths, Johannes

    2017-04-01

    A 3D FEM model of an FBG in a PANDA fiber with an extended fiber length of 25.4 mm is presented. Simulating long fiber lengths with limited computer power is achieved by using an iterative solver and by optimizing the FEM mesh. For verification purposes, the model is adapted to a configuration with transversal loads on the fiber. The 3D FEM model results correspond with experimental data and with the results of an additional 2D FEM plain strain model. In further studies, this 3D model shall be applied to more sophisticated situations, for example to study the temperature dependence of surface-glued or embedded FBGs in PANDA fibers that are used for strain-temperature decoupling.

  16. Femur ultrasound (FemUS)-first clinical results on hip fracture discrimination and estimation of femoral BMD

    DEFF Research Database (Denmark)

    Barkmann, R; Dencks, S; Laugier, P

    2010-01-01

    has been introduced yet. We developed a QUS scanner for measurements at the femur (Femur Ultrasound Scanner, FemUS) and tested its in vivo performance. METHODS: Using the FemUS device, we obtained femoral QUS and DXA on 32 women with recent hip fractures and 30 controls. Fracture discrimination......A quantitative ultrasound (QUS) device for measurements at the proximal femur was developed and tested in vivo (Femur Ultrasound Scanner, FemUS). Hip fracture discrimination was as good as for DXA, and a high correlation with hip BMD was achieved. Our results show promise for enhanced QUS...... and the correlation with femur bone mineral density (BMD) were assessed. RESULTS: Hip fracture discrimination using the FemUS device was at least as good as with hip DXA and calcaneal QUS. Significant correlations with total hip bone mineral density were found with a correlation coefficient R (2) up to 0...

  17. Stochastic phenomena in a fiber Raman amplifier

    Energy Technology Data Exchange (ETDEWEB)

    Kalashnikov, Vladimir [Aston Institute of Photonic Technologies, Aston University, Birmingham (United Kingdom); Institute of Photonics, Vienna University of Technology (Austria); Sergeyev, Sergey V. [Aston Institute of Photonic Technologies, Aston University, Birmingham (United Kingdom); Ania-Castanon, Juan Diego [Instituto de Optica CSIC, Madrid (Spain); Jacobsen, Gunnar [Acreo, Kista (Sweden); Popov, Sergei [Royal Institute of Technology (KTH), Stockholm (Sweden)

    2017-01-15

    The interplay of such cornerstones of modern nonlinear fiber optics as a nonlinearity, stochasticity and polarization leads to variety of the noise induced instabilities including polarization attraction and escape phenomena harnessing of which is a key to unlocking the fiber optic systems specifications required in high resolution spectroscopy, metrology, biomedicine and telecommunications. Here, by using direct stochastic modeling, the mapping of interplay of the Raman scattering-based nonlinearity, the random birefringence of a fiber, and the pump-to-signal intensity noise transfer has been done in terms of the fiber Raman amplifier parameters, namely polarization mode dispersion, the relative intensity noise of the pump laser, fiber length, and the signal power. The obtained results reveal conditions for emergence of the random birefringence-induced resonance-like enhancement of the gain fluctuations (stochastic anti-resonance) accompanied by pulse broadening and rare events in the form of low power output signals having probability heavily deviated from the Gaussian distribution. (copyright 2016 by WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  18. Raman spectroscopy of white wines.

    Science.gov (United States)

    Martin, Coralie; Bruneel, Jean-Luc; Guyon, François; Médina, Bernard; Jourdes, Michael; Teissedre, Pierre-Louis; Guillaume, François

    2015-08-15

    The feasibility of exploiting Raman scattering to analyze white wines has been investigated using 3 different wavelengths of the incoming laser radiation in the near-UV (325 nm), visible (532 nm) and near infrared (785 nm). To help in the interpretation of the Raman spectra, the absorption properties in the UV-visible range of two wine samples as well as their laser induced fluorescence have also been investigated. Thanks to the strong intensity enhancement of the Raman scattered light due to electronic resonance with 325 nm laser excitation, hydroxycinnamic acids may be detected and analyzed selectively. Fructose and glucose may also be easily detected below ca. 1000 cm(-1). This feasibility study demonstrates the potential of the Raman spectroscopic technique for the analysis of white wines. Copyright © 2015 Elsevier Ltd. All rights reserved.

  19. All-Fiber Raman Probe

    DEFF Research Database (Denmark)

    Brunetti, Anna Chiara

    by means of fiber components. Assuming the possibility to use a fiber laser with a fundamental radiation at 1064nm, in-fiber efficient second harmonic generation is achieved by optically poling the core of the waveguide delivering the excitation light to the sample. In this way, Raman spectroscopy...... in the visible range can be performed. The simultaneous delivery of the excitation light and collection of the Raman signal from the sample are achieved by means of a doubleclad fiber, whose core and inner cladding act as \\independent" transmission channels. A double-clad fiber coupler allows for the recovery...... of the collected Raman scattering from the inner-cladding region of the double-clad fiber, thus replacing the bulk dichroic component normally used to demultiplex the pump and Raman signal. A tunable Rayleigh-rejection filter based on a liquid filled-photonic bandgap fiber is also demonstrated in this work...

  20. 2-D FEM Simulation of Propagation and Radiation of Leaky Lamb Wave in a Plate-Type Ultrasonic Waveguide Sensor

    Energy Technology Data Exchange (ETDEWEB)

    Park, Sang-Jin; Kim, Hoe-Woong; Joo, Young-Sang; Kim, Sung-Kyun; Kim, Jong-Bum [KAERI, Daejeon (Korea, Republic of)

    2016-05-15

    This paper introduces the 2-D FEM simulation of the propagation and radiation of the leaky Lamb wave in and from a plate-type ultrasonic waveguide sensor conducted for the radiation beam profile analysis. The FEM simulations are performed with three different excitation frequencies and the radiation beam profiles obtained from FEM simulations are compared with those obtained from corresponding experiments. This paper deals with the 2-D FEM simulation of the propagation and radiation of the leaky Lamb wave in and from a plate-type ultrasonic waveguide sensor conducted to analyze the radiation beam profiles. The radiation beam profile results obtained from the FEM simulation show good agreement with the ones obtained from the experiment. This result will be utilized to improve the performance of the developed waveguide sensor. The quality of the visualized image is mainly affected by beam profile characteristics of the leaky wave radiated from the waveguide sensor. However, the relationships between the radiation beam profile and many parameters of the waveguide sensor are not fully revealed yet. Therefore, further parametric studies are necessary to improve the performance of the sensor and the finite element method (FEM) is one of the most effective tools for the parametric study.

  1. Raman study of InAs/InP quantum wires

    Science.gov (United States)

    Angelova, T.; Cros, A.; Cantarero, A.; Fuster, D.; González, Y.; González, L.

    2007-04-01

    We present a Raman study of the vibrational modes in InAs/InP (001) quantum wires. The energy of the observed phonon modes evidences the confinement properties of the wires, their strain anisotropy and the effect of atomic intermixing. Resonance effects in confined and interface phonons are discussed for excitation in the vicinity of the E1 critical point. The observed vibrations and their variation with sample characteristics are in agreement with the conclusions of previous structural and optical characterization performed in the same samples.

  2. Raman scattering in orthorhombic CuInS2 nanocrystals

    International Nuclear Information System (INIS)

    Dzhagan, V.M.; Valakh, M.Ya.; Litvinchuk, A.P.; Kruszynska, M.; Kolny-Olesiak, J.; Himcinschi, C.; Zahn, D.R.T.

    2014-01-01

    We report the results of non-resonant and resonant Raman scattering in orthorhombic nanocrystalline CuInS 2 semiconductor, supported by density functional first principle lattice dynamics calculations. A larger number of dominant phonon modes in comparison with standard tetragonal CuInS 2 phases is shown to be associated with peculiarities of cation sublattice ordering and is the ''fingerprint'' of the corresponding structural polymorph. Good overall agreement is found between theoretical and experimental phonon mode frequencies. (copyright 2014 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  3. Raman microscopic studies of PVD deposited hard ceramic coatings

    International Nuclear Information System (INIS)

    Constable, C.P.

    2000-01-01

    PVD hard ceramic coatings grown via the combined cathodic arc/unbalance magnetron deposition process were studied using Raman microscopy. Characteristic spectra from binary, multicomponent, multilayered and superlattice coatings were acquired to gain knowledge of the solid-state physics associated with Raman scattering from polycrystalline PVD coatings and to compile a comprehensive spectral database. Defect-induced first order scattering mechanisms were observed which gave rise to two pronounced groups of bands related to the acoustical (150- 300cm -1 ) and optical (400-7 50cm -1 ) parts of the phonon spectrum. Evidence was gathered to support the theory that the optic modes were mainly due to the vibrations of the lighter elements and the acoustic modes due to the vibrations of the heavier elements within the lattice. A study into the deformation and disordering on the Raman spectral bands of PVD coatings was performed. TiAIN and TiZrN coatings were intentionally damaged via scratching methods. These scratches were then analysed by Raman mapping, both across and along, and a detailed spectral interpretation performed. Band broadening occurred which was related to 'phonon relaxation mechanisms' as a direct result of the breaking up of coating grains resulting in a larger proportion of grain boundaries per-unit-volume. A direct correlation of the amount of damage with band width was observed. Band shifts were also found to occur which were due to the stresses caused by the scratching process. These shifts were found to be the largest at the edges of scratches. The Raman mapping of 'droplets', a defect inherent to PVD deposition processes, found that higher compressive stresses and large amounts of disorder occurred for coating growth onto droplets. Strategies designed to evaluate the ability of Raman microscopy to monitor the extent of real wear on cutting tools were evaluated. The removal of a coating layer and subsequent detection of a base layer proved

  4. Triplet State Resonance Raman Spectroscopy

    DEFF Research Database (Denmark)

    Wilbrandt, Robert Walter; Jensen, N. H.; Pagsberg, Palle Bjørn

    1978-01-01

    Makes the first report on the resonance Raman spectrum of a molecule in its triplet state generated by pulse radiolysis. A solution of 0.01 mol dm-3 of p-terphenyl in benzene was studied......Makes the first report on the resonance Raman spectrum of a molecule in its triplet state generated by pulse radiolysis. A solution of 0.01 mol dm-3 of p-terphenyl in benzene was studied...

  5. Heating by the Raman instability

    International Nuclear Information System (INIS)

    Estabrook, K.G.; Kruer, W.L.

    1980-01-01

    Computer simulations are presented of the reflection and heating due to stimulated Raman backscatter of intense laser light in large regions of underdense plasma. The heated electron distribution is found to be approximately a Maxwellian of temperature (m/sub e//2)v/sub p/ 2 , where v/sub p/ is the phase velocity of the electron plasma wave. A simple model of the reflection is presented. Raman may cause a pre-heat problem with large laser fusion reactor targets

  6. Raman spectroscopy of sputtered metal-graphene and metal-oxide-graphene interfaces

    Science.gov (United States)

    Chen, Ching-Tzu; Gajek, Marcin; Freitag, Marcus; Kuroda, Marcelo; Perebeinos, Vasili; Raoux, Simone

    2012-02-01

    In this talk, we report our recent development in sputtering deposition of magnetic and non-magnetic metal and metal-oxide thin films on graphene for applications in spintronics and nanoeleoctronics. TEM and SEM images demonstrate homogeneous coverage, uniform thickness, and good crystallinity of the sputtered films. Raman spectroscopy shows that the structure of the underlying graphene is well preserved, and the spectral weight of the defect D mode is comparable to that of the e-beam evaporated samples. Most significantly, we report the first observation of graphene-enhanced surface excitations of crystalline materials. Specifically, we discover two pronounced dispersive Raman modes at the interface of graphene and the nickel-oxide and cobalt-oxide films which we attribute to the strong light absorption and high-order resonant scattering process in the graphene layer. We will present the frequency-dependent, polarization-dependent Raman data of these two modes and discuss their microscopic origin.

  7. In vivo confocal Raman spectroscopy of the human cornea.

    Science.gov (United States)

    Bauer, N J; Hendrikse, F; March, W F

    1999-07-01

    To investigate the feasibility of a confocal Raman spectroscopic technique for the noninvasive assessment of corneal hydration in vivo in two legally blind subjects. A laser beam (632.8 nm; 15 mJ) was maintained on the cornea by using a microscope objective lens (x25 magnification, NA = 0.5, f = 10 mm) both for focusing the incident light as well as collecting the Raman backscattered light, in a 180 degrees backscatter configuration. An optical fiber, acting as the confocal pinhole for elimination of light from out-of-focus places, was coupled to a spectrometer that dispersed the collected light onto a sensitive array detector for rapid spectral data acquisition over a range from 2,890 to 3,590/cm(-1). Raman spectra were recorded from the anterior 100-150 microm of the cornea over a period before and after topical application of a mild dehydrating solution. The ratio between the amplitudes of the signals at 3,400/cm(-1) (OH-vibrational mode of water) and 2,940/cm(-1) (CH-vibrational mode of proteins) was used as a measure for corneal hydration. High signal-to-noise ratio (SNR = 25) Raman spectra were obtained from the human corneas by using 15 mJ of laser light energy. Qualitative changes in the hydration of the anteriormost part of the corneas could be observed as a result of the dehydrating agent. With adequate improvements in system safety, confocal Raman spectroscopy could potentially be applied clinically as a noninvasive tool for the assessment of corneal hydration in vivo.

  8. Raman scattering from epitaxial HfN layers grown on MgO(001)

    International Nuclear Information System (INIS)

    Stoehr, M.; Seo, H.-S.; Petrov, I.; Greene, J.E.

    2006-01-01

    Stoichiometric single-crystal HfN layers grown on MgO(001) are analyzed by Raman spectroscopy. Second-order Raman scattering predominates, but first-order modes in the acoustic and optical ranges are also visible. The latter indicates that the O h symmetry of NaCl-structure HfN is broken. The large mass difference between Hf and N leads to a correspondingly large separation, 250 cm -1 , between the first-order acoustic and optical bands. Within this gap, four Raman lines are clearly observed. The first three are the second-order transverse acoustic mode (240 cm -1 ), the sum of the first-order transverse and longitudinal acoustic modes (280 cm -1 ), and the second-order longitudinal acoustic mode (325 cm -1 ). The fourth line at 380 cm -1 is identified as the difference between the first-order optical and acoustic modes. The observed first-order Raman scattering, as well as the width of the gap between the first-order acoustic and optical modes, is in good agreement with previously calculated HfN phonon density of states

  9. Raman analysis of ferroelectric switching in niobium-doped lead zirconate titanate thin films

    International Nuclear Information System (INIS)

    Ferrari, P.; Ramos-Moore, E.; Guitar, M.A.; Cabrera, A.L.

    2014-01-01

    Characteristic Raman vibration modes of niobium-doped lead zirconate titanate (PNZT) are studied as a function of ferroelectric domain switching. The microstructure of PNZT is characterized by scanning electron microscopy and X-ray diffraction. Ferroelectric switching is achieved by applying voltages between the top (Au) and bottom (Pt) electrodes, while acquiring the Raman spectra in situ. Vibrational active modes associated with paraelectric and ferroelectric phases are identified after measuring above and below the ferroelectric Curie temperature, respectively. Changes in the relative intensities of the Raman peaks are observed as a function of the switching voltage. The peak area associated with the ferroelectric modes is analyzed as a function of the applied voltage within one ferroelectric polarization loop, showing local maxima around the coercive voltage. This behavior can be understood in terms of the correlation between vibrational and structural properties, since ferroelectric switching modifies the interaction between the body-centered atom (Zr, Ti or Nb) and the Pb–O lattice. - Highlights: • Electric fields induce structural distortions on ferroelectric perovskites. • Ferroelectric capacitor was fabricated to perform hysteresis loops. • Raman analysis was performed in situ during ferroelectric switching. • Raman modes show hysteresis and inflections around the coercive voltages. • Data can be understood in terms of vibrational–structural correlations

  10. Plasma Modes

    Science.gov (United States)

    Dubin, D. H. E.

    This chapter explores several aspects of the linear electrostatic normal modes of oscillation for a single-species non-neutral plasma in a Penning trap. Linearized fluid equations of motion are developed, assuming the plasma is cold but collisionless, which allow derivation of the cold plasma dielectric tensor and the electrostatic wave equation. Upper hybrid and magnetized plasma waves in an infinite uniform plasma are described. The effect of the plasma surface in a bounded plasma system is considered, and the properties of surface plasma waves are characterized. The normal modes of a cylindrical plasma column are discussed, and finally, modes of spheroidal plasmas, and finite temperature effects on the modes, are briefly described.

  11. Raman spectroscopy of ZnMnO thin films grown by pulsed laser deposition

    Science.gov (United States)

    Orozco, S.; Riascos, H.; Duque, S.

    2016-02-01

    ZnMnO thin films were grown by Pulsed Laser Deposition (PLD) technique onto Silicon (100) substrates at different growth conditions. Thin films were deposited varying Mn concentration, substrate temperature and oxygen pressure. ZnMnO samples were analysed by using Raman Spectroscopy that shows a red shift for all vibration modes. Raman spectra revealed that nanostructure of thin films was the same of ZnO bulk, wurzite hexagonal structure. The structural disorder was manifested in the line width and shape variations of E2(high) and E2(low) modes located in 99 and 434cm-1 respectively, which may be due to the incorporation of Mn ions inside the ZnO crystal lattice. Around 570cm-1 was found a peak associated to E1(LO) vibration mode of ZnO. 272cm-1 suggest intrinsic host lattice defects. Additional mode centred at about 520cm-1 can be overlap of Si and Mn modes.

  12. Raman scattering of 2H-MoS2 at simultaneous high temperature and high pressure (up to 600 K and 18.5 GPa

    Directory of Open Access Journals (Sweden)

    JianJun Jiang

    2016-03-01

    Full Text Available The Raman spectroscopy of natural molybdenite powder was investigated at simultaneous conditions of high temperature and high pressure in a heatable diamond anvil cell (DAC, to obtain the temperature and pressure dependence of the main Raman vibrational modes (E1g, E 2 g 1 ,A1g, and 2LA(M. Over our experimental temperature and pressure range (300–600 K and 1 atm−18.5 GPa, the Raman modes follow a systematic blue shift with increasing pressure, and red shift with increasing temperature. The results were calculated by three-variable linear fitting. The mutual correlation index of temperature and pressure indicates that the pressure may reduce the temperature dependence of Raman modes. New Raman bands due to structural changes emerged at about 3–4 GPa lower than seen in previous studies; this may be caused by differences in the pressure hydrostaticity and shear stress in the sample cell that promote the interlayer sliding.

  13. Raman scattering of 2H-MoS2 at simultaneous high temperature and high pressure (up to 600 K and 18.5 GPa)

    Science.gov (United States)

    Jiang, JianJun; Li, HePing; Dai, LiDong; Hu, HaiYing; Zhao, ChaoShuai

    2016-03-01

    The Raman spectroscopy of natural molybdenite powder was investigated at simultaneous conditions of high temperature and high pressure in a heatable diamond anvil cell (DAC), to obtain the temperature and pressure dependence of the main Raman vibrational modes (E1g, E2 g 1 ,A1g, and 2LA(M)). Over our experimental temperature and pressure range (300-600 K and 1 atm-18.5 GPa), the Raman modes follow a systematic blue shift with increasing pressure, and red shift with increasing temperature. The results were calculated by three-variable linear fitting. The mutual correlation index of temperature and pressure indicates that the pressure may reduce the temperature dependence of Raman modes. New Raman bands due to structural changes emerged at about 3-4 GPa lower than seen in previous studies; this may be caused by differences in the pressure hydrostaticity and shear stress in the sample cell that promote the interlayer sliding.

  14. Higher Order, Hybrid BEM/FEM Methods Applied to Antenna Modeling

    Science.gov (United States)

    Fink, P. W.; Wilton, D. R.; Dobbins, J. A.

    2002-01-01

    In this presentation, the authors address topics relevant to higher order modeling using hybrid BEM/FEM formulations. The first of these is the limitation on convergence rates imposed by geometric modeling errors in the analysis of scattering by a dielectric sphere. The second topic is the application of an Incomplete LU Threshold (ILUT) preconditioner to solve the linear system resulting from the BEM/FEM formulation. The final tOpic is the application of the higher order BEM/FEM formulation to antenna modeling problems. The authors have previously presented work on the benefits of higher order modeling. To achieve these benefits, special attention is required in the integration of singular and near-singular terms arising in the surface integral equation. Several methods for handling these terms have been presented. It is also well known that achieving he high rates of convergence afforded by higher order bases may als'o require the employment of higher order geometry models. A number of publications have described the use of quadratic elements to model curved surfaces. The authors have shown in an EFIE formulation, applied to scattering by a PEC .sphere, that quadratic order elements may be insufficient to prevent the domination of modeling errors. In fact, on a PEC sphere with radius r = 0.58 Lambda(sub 0), a quartic order geometry representation was required to obtain a convergence benefi.t from quadratic bases when compared to the convergence rate achieved with linear bases. Initial trials indicate that, for a dielectric sphere of the same radius, - requirements on the geometry model are not as severe as for the PEC sphere. The authors will present convergence results for higher order bases as a function of the geometry model order in the hybrid BEM/FEM formulation applied to dielectric spheres. It is well known that the system matrix resulting from the hybrid BEM/FEM formulation is ill -conditioned. For many real applications, a good preconditioner is required

  15. FEM validation of a double porosity elastic model for consolidation of structurally complex clayey soils

    Science.gov (United States)

    Callari, C.; Federico, F.

    2000-04-01

    Laboratory consolidation of structured clayey soils is analysed in this paper. The research is carried out by two different methods. The first one treats the soil as an isotropic homogeneous equivalent Double Porosity (DP) medium. The second method rests on the extensive application of the Finite Element Method (FEM) to combinations of different soils, composing 2D or fully 3D ordered structured media that schematically discretize the complex material. Two reference problems, representing typical situations of 1D laboratory consolidation of structured soils, are considered. For each problem, solution is obtained through integration of the equations governing the consolidation of the DP medium as well as via FEM applied to the ordered schemes composed of different materials. The presence of conventional experimental devices to ensure the drainage of the sample is taken into account through appropriate boundary conditions. Comparison of FEM results with theoretical results clearly points out the ability of the DP model to represent consolidation processes of structurally complex soils. Limits of applicability of the DP model may arise when the rate of fluid exchange between the two porous systems is represented through oversimplified relations. Results of computations, obtained having assigned reasonable values to the meso-structural and to the experimental apparatus parameters, point out that a partially efficient drainage apparatus strongly influences the distribution along the sample and the time evolution of the interstitial water pressure acting in both systems of pores. Data of consolidation tests in a Rowe's cell on samples of artificially fissured clays reported in the literature are compared with the analytical and numerical results showing a significant agreement.

  16. When the science fails and the ethics works: 'Fail-safe' ethics in the FEM-PrEP study.

    Science.gov (United States)

    Kingori, Patricia

    2015-12-01

    This paper will explore the concept of 'fail safe' ethics in the FEM PrEP trial, and the practice of research and ethics on the ground. FEM-PrEP examined the efficacy of PrEP in African women after promising outcomes in research conducted with MSM. This was a hugely optimistic time and FEM-PrEP was mobilised using rights-based ethical arguments that women should have access to PrEP. This paper will present data collected during an ethnographic study of frontline research workers involved in FEM-PrEP. During our discussions, 'fail-safe' ethics emerged as concept that encapsulated their confidence that their ethics could not fail. However, in 2011, FEM-PrEP was halted and deemed a failure. The women involved in the study were held responsible because contrary to researcher's expectations they were not taking the oral PrEP being researched. This examination of FEM-PrEP will show that ethical arguments are increasingly deployed to mobilise, maintain and in some cases stop trials in ways which, at times, are superseded or co-opted by other interests. While promoting the interests of women, rights-based approaches are argued to indirectly justify the continuation of individualised, biomedical interventions which have been problematic in other women-centred trials. In this examination of FEM-PrEP, the rights-based approach obscured: ethical concerns beyond access to PrEP; the complexities of power relationships between donor and host countries; the operations of the HIV industry in research-saturated areas and the cumulative effect of unfilled expectations in HIV research and how this has shaped ideas of research and ethics.

  17. Tip-enhanced Raman mapping with top-illumination AFM.

    Science.gov (United States)

    Chan, K L Andrew; Kazarian, Sergei G

    2011-04-29

    Tip-enhanced Raman mapping is a powerful, emerging technique that offers rich chemical information and high spatial resolution. Currently, most of the successes in tip-enhanced Raman scattering (TERS) measurements are based on the inverted configuration where tips and laser are approaching the sample from opposite sides. This results in the limitation of measurement for transparent samples only. Several approaches have been developed to obtain tip-enhanced Raman mapping in reflection mode, many of which involve certain customisations of the system. We have demonstrated in this work that it is also possible to obtain TERS nano-images using an upright microscope (top-illumination) with a gold-coated Si atomic force microscope (AFM) cantilever without significant modification to the existing integrated AFM/Raman system. A TERS image of a single-walled carbon nanotube has been achieved with a spatial resolution of ∼ 20-50 nm, demonstrating the potential of this technique for studying non-transparent nanoscale materials.

  18. Tip-enhanced Raman mapping with top-illumination AFM

    Energy Technology Data Exchange (ETDEWEB)

    Chan, K L Andrew; Kazarian, Sergei G, E-mail: s.kazarian@imperial.ac.uk [Department of Chemical Engineering, Imperial College London, SW7 2AZ (United Kingdom)

    2011-04-29

    Tip-enhanced Raman mapping is a powerful, emerging technique that offers rich chemical information and high spatial resolution. Currently, most of the successes in tip-enhanced Raman scattering (TERS) measurements are based on the inverted configuration where tips and laser are approaching the sample from opposite sides. This results in the limitation of measurement for transparent samples only. Several approaches have been developed to obtain tip-enhanced Raman mapping in reflection mode, many of which involve certain customisations of the system. We have demonstrated in this work that it is also possible to obtain TERS nano-images using an upright microscope (top-illumination) with a gold-coated Si atomic force microscope (AFM) cantilever without significant modification to the existing integrated AFM/Raman system. A TERS image of a single-walled carbon nanotube has been achieved with a spatial resolution of {approx} 20-50 nm, demonstrating the potential of this technique for studying non-transparent nanoscale materials.

  19. Tip-enhanced Raman mapping with top-illumination AFM

    International Nuclear Information System (INIS)

    Chan, K L Andrew; Kazarian, Sergei G

    2011-01-01

    Tip-enhanced Raman mapping is a powerful, emerging technique that offers rich chemical information and high spatial resolution. Currently, most of the successes in tip-enhanced Raman scattering (TERS) measurements are based on the inverted configuration where tips and laser are approaching the sample from opposite sides. This results in the limitation of measurement for transparent samples only. Several approaches have been developed to obtain tip-enhanced Raman mapping in reflection mode, many of which involve certain customisations of the system. We have demonstrated in this work that it is also possible to obtain TERS nano-images using an upright microscope (top-illumination) with a gold-coated Si atomic force microscope (AFM) cantilever without significant modification to the existing integrated AFM/Raman system. A TERS image of a single-walled carbon nanotube has been achieved with a spatial resolution of ∼ 20-50 nm, demonstrating the potential of this technique for studying non-transparent nanoscale materials.

  20. Fourier transform Raman spectroscopy of polyacrylamide gels for radiation dosimetry

    International Nuclear Information System (INIS)

    Baldock, C.; Murry, P.; Pope, J.; Rintoul, L.; George, G.

    1998-01-01

    Polyacrylamide (PAG) gels are used in magnetic resonance imaging radiation dosimetry. The PAG dosimeter is based on the radiation-induced co-polymerisation and cross-linking of acrylic monomers infused in a gel matrix. PAG was manufactured with a composition of 5% gelatine, 3% acrylamide and 3% N,N'methylene-bis-acrylamide by mass, with distilled water as the remaining constituent [Baldock, 1998]. FT-Raman spectroscopy studies were undertaken to investigate cross-linking changes during the co-polymerisation of PAG in the spectral range of 200 - 3500 cm -1 . Vibrational bands of 1285 cm -1 and 1256 cm -1 were assigned to the acrylamide and bis-acrylamide single CH 2 δ CH2 binding modes. These bands were found to decrease in amplitude with increasing absorbed radiation dose, as a result of co-polymerisation. Principal Component Regression was performed on FT-Raman spectra of PAG samples irradiated to 50 Gy and two components were found to be sufficient to account for 98.7% of variance in the data. Cross validation was used to establish the absorbed radiation dose of an unknown PAG sample from the FT-Raman spectra. The calculated correlation coefficient between measured and predictive samples was 0.997 with a standard error of estimate of 0.976 and a standard error of prediction of 1.140. These results demonstrate the potential of FT-Raman spectroscopy for ionising radiation dosimetry using polyacrylamide gels

  1. Physical chemistry of Nanogap-Enhanced Raman Scattering (NERS)

    Science.gov (United States)

    Suh, Yung Doug; Kim, Hyun Woo

    2017-08-01

    Plasmonically coupled electromagnetic field localization has generated a variety of new concepts and applications, and this has been one of the hottest topics in nanoscience, materials science, chemistry, physics and engineering and increasingly more important over the last decade. In particular, plasmonically coupled nanostructures with ultra-small gap ( 1-nm or smaller) gap have been of special interest due to their ultra-strong optical properties that can be useful for a variety of signal enhancements such surface-enhanced Raman scattering (SERS) and nanoantenna. These promising nanostructures with extraordinarily strong optical signal, however, have rendered a limited success in widespread use and commercialization largely due to the lack of designing principles, high-yield synthetic strategies with nm-level structural controllability and reproducibility and lack of systematic single-molecule and single-particle level studies. All these are extremely important challenges because even small changes ( 1 nm) of the coupled nanogap structures can significant affect plasmon mode and signal intensity and therefore structural and signal reproducibility and controllability can be in question. The plasmonic nanogap-enhanced Raman scattering (NERS) is defined as the plasmonic nanogap-based Raman signal enhancement within plasmonic nanogap particles with 1 nm gap and a Raman dye positioned inside the gap.

  2. Design of an 1800nm Raman amplifier

    DEFF Research Database (Denmark)

    Svane, Ask Sebastian; Rottwitt, Karsten

    2013-01-01

    We present the experimental results for a Raman amplifier that operates at 1810 nm and is pumped by a Raman fiber laser at 1680 nm. Both the pump laser and the Raman amplifier is polarization maintaining. A challenge when scaling Raman amplifiers to longer wavelengths is the increase...... in transmission loss, but also the reduction in the Raman gain coefficient as the amplifier wavelength is increased. Both polarization components of the Raman gain is characterized, initially for linearly co-polarized signal and pump, subsequently linearly polarized orthogonal signal and pump. The noise...

  3. Raman Optical Activity and Raman Spectra of Amphetamine Species

    DEFF Research Database (Denmark)

    Berg, Rolf W.; Shim, Irene; White, Peter Cyril

    2012-01-01

    Theoretical calculations and preliminary measurements of vibrational Raman optical activity (ROA) spectra of different species of amphetamine (amphetamine and amphetamine-H+) are reported for the first time. The quantum chemical calculations were carried out as hybrid ab initio DFT-molecular orbi......Theoretical calculations and preliminary measurements of vibrational Raman optical activity (ROA) spectra of different species of amphetamine (amphetamine and amphetamine-H+) are reported for the first time. The quantum chemical calculations were carried out as hybrid ab initio DFT...... are employed for identification purposes. The DFT calculations show that the most stable conformations are those allowing for close contact between the aromatic ring and the amine hydrogen atoms. The internal rotational barrier within the same amphetamine enanti- omer has a considerable influence on the Raman...

  4. Environmental equipment for usages of FEM software. ADVENTURE system user's guide

    International Nuclear Information System (INIS)

    Yamasaki, Ichirou; Yoshimura, Shinobu

    2003-05-01

    The community softwares, databases, and other various tools have been installed in the ITBL environment by the Office of ITBL Promotion as a common utility property for each research field. Among those softwares, Finite Element Method (FEM) code, Adventure (which was originally developed by Prof. Yoshimura, the University of Tokyo), is provided as one of structure analysis programs for ITBL users. The code is well known to possess a high performance ability for parallel processing, especially for massively parallel environments. In this report, a chain of processes for usages of the system as well as the installation method to PC cluster are described. (author)

  5. Interactive tool that empowers structural understanding and enables FEM analysis in a parametric design environment

    DEFF Research Database (Denmark)

    Christensen, Jesper Thøger; Parigi, Dario; Kirkegaard, Poul Henning

    2014-01-01

    This paper introduces an interactive tool developed to integrate structural analysis in the architectural design environment from the early conceptual design stage. The tool improves exchange of data between the design environment of Rhino Grasshopper and the FEM analysis of Autodesk Robot...... Structural Analysis. Further the tool provides intuitive setup and visual aids in order to facilitate the process. Enabling students and professionals to quickly analyze and evaluate multiple design variations. The tool has been developed inside the Performance Aided Design course at the Master...... of Architecture and Design at Aalborg University...

  6. Mechatronic FEM model of an electromagnetic-force-compensated load cell

    International Nuclear Information System (INIS)

    Weis, Hanna; Hilbrunner, Falko; Fröhlich, Thomas; Jäger, Gerd

    2012-01-01

    In this paper, a mechatronic model for an electromagnetic-force-compensated (EMC) load cell is presented. Designed in ANSYS Mechanical APDL®, the model consists of two modules: the mechanical behaviour of the load cell is represented by a FEM model. The electronic and the electromagnetic parts, consisting of a position indicator, controller and electromagnetic actuator, are implemented into the model as a set of differential equations via ANSYS Parametric Design Language (APDL). Optimization of the mechanical, electromagnetic and controller components can be performed using this model, as well as experiments to determine the sensitivity of the complete system to changes of environmental properties, e.g., the stiffness of the support. (paper)

  7. Environmental equipment for usages of FEM software. ADVENTURE system user's guide

    Energy Technology Data Exchange (ETDEWEB)

    Yamasaki, Ichirou [Japan Atomic Energy Research Inst., Center for Promotion of Computional Science and Engineering, Kizu, Kyoto (Japan); Yoshimura, Shinobu [Tokyo Univ., Tokyo (Japan)

    2003-05-01

    The community softwares, databases, and other various tools have been installed in the ITBL environment by the Office of ITBL Promotion as a common utility property for each research field. Among those softwares, Finite Element Method (FEM) code, Adventure (which was originally developed by Prof. Yoshimura, the University of Tokyo), is provided as one of structure analysis programs for ITBL users. The code is well known to possess a high performance ability for parallel processing, especially for massively parallel environments. In this report, a chain of processes for usages of the system as well as the installation method to PC cluster are described. (author)

  8. Converter-level FEM simulation for lifetime prediction of an LED driver with improved thermal modelling

    DEFF Research Database (Denmark)

    Niu, H.; Wang, H.; Ye, X.

    2017-01-01

    application. A converter-level finite element simulation (FEM) simulation is carried out to obtain the ambient temperature of electrolytic capacitors and power MOSFETs used in the LED driver, which takes into account the impact of the driver enclosure and the thermal coupling among different components....... Therefore, the proposed method bridges the link between the global ambient temperature profile outside of the enclosure and the local ambient temperature profiles of the components of interest inside the driver. A quantitative comparison of the estimated annual lifetime consumptions of MOSFETs...

  9. Mixed FEM for Second Order Elliptic Problems on Polygonal Meshes with BEM-Based Spaces

    KAUST Repository

    Efendiev, Yalchin

    2014-01-01

    We present a Boundary Element Method (BEM)-based FEM for mixed formulations of second order elliptic problems in two dimensions. The challenge, we would like to address, is a proper construction of H(div)-conforming vector valued trial functions on arbitrary polygonal partitions of the domain. The proposed construction generates trial functions on polygonal elements which inherit some of the properties of the unknown solution. In the numerical realization, the relevant local problems are treated by means of boundary integral formulations. We test the accuracy of the method on two model problems. © 2014 Springer-Verlag.

  10. Identification of the numerical model of FEM in reference to measurements in situ

    Science.gov (United States)

    Jukowski, Michał; Bec, Jarosław; Błazik-Borowa, Ewa

    2018-01-01

    The paper deals with the verification of various numerical models in relation to the pilot-phase measurements of a rail bridge subjected to dynamic loading. Three types of FEM models were elaborated for this purpose. Static, modal and dynamic analyses were performed. The study consisted of measuring the acceleration values of the structural components of the object at the moment of the train passing. Based on this, FFT analysis was performed, the main natural frequencies of the bridge were determined, the structural damping ratio and the dynamic amplification factor (DAF) were calculated and compared with the standard values. Calculations were made using Autodesk Simulation Multiphysics (Algor).

  11. Near IR Scanning Angle Total Internal Reflection Raman Spectroscopy at Smooth Gold Films

    Energy Technology Data Exchange (ETDEWEB)

    McKee, Kristopher; Meyer, Matthew; Smith, Emily

    2012-04-13

    Total internal reflection (TIR) Raman and reflectivity spectra were collected for nonresonant analytes as a function of incident angle at sapphire or sapphire/smooth 50 nm gold interfaces using 785 nm excitation. For both interfaces, the Raman signal as a function of incident angle is well-modeled by the calculated interfacial mean square electric field (MSEF) relative to the incident field times the thickness of the layer being probed in the Raman measurement (D{sub RS}). The Raman scatter was reproducibly enhanced at the interface containing a gold film relative to the sapphire interface by a factor of 4.3–4.6 for aqueous pyridine or 2.2–3.7 for neat nitrobenzene, depending on the analyzed vibrational mode. The mechanism for the increased Raman signal is the enhanced MSEF at incident angles where propagating surface plasmons are excited in the metal film. The background from the TIR prism was reduced by 89–95% with the addition of the gold film, and the percent relative uncertainty in peak area was reduced from 15 to 1.7% for the 1347 cm–1 mode of nitrobenzene. Single monolayers of benzenethiol (S/N = 6.8) and 4-mercaptopyridine (S/N = 16.5) on gold films were measured by TIR Raman spectroscopy with 785 nm excitation (210 mW) without resonant enhancement in 1 min.

  12. Tacoma mode

    International Nuclear Information System (INIS)

    Courant, E.D.; Ruth, R.D.; Wang, J.M.

    1979-01-01

    The name Tacoma refers to the Tacoma Narrows Bridge which collapsed on November 8, 1940 due to massive oscillations caused by high winds. One of the destructive modes was a torsion mode which was excited by transverse wind, a dipole force, and continued until the bridge collapsed. The name is used to refer to a coherent mode of oscillation of a spectrum of oscillators in which the amplitude vs frequency graph contains one node, where the node occurs near the driving frequency and a ω is not symmetric about zero. When this result is applied to vertical instabilities in coasting beams, it implies the existence of a coherent skew quadrupole moment, Q/sub xy/, whenever a coherent dipole oscillation exists

  13. Tacoma mode

    International Nuclear Information System (INIS)

    Courant, E.D.; Ruth, R.D.; Wang, J.M.

    1979-01-01

    The name Tacoma refers to the Tacoma Narrows Bridge which collapsed on November 8, 1940 due to massive oscillations caused by high winds. One of the destructive modes was a torsion mode which was excited by transverse wind, a dipole force, and continued until the bridge collapsed. The name is used to refer to a coherent mode of oscillation of a spectrum of oscillators in which the amplitude vs frequency graph contains one node, where the node occurs near the driving frequency and a(ω) is not symmetric about zero. When this result is applied to vertical instabilities in coasting beams, it implies the existence of a coherent skew quadrupole moment, whenever a coherent dipole oscillation exists

  14. Resonant Raman scattering of ZnS, ZnO, and ZnS/ZnO core/shell quantum dots

    Energy Technology Data Exchange (ETDEWEB)

    Milekhin, A.G. [Institute of Semiconductor Physics, Novosibirsk (Russian Federation); Novosibirsk State University, Novosibirsk (Russian Federation); Yeryukov, N.A.; Sveshnikova, L.L.; Duda, T.A. [Institute of Semiconductor Physics, Novosibirsk (Russian Federation); Himcinschi, C. [TU Bergakademie Freiberg, Institut fuer Theoretische Physik, Freiberg (Germany); Zenkevich, E.I. [Belarussian National Technical University, Minsk (Belarus); Zahn, D.R.T. [Chemnitz University of Technology, Semiconductor Physics, Chemnitz (Germany)

    2012-05-15

    Resonant Raman scattering by optical phonon modes as well as their overtones was investigated in ZnS and ZnO quantum dots grown by the Langmuir-Blodgett technique. The in situ formation of ZnS/ZnO core/shell quantum dots was monitored by Raman spectroscopy during laser illumination. (orig.)

  15. Raman chemical imaging technology for food and agricultural applications

    Science.gov (United States)

    This paper presents Raman chemical imaging technology for inspecting food and agricultural products. The paper puts emphasis on introducing and demonstrating Raman imaging techniques for practical uses in food analysis. The main topics include Raman scattering principles, Raman spectroscopy measurem...

  16. Optimization of force-cooled power transmission cables by means of 3D FEM simulations; Optimierung zwangsgekuehlter Energiekabel durch dreidimensionale FEM-Simulationen

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Dongping

    2009-10-26

    Lateral forced cooling can significantly increase the temporary overload capacity of a cable system, but the design of such systems requires a time-dependent 3D analysis of the nonlinear thermal behavior as the cooling water along the cable is heated up, resulting in position-dependent and time-dependent heat uptake. For this, a new calculation method was developed on the basis of an available 3D FEM software. The new method enables 3D simulation of force-cooled cables in consideration of the potential partial dryout of soil and of thermal stabilizations. The new method was first applied to a 110 kV wind power transmission cable for different configurations and grid conditions. It was found that with lateral forced cooling, the 110 kV will have a temporal 50 percent overload capacity. Further, the thermal characteristics and limiting capacity of a force-cooled 380 kV cable system were investigated. According to the results so far, laterally cooled cable systems open up new operating options, with advantages in terms of availability, economic efficiency, and flexibility. (orig.) [German] Eine laterale Zwangskuehlung kann die temporaere Ueberlastbarkeit einer Kabelanlage signifikant erhoehen. Der Entwurf solcher zwangsgekuehlter Kabelanlagen erfordert jedoch eine zeitabhaengige, dreidimensionale Analyse des nichtlinearen thermischen Verhaltens, da sich das Kuehlwasser entlang der Trasse erwaermt und sich so eine orts- und zeitabhaengige Waermeaufnahme ergibt. Zu diesem Zweck wurde auf der Basis eines vorhandenen zweidimensionalen FEM-Programms ein neues Berechnungsverfahren entwickelt, das die dreidimensionale Simulation zwangsgekuehlter Kabelanlagen unter Beruecksichtigung einer moeglicherweise auftretenden partiellen Bodenaustrocknung und von thermischen Stabilisierungen erlaubt. Mit Hilfe dieses Berechnungsverfahrens wurde zuerst eine 110-kV-Kabelanlage zur Windenergieuebertragung bei unterschiedlichen Anordnungen und unterschiedlichen Netzsituationen untersucht

  17. Low-Frequency Interlayer Breathing Modes in Few-Layer Black Phosphorus.

    Science.gov (United States)

    Ling, Xi; Liang, Liangbo; Huang, Shengxi; Puretzky, Alexander A; Geohegan, David B; Sumpter, Bobby G; Kong, Jing; Meunier, Vincent; Dresselhaus, Mildred S

    2015-06-10

    As a new two-dimensional layered material, black phosphorus (BP) is a very promising material for nanoelectronics and optoelectronics. We use Raman spectroscopy and first-principles theory to characterize and understand the low-frequency (LF) interlayer breathing modes (<100 cm(-1)) in few-layer BP for the first time. Using a laser polarization dependence study and group theory analysis, the breathing modes are assigned to Ag symmetry. Compared to the high-frequency (HF) Raman modes, the LF breathing modes are considerably more sensitive to interlayer coupling and, thus, their frequencies show a stronger dependence on the number of layers. Hence, they constitute an effective means to probe both the crystalline orientation and thickness of few-layer BP. Furthermore, the temperature dependence shows that in the temperature range -150 to 30 °C, the breathing modes have a weak anharmonic behavior, in contrast to the HF Raman modes that exhibit strong anharmonicity.

  18. Raman scattering of monolayer graphene: the temperature and oxygen doping effects

    International Nuclear Information System (INIS)

    Zhou Haiqing; Qiu Caiyu; Yu Fang; Yang Huaichao; Chen Minjiang; Hu Lijun; Guo Yanjun; Sun Lianfeng

    2011-01-01

    Raman spectra of monolayer graphene at various temperatures (303-473 K) are measured. In Raman scattering with wave numbers ranging from 1200 to 3400 cm -1 , the four main Raman peaks (G, 2D, T + D and 2D') show temperature-dependent behaviour, but have different frequency shifts with increase in temperature. We propose that the peak frequency shift is related mainly to the elongation of C-C bond due to thermal expansion or anharmonic coupling of phonon modes, and oxygen-induced strong hole doping on the graphene surface. The doping effect can be confirmed from the frequency shifts, full-width at half-maximum as well as the area and intensity ratios of G and 2D peaks in temperature-dependent Raman scattering of graphene, room-temperature Raman spectra of pristine graphene and graphene cooled down after Raman measurement at 473 K in air. Therefore, the oxygen doping effect and temperature effect coexist in temperature-dependent Raman scattering of monolayer graphene.

  19. Sum-Frequency-Generation-Based Laser Sidebands for Tunable Femtosecond Raman Spectroscopy in the Ultraviolet

    Directory of Open Access Journals (Sweden)

    Liangdong Zhu

    2015-04-01

    Full Text Available Femtosecond stimulated Raman spectroscopy (FSRS is an emerging molecular structural dynamics technique for functional materials characterization typically in the visible to near-IR range. To expand its applications we have developed a versatile FSRS setup in the ultraviolet region. We use the combination of a narrowband, ~400 nm Raman pump from a home-built second harmonic bandwidth compressor and a tunable broadband probe pulse from sum-frequency-generation-based cascaded four-wave mixing (SFG-CFWM laser sidebands in a thin BBO crystal. The ground state Raman spectrum of a laser dye Quinolon 390 in methanol that strongly absorbs at ~355 nm is systematically studied as a standard sample to provide previously unavailable spectroscopic characterization in the vibrational domain. Both the Stokes and anti-Stokes Raman spectra can be collected by selecting different orders of SFG-CFWM sidebands as the probe pulse. The stimulated Raman gain with the 402 nm Raman pump is >21 times larger than that with the 550 nm Raman pump when measured at the 1317 cm−1 peak for the aromatic ring deformation and ring-H rocking mode of the dye molecule, demonstrating that pre-resonance enhancement is effectively achieved in the unique UV-FSRS setup. This added tunability in the versatile and compact optical setup enables FSRS to better capture transient conformational snapshots of photosensitive molecules that absorb in the UV range.

  20. Theory of Graphene Raman Scattering.

    Science.gov (United States)

    Heller, Eric J; Yang, Yuan; Kocia, Lucas; Chen, Wei; Fang, Shiang; Borunda, Mario; Kaxiras, Efthimios

    2016-02-23

    Raman scattering plays a key role in unraveling the quantum dynamics of graphene, perhaps the most promising material of recent times. It is crucial to correctly interpret the meaning of the spectra. It is therefore very surprising that the widely accepted understanding of Raman scattering, i.e., Kramers-Heisenberg-Dirac theory, has never been applied to graphene. Doing so here, a remarkable mechanism we term"transition sliding" is uncovered, explaining the uncommon brightness of overtones in graphene. Graphene's dispersive and fixed Raman bands, missing bands, defect density and laser frequency dependence of band intensities, widths of overtone bands, Stokes, anti-Stokes anomalies, and other known properties emerge simply and directly.

  1. Multifocus confocal Raman microspectroscopy for fast multimode vibrational imaging of living cells.

    Science.gov (United States)

    Okuno, Masanari; Hamaguchi, Hiro-o

    2010-12-15

    We have developed a multifocus confocal Raman microspectroscopic system for the fast multimode vibrational imaging of living cells. It consists of an inverted microscope equipped with a microlens array, a pinhole array, a fiber bundle, and a multichannel Raman spectrometer. Forty-eight Raman spectra from 48 foci under the microscope are simultaneously obtained by using multifocus excitation and image-compression techniques. The multifocus confocal configuration suppresses the background generated from the cover glass and the cell culturing medium so that high-contrast images are obtainable with a short accumulation time. The system enables us to obtain multimode (10 different vibrational modes) vibrational images of living cells in tens of seconds with only 1 mW laser power at one focal point. This image acquisition time is more than 10 times faster than that in conventional single-focus Raman microspectroscopy.

  2. Phase discrimination in CdSe structures by means of Raman scattering

    International Nuclear Information System (INIS)

    Cusco, R.; Artus, L.; Consonni, V.; Bellet-Amalric, E.; Andre, R.

    2017-01-01

    Raman spectra of epitaxial layers of CdSe grown by molecular beam epitaxy have been measured for the cubic (zincblende) and hexagonal (wurtzite) phases. The Raman spectra are examined in the light of density functional calculations for these two highly similar structures. Characteristic Raman frequencies and spectral features associated with the different symmetry are discussed and reliable criteria for phase discrimination based on Raman spectroscopy are proposed. Although LO frequencies are virtually identical in both structures and may be affected by size effects, the observation of a low energy E 2 mode at 33 cm -1 unambiguously identifies the wurtzite structure and can be used as a specific fingerprint to distinguish between these two phases in CdSe-based nanostructures. The slightly lower LO frequency measured in the zincblende epitaxial layer is ascribed to residual tensile strain. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  3. High-temperature and high-pressure cubic zirconia anvil cell for Raman spectroscopy.

    Science.gov (United States)

    Chen, Jinyang; Zheng, Haifei; Xiao, Wansheng; Zeng, Yishan

    2003-10-01

    A simple and inexpensive cubic zirconia anvil cell has been developed for the performance of in situ Raman spectroscopy up to the conditions of 500 degrees C and 30 kbar pressure. The design and construction of this cell are fully described, as well as its applications for Raman spectroscopy. Molybdenum heater wires wrapped around ceramic tubes encircling two cubic zirconia anvils are used to heat samples, and the temperatures are measured and controlled by a Pt-PtRh thermocouple adhered near the sample chamber and an intelligent digital control apparatus. With this cell, Raman spectroscopic measurements have been satisfactorily performed on water at 6000 bar pressure to 455 degrees C and on ice of room temperature to 24 kbar, in which the determinations of pressures make use of changes of the A1 Raman modes of quartz and the shift of the sharpline (R-line) luminescence of ruby, respectively.

  4. A pulsed single-frequency Nd:GGG/BaWO4 Raman laser

    Science.gov (United States)

    Liu, Zhaojun; Men, Shaojie; Cong, Zhenhua; Qin, Zengguang; Zhang, Xingyu; Zhang, Huaijin

    2018-04-01

    A single-frequency pulsed laser at 1178.3 nm was demonstrated in a crystalline Raman laser. A crystal combination of Nd:GGG and BaWO4 was selected to realize Raman conversion from a 1062.5 nm fundamental wave to a 1178.3 nm Stokes wave. An entangled cavity was specially designed to form an intracavity Raman configuration. Single-longitudinal-mode operation was realized by introducing two Fabry-Perot etalons into the Raman laser cavity. This laser operated at a pulse repetition rate of 50 Hz with 2 ms long envelopes containing micro pulses at a 30 kHz repetition rate. The highest output power was 41 mW with the micro pulse duration of 15 ns. The linewidth was measured to be less than 130 MHz.

  5. Surface-enhanced Raman effect in hybrid metal–semiconductor nanoparticle assemblies

    International Nuclear Information System (INIS)

    Lughi, Vanni; Bonifacio, Alois; Barbone, Matteo; Marsich, Lucia; Sergo, Valter

    2013-01-01

    Hybrid metal–semiconductor nanoparticles consisting of silver nanoparticle cores (AgNPs) coated with a layer of CdSe quantum dots (QDs) have been studied by Raman spectroscopy. The hybrid nanoparticles were prepared via electrostatic interaction by mixing aqueous suspensions of QDs and AgNPs, where opposite charges on the AgNPs and QDs surfaces were induced by opportunely selected capping agents. Assemblies of such hybrid nanoparticles show an increased intensity of the Raman spectrum of up to 500 times, when compared to that of the sole QDs. This enhancement is attributed to the SERS effect (Surface-enhanced Raman scattering). Such enhancement of the Raman modes suggests several opportunities for further research, both in imaging and sensing applications.

  6. Inter-tetrahedra bond angle of permanently densified silicas extracted from their Raman spectra

    International Nuclear Information System (INIS)

    Hehlen, B

    2010-01-01

    Relative Raman scattering intensities are obtained in three samples of vitreous silica of increasing density. The variation of the intensity upon densification is very different for bending and stretching modes. For the former we find a Raman coupling-to-light coefficient C B ∝ω 2 . A comparative intensity and frequency dependence of the Raman spectral lines in the three glasses is performed. Provided the Raman spectra are normalized by C B , there exists a simple relation between the Si-O-Si bond angle and the frequency of all O-bending motions, including those of fourfold (n = 4) and threefold (n = 3) rings. For 20% densification we find a reduction of ∼5.7 deg. of the maximum of the network angle distribution, a value in very close agreement with previous NMR experiments. The threefold and fourfold rings are weakly perturbed by the densification, with a bond angle reduction of ∼0.5 deg. for the former.

  7. Development of a tunable femtosecond stimulated raman apparatus and its application to beta-carotene.

    Science.gov (United States)

    Shim, Sangdeok; Mathies, Richard A

    2008-04-17

    We have developed a tunable femtosecond stimulated Raman spectroscopy (FSRS) apparatus and used it to perform time-resolved resonance Raman experiments with Raman excitation, the resonant S1 state modes are enhanced by a factor of approximately 200 compared with 800 nm FSRS experiments. The improved signal-to-noise ratios facilitate the measurement of definitive time constants for beta-carotene dynamics including the 180 fs appearance of the S1 vibrational features due to direct internal conversion from S2 and their characteristic 9 ps decay to S0. By tuning the FSRS system to 590 nm Raman excitation, we are able to selectively enhance vibrational features of the hot ground state S hot 0 and monitor its approximately 5 ps cooling dynamics. This tunable FSRS system is valuable because it facilitates the direct observation of structural changes of selected resonantly enhanced states and intermediates during photochemical and photobiological reactions.

  8. Phase discrimination in CdSe structures by means of Raman scattering

    Energy Technology Data Exchange (ETDEWEB)

    Cusco, R.; Artus, L. [Institut Jaume Almera (ICTJA-CSIC), Consejo Superior de Investigaciones Cientificas, Lluis Sole i Sabaris s.n., 08028 Barcelona (Spain); Consonni, V. [Universite Grenoble Alpes and CNRS, LMGP, 38016 Grenoble (France); Bellet-Amalric, E. [Universite Grenoble Alpes and CEA, INAC-PHEILQS, Nanophysique et Semiconducteurs Group, 38000 Grenoble (France); Andre, R. [Universite Grenoble Alpes and CNRS, Institut Neel, Nanophysique et Semiconducteurs Group, 38000 Grenoble (France)

    2017-05-15

    Raman spectra of epitaxial layers of CdSe grown by molecular beam epitaxy have been measured for the cubic (zincblende) and hexagonal (wurtzite) phases. The Raman spectra are examined in the light of density functional calculations for these two highly similar structures. Characteristic Raman frequencies and spectral features associated with the different symmetry are discussed and reliable criteria for phase discrimination based on Raman spectroscopy are proposed. Although LO frequencies are virtually identical in both structures and may be affected by size effects, the observation of a low energy E{sub 2} mode at 33 cm{sup -1} unambiguously identifies the wurtzite structure and can be used as a specific fingerprint to distinguish between these two phases in CdSe-based nanostructures. The slightly lower LO frequency measured in the zincblende epitaxial layer is ascribed to residual tensile strain. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  9. Confocal Raman microscopy to monitor extracellular matrix during dental pulp stem cells differentiation

    Science.gov (United States)

    Salehi, Hamideh; Collart-Dutilleul, Pierre-Yves; Gergely, Csilla; Cuisinier, Frédéric J. G.

    2015-07-01

    Regenerative medicine brings promising applications for mesenchymal stem cells, such as dental pulp stem cells (DPSCs). Confocal Raman microscopy, a noninvasive technique, is used to study osteogenic differentiation of DPSCs. Integrated Raman intensities in the 2800 to 3000 cm-1 region (C-H stretching) and the 960 cm-1 peak (ν1 PO43-) were collected (to image cells and phosphate, respectively), and the ratio of two peaks 1660 over 1690 cm-1 (amide I bands) to measure the collagen cross-linking has been calculated. Raman spectra of DPSCs after 21 days differentiation reveal several phosphate peaks: ν1 (first stretching mode) at 960 cm-1, ν2 at 430 cm-1, and ν4 at 585 cm-1 and collagen cross-linking can also be calculated. Confocal Raman microscopy enables monitoring osteogenic differentiation in vitro and can be a credible tool for clinical stem cell based research.

  10. Probing the evaporation of ternary ethanol-methanol-water droplets by cavity enhanced Raman scattering.

    Science.gov (United States)

    Howle, Chris R; Homer, Chris J; Hopkins, Rebecca J; Reid, Jonathan P

    2007-10-21

    Cavity enhanced Raman scattering is used to characterise the evolving composition of ternary aerosol droplets containing methanol, ethanol and water during evaporation into a dry nitrogen atmosphere. Measurements made using non-linear stimulated Raman scattering from these ternary alcohol-water droplets allow the in situ determination of the concentration of the two alcohol components with high accuracy. The overlapping spontaneous Raman bands of the two alcohol components, arising from C-H stretching vibrational modes, are spectrally-resolved in stimulated Raman scattering measurements. We also demonstrate that the evaporation measurements are consistent with a quasi-steady state evaporation model, which can be used to interpret the evaporation dynamics occurring at a range of pressures at a particular evaporation time.

  11. Contrastive Analysis of the Raman Spectra of Polychlorinated Benzene: Hexachlorobenzene and Benzene

    Directory of Open Access Journals (Sweden)

    Zhengjun Zhang

    2011-12-01

    Full Text Available Detection of persistent pollutants such as polychlorinated benzene in environment in trace amounts is challenging, but important. It is more difficult to distinguish homologues and isomers of organic pollutantd when present in trace amounts because of their similar physical and chemical properties. In this work we simulate the Raman spectra of hexachlorobenzene and benzene, and figure out the vibration mode of each main peak. The effect on the Raman spectrum of changing substituents from H to Cl is analyzed to reveal the relations between the Raman spectra of homologues and isomers of polychlorinated benzene, which should be helpful for distinguishing one kind of polychlorinated benzene from its homologues and isomers by surface enhanced Raman scattering.

  12. Squeezing, photon bunching, photon antibunching and nonclassical photon statistics in degenerate hyper Raman processes

    International Nuclear Information System (INIS)

    Sen, Biswajit; Mandal, Swapan

    2007-01-01

    An initially prepared coherent state coupled to a second-order nonlinear medium is responsible for stimulated and spontaneous hyper Raman processes. By using an intuitive approach based on perturbation theory, the Hamiltonian corresponding to the hyper Raman processes is analytically solved to obtain the temporal development of the field operators. It is true that these analytical solutions are valid for small coupling constants. However, the interesting part is that these solutions are valid for reasonably large time. Hence, the present analytical solutions are quite general and are fresh compared to those solutions under short-time approximations. By exploiting the analytical solutions of field operators for various modes, we investigate the squeezing, photon antibunching and nonclassical photon statistics for pure modes of the input coherent light responsible for hyper Raman processes. At least in one instance (stimulated hyper Raman processes for vibration phonon mode), we report the simultaneous appearance of classical (photon bunching) and nonclassical (squeezing) effects of the radiation field responsible for hyper Raman processes

  13. Tip Enhanced Raman Spectroscopy of Rhodamine 6G on nanostructured gold substrate

    KAUST Repository

    Moretti, Manola

    2015-05-01

    A new concept based setup for Tip Enhanced Raman Scattering measurement assisted by gold nanostructure is presented, that can provide a platform for gap-mode enhancement of the signal at the single molecule level conjugated with controlled spatial localization of the molecule under investigation and a method to determine the diffraction limit properties of the tip. In essence, this effect is obtained illuminating a gold coated AFM tip which is raster scanned over a nanostructured gold substrate, after chemisorption of a Raman active molecule. We expect that the near-field Raman enhancement would be given by the gap-mode effect of the two facing nano-features. Thanks to the nanostructured substrate, we verify that the resolution of the Raman mapping signal is well below the diffraction limit given by the combination of the optics geometry and the laser wavelength. We show that the gap-mode TERS can generate an estimated field- enhancement (g) of ~20 in localized areas of the sample and we demonstrate the ability to spatially define the molecule position (by Raman mapping) at the tens of nanometers scale. © 2015 Elsevier Ltd.

  14. Tip Enhanced Raman Spectroscopy of Rhodamine 6G on nanostructured gold substrate

    KAUST Repository

    Moretti, Manola; Das, Gobind; Torre, Bruno; Allione, Marco; Di Fabrizio, Enzo M.

    2015-01-01

    A new concept based setup for Tip Enhanced Raman Scattering measurement assisted by gold nanostructure is presented, that can provide a platform for gap-mode enhancement of the signal at the single molecule level conjugated with controlled spatial localization of the molecule under investigation and a method to determine the diffraction limit properties of the tip. In essence, this effect is obtained illuminating a gold coated AFM tip which is raster scanned over a nanostructured gold substrate, after chemisorption of a Raman active molecule. We expect that the near-field Raman enhancement would be given by the gap-mode effect of the two facing nano-features. Thanks to the nanostructured substrate, we verify that the resolution of the Raman mapping signal is well below the diffraction limit given by the combination of the optics geometry and the laser wavelength. We show that the gap-mode TERS can generate an estimated field- enhancement (g) of ~20 in localized areas of the sample and we demonstrate the ability to spatially define the molecule position (by Raman mapping) at the tens of nanometers scale. © 2015 Elsevier Ltd.

  15. Field Raman spectrograph for environmental analysis

    International Nuclear Information System (INIS)

    Carrabba, M.M.

    1995-01-01

    The use of Raman Spectroscopy in the screening of soils, ground water, and surface waters for pollutants is described. A probe accessory for conducting surface enhanced Raman Spectroscopy is undergoing testing for dilute chlorinated solvents

  16. Raman and Photoluminescence Spectroscopy in Mineral Identification

    Science.gov (United States)

    Kuehn, J. W.

    2014-06-01

    Raman spectroscopy is particularly useful for rapid identification of minerals and gemstones. Raman spectrometers also allow PL studies for authentication of samples and geological provenance, diamond type screening and detection of HPHT treatments.

  17. Dynamics of long ring Raman fiber laser

    Science.gov (United States)

    Sukhanov, Sergey V.; Melnikov, Leonid A.; Mazhirina, Yulia A.

    2016-04-01

    The numerical model for dynamics of long fiber ring Raman laser is proposed. The model is based on the transport equations and Courant-Isaacson-Rees numerical method. Different regimes of a long ring fiber Raman laser are investigated.

  18. Failure Modes

    DEFF Research Database (Denmark)

    Jakobsen, K. P.; Burcharth, H. F.; Ibsen, Lars Bo

    1999-01-01

    The present appendix contains the derivation of ten different limit state equations divided on three different failure modes. Five of the limit state equations can be used independently of the characteristics of the subsoil, whereas the remaining five can be used for either drained or undrained s...

  19. Calculation of marine propeller static strength based on coupled BEM/FEM

    Directory of Open Access Journals (Sweden)

    YE Liyu

    2017-10-01

    Full Text Available [Objectives] The reliability of propeller stress has a great influence on the safe navigation of a ship. To predict propeller stress quickly and accurately,[Methods] a new numerical prediction model is developed by coupling the Boundary Element Method(BEMwith the Finite Element Method (FEM. The low order BEM is used to calculate the hydrodynamic load on the blades, and the Prandtl-Schlichting plate friction resistance formula is used to calculate the viscous load. Next, the calculated hydrodynamic load and viscous correction load are transmitted to the calculation of the Finite Element as surface loads. Considering the particularity of propeller geometry, a continuous contact detection algorithm is developed; an automatic method for generating the finite element mesh is developed for the propeller blade; a code based on the FEM is compiled for predicting blade stress and deformation; the DTRC 4119 propeller model is applied to validate the reliability of the method; and mesh independence is confirmed by comparing the calculated results with different sizes and types of mesh.[Results] The results show that the calculated blade stress and displacement distribution are reliable. This method avoids the process of artificial modeling and finite element mesh generation, and has the advantages of simple program implementation and high calculation efficiency.[Conclusions] The code can be embedded into the code of theoretical and optimized propeller designs, thereby helping to ensure the strength of designed propellers and improve the efficiency of propeller design.

  20. Integrity evaluation for stud female threads on pressure vessel according to ASME code using FEM

    International Nuclear Information System (INIS)

    Kim, Moon Young; Chung, Nam Yong

    2003-01-01

    The extension of design life among power plants is increasingly becoming a world-wide trend. Kori no.1 unit in Korea is operating two cycle. It has two man-ways for tube inspection in a steam generator which is one of the important components in a nuclear power plant. Especially, stud bolts for man-way cover have damaged by disassembly and assembly several times and degradation for bolt materials for long term operation. It should be evaluated and compared by ASME code criteria for integrity evaluation. Integrity evaluation criteria which has been made by the manufacturer is not applied on the stud bolts of nuclear pressure vessels directly because it is controlled by the yield stress of ASME code. It can apply evaluation criteria through FEM analysis to damaged female threads and to evaluated safety for helical-coil method which is used according to code case-N-496-1. From analysis results, we found that it is the same results between stress intensity which got from FEM analysis on damaged female threads over 10% by manufacture integrity criteria and 2/3 yield strength criteria on ASME code. It was also confirmed that the helical-coil repair method would be safe

  1. 1963 Vajont rock slide: a comparison between 3D DEM and 3D FEM

    Science.gov (United States)

    Crosta, Giovanni; Utili, Stefano; Castellanza, Riccardo; Agliardi, Federico; Bistacchi, Andrea; Weng Boon, Chia

    2013-04-01

    Data on the exact location of the failure surface of the landslide have been used as the starting point for the modelling of the landslide. 3 dimensional numerical analyses were run employing both the discrete element method (DEM) and a Finite Element Method (FEM) code. In this work the focus is on the prediction of the movement of the landlside during its initial phase of detachment from Mount Toc. The results obtained by the two methods are compared and conjectures on the observed discrepancies of the predictions between the two methods are formulated. In the DEM simulations the internal interaction of the sliding blocks and the expansion of the debris is obtained as a result of the kinematic interaction among the rock blocks resulting from the jointing of the rock mass involved in the slide. In the FEM analyses, the c-phi reduction technique was employed along the predefine failure surface until the onset of the landslide occurred. In particular, two major blocks of the landslide were identified and the stress, strain and displacement fields at the interface between the two blocks were analysed in detail.

  2. Investigation of the fittest shear transfer model used to FEM analysis of RC structures

    International Nuclear Information System (INIS)

    Endo, Tatumi; Aoyagi, Masao; Endo, Takao

    1988-01-01

    In order to rationalize the design method of reinforced concrete (RC) structures in the nuclear power plant, the structural analysis, which is able to simulate the seismic behavior of RC structures, should be established. In this report, the investigation of shear transfer model at shear plane to be applied to FEM analysis is performed. Main conclusions obtained within the limit of the study are as follows. 1. Development of the shear transfer model at shear plane. 1) Two shear transfer models are developed to be used to the 2-dimensional nonlinear FEM analysis. 2) In one model suggested, reinforcements are modeled by plate elements and the nonlinearity of concrete surrounding reinforcement but the properties of bond-slip relation between concrete and reinforcements is also considered. 3) In another model, reinforcements are modeled by equivalent concrete properties, in which axial regidity and dowel effects of reinforcements are considered. 2. Verification of the suggested model. 1) It is confirmed that the computational results using the above-mentioned model could simulate the experimental ones fairly well. 2) Considering the application to the analysis of RC structures in the design, the model, in which reinforcement are modeled by equivalent concrete properties, is useful in view point of accuracy and simplicity. (author)

  3. Raman Signatures of Polytypism in Molybdenum Disulfide.

    Science.gov (United States)

    Lee, Jae-Ung; Kim, Kangwon; Han, Songhee; Ryu, Gyeong Hee; Lee, Zonghoon; Cheong, Hyeonsik

    2016-02-23

    Since the stacking order sensitively affects various physical properties of layered materials, accurate determination of the stacking order is important for studying the basic properties of these materials as well as for device applications. Because 2H-molybdenum disulfide (MoS2) is most common in nature, most studies so far have focused on 2H-MoS2. However, we found that the 2H, 3R, and mixed stacking sequences exist in few-layer MoS2 exfoliated from natural molybdenite crystals. The crystal structures are confirmed by HR-TEM measurements. The Raman signatures of different polytypes are investigated by using three different excitation energies that are nonresonant and resonant with A and C excitons, respectively. The low-frequency breathing and shear modes show distinct differences for each polytype, whereas the high-frequency intralayer modes show little difference. For resonant excitations at 1.96 and 2.81 eV, distinct features are observed that enable determination of the stacking order.

  4. Raman studies of lanthanum cuprate superconductors

    International Nuclear Information System (INIS)

    Weber, W.H.; Peters, C.R.; Logothetis, E.M.

    1989-01-01

    Raman-scattering studies of the high-T/sub c/ superconductor La/sub 2-//sub x/(Sr, Ba)/sub x/CuO 4 are briefly reviewed. A detailed analysis of the phonon-mode symmetries is given along with a discussion of the effects expected from the orthorhombic-to-tetragonal phase transition, which is known to occur in these materials. Survey spectra are given for powders, ceramics, and single crystals, and an oxide of Cu is identified as the primary impurity phase. Extensive spectra are given from oriented single crystals of La 2 CuO 4 and La/sub 1.85/Sr/sub 0.15/CuO 4 , and several mode assignments are made. Spectra for the high-temperature tetragonal phase and the low-temperature orthorhombic phase are given for each material. The soft phonon associated with the phase transition is seen in La 2 CuO 4 as is a broad peak arising from two-magnon scattering. Neither of these features is seen in the Sr-doped sample

  5. Raman Spectroscopy of Microbial Pigments

    Science.gov (United States)

    Edwards, Howell G. M.; Oren, Aharon

    2014-01-01

    Raman spectroscopy is a rapid nondestructive technique providing spectroscopic and structural information on both organic and inorganic molecular compounds. Extensive applications for the method in the characterization of pigments have been found. Due to the high sensitivity of Raman spectroscopy for the detection of chlorophylls, carotenoids, scytonemin, and a range of other pigments found in the microbial world, it is an excellent technique to monitor the presence of such pigments, both in pure cultures and in environmental samples. Miniaturized portable handheld instruments are available; these instruments can be used to detect pigments in microbiological samples of different types and origins under field conditions. PMID:24682303

  6. Micro-raman and tip-enhanced raman spectroscopy of carbon allotropes

    NARCIS (Netherlands)

    Hoffmann, G.G.; With, de G.; Loos, J.

    2008-01-01

    Raman spectroscopic data are obtained on various carbon allotropes like diamond, amorphous carbon, graphite, graphene and single wall carbon nanotubes by micro-Raman spectroscopy, tip-enhanced Raman spectroscopy and tip-enhanced Raman spectroscopy imaging, and the potentials of these techniques for

  7. Mixture analysis with laser raman spctroscopy

    International Nuclear Information System (INIS)

    Kim, M.S.; Bark, G.M.

    1981-01-01

    Trace amount of methyl orange was determined in colored medium by resonance Raman spectrometry. Without major modification of a commercial laser Raman spectrometer, the resonance Raman active molecule could be determined satisfactorily in 10sup(-5)M range when the background fluorescence was more than 20 times stronger than the signal. Use of fluorescence quenching agent was found helpful to improve the Raman signal. Suggestions for the improvement of analytical method is presented. (Author)

  8. Subfemtosecond pulse generation by cascade-stimulated Raman scattering with modulated Raman excitation

    International Nuclear Information System (INIS)

    Wu Kun; Wu Jian; Zeng Heping

    2003-01-01

    Subfemtosecond (sub-fs) pulses can be generated by cascade-stimulated Raman scattering in a Raman medium with modulated Raman excitations, driven by two sufficiently intense laser beams, one of which is amplitude modulated. The nonadiabatic Raman interaction establishes a strong modulated Raman coherence, which supports compression of the generated broadband Raman sidebands to a train of sub-fs pulses regardless of whether the carrier frequencies of the driving lasers are tuned above, below or on two-photon Raman resonance. (letter to the editor)

  9. Raman spectroscopy for DNA quantification in cell nucleus.

    Science.gov (United States)

    Okotrub, K A; Surovtsev, N V; Semeshin, V F; Omelyanchuk, L V

    2015-01-01

    Here we demonstrate the feasibility of a novel approach to quantify DNA in cell nuclei. This approach is based on spectroscopy analysis of Raman light scattering, and avoids the problem of nonstoichiometric binding of dyes to DNA, as it directly measures the signal from DNA. Quantitative analysis of nuclear DNA contribution to Raman spectrum could be reliably performed using intensity of a phosphate mode at 1096 cm(-1) . When compared to the known DNA standards from cells of different animals, our results matched those values at error of 10%. We therefore suggest that this approach will be useful to expand the list of DNA standards, to properly adjust the duration of hydrolysis in Feulgen staining, to assay the applicability of fuchsines for DNA quantification, as well as to measure DNA content in cells with complex hydrolysis patterns, when Feulgen densitometry is inappropriate. © 2014 International Society for Advancement of Cytometry.

  10. Theory of Raman scattering in coupled electron-phonon systems

    Science.gov (United States)

    Itai, K.

    1992-01-01

    The Raman spectrum is calculated for a coupled conduction-electron-phonon system in the zero-momentum-transfer limit. The Raman scattering is due to electron-hole excitations and phonons as well. The phonons of those branches that contribute to the electron self-energy and the correction of the electron-phonon vertex are assumed to have flat energy dispersion (the Einstein phonons). The effect of electron-impurity scattering is also incorporated. Both the electron-phonon interaction and the electron-impurity interaction cause the fluctuation of the electron distribution between different parts of the Fermi surface, which results in overdamped zero-sound modes of various symmetries. The scattering cross section is obtained by solving the Bethe-Salpeter equation. The spectrum shows a lower threshold at the smallest Einstein phonon energy when only the electron-phonon interaction is taken into consideration. When impurities are also taken into consideration, the threshold disappears.

  11. Pulsed Raman fiber laser and multispectral imaging in three dimensions

    DEFF Research Database (Denmark)

    Andersen, Joachim F.; Busck, Jens; Heiselberg, Henning

    2006-01-01

    Raman scattering in single-mode optical fibers is exploited to generate multispectral light from a green nanolaser with high pulse repetition rate. Each pulse triggers a picosecond camera and measures the distance by time-of-flight in each of the 0.5 Mpixels. Three-dimensional images...... are then constructed with submillimeter accuracy for all visible colors. The generation of a series of Stokes peaks by Raman scattering in a Si fiber is discussed in detail and the laser radar technique is demonstrated. The data recording takes only a few seconds, and the high accuracy 3D color imaging works at ranges...... up to ∼200 m. Applications for optical tomography in highly scattering media such as water and human tissue are mentioned. © 2006 Optical Society of America....

  12. Raman scattering characterization of space solar cell structures

    Science.gov (United States)

    Mintairov, Alexander M.; Khvostikov, V. P.; Paleeva, E. V.; Sorokina, S. V.

    1995-01-01

    A contactless method for the determination of the free-carrier density and the composition distribution across the thickness of 3-5 multi-layer solar cell structures, using the Raman scattering method, is developed. The method includes a step analysis of Raman spectra from optical phonons and phonon-plasmon modes of different layers. The method provides simultaneous measurements of the element composition and the thickness of the structure's layers together with the free-carrier density. The results of measurements of the free-carrier density composition distributions of the liquid phase epitaxy grown AlGaAs/GaAs and GaSb solar cell structures are presented and discussed.

  13. Raman Microscopy and Microspectroscopy of Biological Materials

    NARCIS (Netherlands)

    Sijtsema, N.M.; Otto, C.; Segers-Nolten, G.M.J.; Greve, J.; Merlin, Jean Claude; Turrell, Sylvia; Huvenne, Jean Pierre

    With a confocal Raman microspectrometer it is possible to collect Raman signal of a volume of only 1 µm3 Therefore, this technique offers the possibility to obtain information about the chemical composition of small cell structures like granules, without destroying the cell [1], This makes Raman

  14. Raman spectra of lignin model compounds

    Science.gov (United States)

    Umesh P. Agarwal; Richard S. Reiner; Ashok K. Pandey; Sally A. Ralph; Kolby C. Hirth; Rajai H. Atalla

    2005-01-01

    To fully exploit the value of Raman spectroscopy for analyzing lignins and lignin containing materials, a detailed understanding of lignins’ Raman spectra needs to be achieved. Although advances made thus far have led to significant growth in application of Raman techniques, further developments are needed to improve upon the existing knowledge. Considering that lignin...

  15. Raman selection rule of surface optical phonon in ZnS nanobelts

    KAUST Repository

    Ho, Chih-Hsiang; Varadhan, Purushothaman; Wang, Hsin-Hua; Chen, Cheng-Ying; Fang, Xiaosheng; He, Jr-Hau

    2016-01-01

    We report Raman scattering results of high-quality wurtzite ZnS nanobelts (NBs) grown by chemical vapor deposition. In Raman spectrum, the ensembles of ZnS NBs exhibit first order phonon modes at 274 cm-1 and 350 cm-1, corresponding to A1/E1 transverse optical and A1/E1 longitudinal optical phonons, in addition with strong surface optical (SO) phonon mode at 329 cm-1. The existence of SO band is confirmed by its shift with different surrounding dielectric media. Polarization dependent Raman spectrum was performed on a single ZnS NB and for the first time SO phonon band has been detected on a single nanobelt. Different selection rules of SO phonon modeshown from their corresponding E1/A1 phonon modeswere attributed to the anisotropic translational symmetry breaking on the NB surface.

  16. Raman selection rule of surface optical phonon in ZnS nanobelts

    KAUST Repository

    Ho, Chih-Hsiang

    2016-02-18

    We report Raman scattering results of high-quality wurtzite ZnS nanobelts (NBs) grown by chemical vapor deposition. In Raman spectrum, the ensembles of ZnS NBs exhibit first order phonon modes at 274 cm-1 and 350 cm-1, corresponding to A1/E1 transverse optical and A1/E1 longitudinal optical phonons, in addition with strong surface optical (SO) phonon mode at 329 cm-1. The existence of SO band is confirmed by its shift with different surrounding dielectric media. Polarization dependent Raman spectrum was performed on a single ZnS NB and for the first time SO phonon band has been detected on a single nanobelt. Different selection rules of SO phonon modeshown from their corresponding E1/A1 phonon modeswere attributed to the anisotropic translational symmetry breaking on the NB surface.

  17. DFT, FT-IR, FT-Raman and vibrational studies of 3-methoxyphenyl boronic acid

    Science.gov (United States)

    Patil, N. R.; Hiremath, Sudhir M.; Hiremath, C. S.

    2018-05-01

    The aim of this work is to study the possible stable, geometrical molecular structure, experimental and theoretical FT-IR and FT-Raman spectroscopic methods of 3-Methoxyphenyl boronic acid (3MPBA). FT-IR and FT-Raman spectra were recorded in the region of 4000-400 cm-1 and 40000-50 cm-1 respectively. The optimized geometric structure and vibrational wavenumbers of the title compound were searched by B3LYP hybrid density functional theory method with 6-311++G (d, p) basis set. The Selectedexperimentalbandswereassignedandcharacterizedonthebasisofthescaledtheoreticalwavenumbersby their potential energy distribution (PED) of the vibrational modes obtained from VEDA 4 program. Finally, the predicted calculation results were applied to simulated FT-IR and FT-Raman spectra of the title compound, which show agreement with the observed spectra. Whereas, it is observed that, the theoretical frequencies are more than the experimental one for O-H stretching vibration modes of the title molecule.

  18. Infrared and Raman spectra, DFT-calculations and spectral assignments of germacyclohexane

    Energy Technology Data Exchange (ETDEWEB)

    Aleksa, V., E-mail: valdemaras.aleksa@ff.vu.lt; Ozerenskis, D.; Pucetaite, M.; Sablinskas, V. [Faculty of Physics, Vilnius University, Sauletekio av. 9, block 3, Vilnius, LT-10222 (Lithuania); Cotter, C.; Guirgis, G. A. [Department of Chemistry and Biochemistry, College of Charleston, Charleston, SC 29424 (United States)

    2015-03-30

    Raman spectra of germacyclohexane in liquid and solid states were recorded and depolarization data obtained. Infrared absorption spectra of the vapor and liquid have been studied. The wavenumbers of the vibrational modes were derived in the harmonic and anharmonic approximation in B3LYP/ccpVTZ calculations. According to the calculations, germacyclohexane exists in the stable chair conformation, whereas a possible twist form should have more than 15 kJ·mol{sup -1} higher enthalpy of formation what makes this conformer experimentally not observable. The 27 A' and 21 A'' fundamentals were assigned on the basis of the calculations and infrared and Raman band intensities, contours of gas phase infrared spectral bands and Raman depolarization measurements. An average discrepancy of ca. 0.77 % was found between the observed and the calculated anharmonic wavenumbers for the 48 modes. Substitution of carbon atom with Ge atom in the cyclohexane ring is reasoning flattening of the ring.

  19. Carbon nanotubes doped with trivalent elements by using back - scattering Raman spectroscopy

    Directory of Open Access Journals (Sweden)

    S. A. Babanejad

    2008-12-01

    Full Text Available  In this paper by using DC arc discharge method and acetylene gas, as the carbon source, and nitrogen, as the carrier gas, canrbon nanotubes, CNTs, doped with trivalent element boron, B, have been produced. The deposited CNTs on the cathod electrod, which have structural doped properties to boron element, have been collected and after purification have been investigated by back-scattering Raman spectroscopy. The results reveal that the high frequency G mode component in CNTs doped with electron acceptor element, B, shift to higher wavenumbers. The low frequency G mode component which can appear at approximately 1540–1570 cm-1 wavenumber region, called BWF mode, is a sign of metallic CNT. In the synthesized doped CNTs due to the presence of boron dopant, D mode has sharp peaks and has relatively high intensity in the Raman spectra .

  20. ALOAD - a code to determine the concentrated forces equivalent with a distributed pressure field for a FEM analysis

    Directory of Open Access Journals (Sweden)

    Nicolae APOSTOLESCU

    2010-12-01

    Full Text Available The main objective of this paper is to describe a code for calculating an equivalent systemof concentrate loads for a FEM analysis. The tables from the Aerodynamic Department containpressure field for a whole bearing surface, and integrated quantities both for the whole surface andfor fixed and mobile part. Usually in a FEM analysis the external loads as concentrated loadsequivalent to the distributed pressure field are introduced. These concentrated forces can also be usedin static tests. Commercial codes provide solutions for this problem, but what we intend to develop isa code adapted to the user’s specific needs.

  1. Stress and displacement analysis of a modern design lathe body by the fi nite element method (FEM

    Directory of Open Access Journals (Sweden)

    R. Staniek

    2012-01-01

    Full Text Available The Finite element method (FEM was used in this study for the analysis of the strain and stress of a turning machine body. The fi nal design decisions were made on the basis of stress and displacement fi eld analysis of various design versions related to the structure of the considered machine tool. The results presented in this paper will be helpful for practical static and dynamic strength evaluation as well as for the appropriate design of machine tools using the FEM.

  2. Raman Spectroscopy of Ocular Tissue

    Science.gov (United States)

    Ermakov, Igor V.; Sharifzadeh, Mohsen; Gellermann, Warner

    The optically transparent nature of the human eye has motivated numerous Raman studies aimed at the non-invasive optical probing of ocular tissue components critical to healthy vision. Investigations include the qualitative and quantitative detection of tissue-specific molecular constituents, compositional changes occurring with development of ocular pathology, and the detection and tracking of ocular drugs and nutritional supplements. Motivated by a better understanding of the molecular mechanisms leading to cataract formation in the aging human lens, a great deal of work has centered on the Raman detection of proteins and water content in the lens. Several protein groups and the hydroxyl response are readily detectable. Changes of protein compositions can be studied in excised noncataractous tissue versus aged tissue preparations as well as in tissue samples with artificially induced cataracts. Most of these studies are carried out in vitro using suitable animal models and conventional Raman techniques. Tissue water content plays an important role in optimum light transmission of the outermost transparent ocular structure, the cornea. Using confocal Raman spectroscopy techniques, it has been possible to non-invasively measure the water to protein ratio as a measure of hydration status and to track drug-induced changes of the hydration levels in the rabbit cornea at various depths. The aqueous humor, normally supplying nutrients to cornea and lens, has an advantageous anterior location for Raman studies. Increasing efforts are pursued to non-invasively detect the presence of glucose and therapeutic concentrations of antibiotic drugs in this medium. In retinal tissue, Raman spectroscopy proves to be an important tool for research into the causes of macular degeneration, the leading cause of irreversible vision disorders and blindness in the elderly. It has been possible to detect the spectral features of advanced glycation and advanced lipooxydation end products in

  3. Three-beam double stimulated Raman scatterings: Cascading configuration

    Science.gov (United States)

    Rao, B. Jayachander; Cho, Minhaeng

    2018-03-01

    Two-beam stimulated Raman scattering (SRS) has been used in diverse label-free spectroscopy and imaging applications of live cells, biological tissues, and functional materials. Recently, we developed a theoretical framework for the three-beam double SRS processes that involve pump, Stokes, and depletion beams, where the pump-Stokes and pump-depletion SRS processes compete with each other. It was shown that the net Stokes gain signal can be suppressed by increasing the depletion beam intensity. The theoretical prediction has been experimentally confirmed recently. In the previous scheme for a selective suppression of one SRS by making it compete with another SRS, the two SRS processes occur in a parallel manner. However, there is another possibility of three-beam double SRS scheme that can be of use to suppress either Raman gain of the Stokes beam or Raman loss of the pump beam by depleting the Stokes photons with yet another SRS process induced by the pair of Stokes and another (second) Stokes beam. This three-beam double SRS process resembles a cascading energy transfer process from the pump beam to the first Stokes beam (SRS-1) and subsequently from the first Stokes beam to the second Stokes beam (SRS-2). Here, the two stimulated Raman gain-loss processes are associated with two different Raman-active vibrational modes of solute molecule. In the present theory, both the radiation and the molecules are treated quantum mechanically. We then show that the cascading-type three-beam double SRS can be described by coupled differential equations for the photon numbers of the pump and Stokes beams. From the approximate solutions as well as exact numerical calculation results for the coupled differential equations, a possibility of efficiently suppressing the stimulated Raman loss of the pump beam by increasing the second Stokes beam intensity is shown and discussed. To further prove a potential use of this scheme for developing a super-resolution SRS microscopy, we

  4. Dark excited states of carotenoid in light harvesting complex probing with femtosecond stimulated Raman spectroscopy

    Directory of Open Access Journals (Sweden)

    Sakai S.

    2013-03-01

    Full Text Available Vibrational dynamics of dark excited states in carotenoids have been investigated using tunable Raman pump pulses. The S1 state has same vibrational dynamics in light-harvesting complex (LH1 and solution. The S* state in LH1 has similar vibrational modes with the triplet state of carotenoid. However, the so-called S* state in solution does not have the modes and is concluded to be different from the S* state in LH1.

  5. Enhancement of the stimulated Raman scattering of benzene, acetonitrile and pyridine

    International Nuclear Information System (INIS)

    Munoz, L; Contreras, W A; Cabanzo, R; Aya-RamIrez, O; Mejia-Ospino, E

    2011-01-01

    In this work we used the second harmonic of Nd:YAG laser to observe stimulated Raman scattering (SRS). SRS was observed on benzene, acetonitrile and pyridine using a single shot laser. The SRS radiation is very intense due their laser characteristics, and it is possible to observe several harmonics of different vibrational modes to each molecule studied here.

  6. High-pressure Raman spectra and DFT calculations of L-tyrosine hydrochloride crystal

    Science.gov (United States)

    dos Santos, C. A. A. S. S.; Carvalho, J. O.; da Silva Filho, J. G.; Rodrigues, J. L.; Lima, R. J. C.; Pinheiro, G. S.; Freire, P. T. C.; Façanha Filho, P. F.

    2018-02-01

    High-pressure Raman spectra of L-tyrosine hydrochloride crystal were obtained from 1.0 atm to 7.0 GPa in the 90-1800 cm-1 spectral region. At atmospheric pressure, the Raman spectrum was obtained in the 50-3200 cm-1 spectral range and the assignment of the normal modes based on density functional theory calculations was provided. We found good correspondence between the calculated and the observed intramolecular geometry parameters. This confirms the correct assignment of the normal modes, since it was crucial to understand the meaning of the changes observed in particular Raman active modes. Here we show that bands associated with internal modes undergo slight modifications during compression. However, an inversion of the relative intensity of bands around 125 cm-1 as well as a change of slope dω/dP from 1.0 to 1.5 GPa was understood as a conformational change involving a torsion of the L-tyrosine molecule. As a consequence, it is possible to conclude that the crystal remained in the same monoclinic structure in the 1 atm-7.0 GPa interval, although conformational change of the molecule was verified. A comparison of our results with other selected studies provided insights about the role of the amino acid side chain on the arrangement of hydrogen bonds. Finally, when the pressure was released back to 1 atm, the Raman spectrum was recovered and no hysteresis was observed.

  7. Inverse Raman effect: applications and detection techniques

    International Nuclear Information System (INIS)

    Hughes, L.J. Jr.

    1980-08-01

    The processes underlying the inverse Raman effect are qualitatively described by comparing it to the more familiar phenomena of conventional and stimulated Raman scattering. An experession is derived for the inverse Raman absorption coefficient, and its relationship to the stimulated Raman gain is obtained. The power requirements of the two fields are examined qualitatively and quantitatively. The assumption that the inverse Raman absorption coefficient is constant over the interaction length is examined. Advantages of the technique are discussed and a brief survey of reported studies is presented

  8. Inverse Raman effect: applications and detection techniques

    Energy Technology Data Exchange (ETDEWEB)

    Hughes, L.J. Jr.

    1980-08-01

    The processes underlying the inverse Raman effect are qualitatively described by comparing it to the more familiar phenomena of conventional and stimulated Raman scattering. An experession is derived for the inverse Raman absorption coefficient, and its relationship to the stimulated Raman gain is obtained. The power requirements of the two fields are examined qualitatively and quantitatively. The assumption that the inverse Raman absorption coefficient is constant over the interaction length is examined. Advantages of the technique are discussed and a brief survey of reported studies is presented.

  9. An Innovative Structural Mode Selection Methodology: Application for the X-33 Launch Vehicle Finite Element Model

    Science.gov (United States)

    Hidalgo, Homero, Jr.

    2000-01-01

    An innovative methodology for determining structural target mode selection and mode selection based on a specific criterion is presented. An effective approach to single out modes which interact with specific locations on a structure has been developed for the X-33 Launch Vehicle Finite Element Model (FEM). We presented Root-Sum-Square (RSS) displacement method computes resultant modal displacement for each mode at selected degrees of freedom (DOF) and sorts to locate modes with highest values. This method was used to determine modes, which most influenced specific locations/points on the X-33 flight vehicle such as avionics control components, aero-surface control actuators, propellant valve and engine points for use in flight control stability analysis and for flight POGO stability analysis. Additionally, the modal RSS method allows for primary or global target vehicle modes to also be identified in an accurate and efficient manner.

  10. Raman Spectroscopic Studies of YBa{sub 2}Cu{sub 3}O{sub 7} Coated Conductors

    Energy Technology Data Exchange (ETDEWEB)

    Choi, Mi Kyeung; Mnh, Nguyen Van; Bae, J. S.; Jo, William; Yang, In Sang [Ewha Womans University, Seoul (Korea, Republic of); Ko, Rock Kil; Ha, Hong Soo; Park, Chan [Korea Electrotecnology Research Institute, Changwon (Korea, Republic of)

    2005-04-15

    We present results of Raman spectroscopic studies of superconducting YBa{sub 2}Cu{sub 3}O{sub 7} (YBCO) coated conductors. Raman scattering is used to characterize optical phonon modes, oxygen content, c-axis misalignment, and second phases of the YBCO coated conductors at a micro scale. A two-dimensional mapping of Raman spectra with transport properties has been performed to elucidate the effect of local propertied on current path and superconducting phase. The information taken from the local measurement will be useful for optimizing the process condition.

  11. The Raman fingerprint of plutonium dioxide: Some example applications for the detection of PuO2 in host matrices

    Science.gov (United States)

    Manara, D.; Naji, M.; Mastromarino, S.; Elorrieta, J. M.; Magnani, N.; Martel, L.; Colle, J.-Y.

    2018-02-01

    Some example applications are presented, in which the peculiar Raman fingerprint of PuO2 can be used for the detection of crystalline Pu4+ with cubic symmetry in an oxide environment in various host materials, like mixed oxide fuels, inert matrices and corium sub-systems. The PuO2 Raman fingerprint was previously observed to consist of one main T2g vibrational mode at 478 cm-1 and two crystal electric field transition lines at 2130 cm-1 and 2610 cm-1. This particular use of Raman spectroscopy is promising for applications in nuclear waste management, safety and safeguard.

  12. Raman Spectroscopy of Irradiated Normoxic Polymethacrylic Acid Gel Dosimeter

    Energy Technology Data Exchange (ETDEWEB)

    Bong, Ji Hye; Kwon, Soo Il; Cho, Yu Ra; Park, Chae Hee; Park, Hyung Wook [Kyonggi University, Suwon (Korea, Republic of); Choi, Kyu Seok; Yu, Soo Chang [Kunsan National University, Gunsan (Korea, Republic of)

    2011-02-15

    A quantitative analysis of the decreasing rate of the monomer and increasing rate of the polymerization was made by monitoring radiation level increments using Raman spectroscopy within the therapeutic radiation range for a normoxic polymethacrylic acid gel dosimeter. The gel dosimeter was synthesized by stirring materials such as gelatin, distilled water, methacrylic acid, hydroquinone and tetrakis phosphonium chloride at 50 .deg. C, and the synthesized gel was contained in a 10- mm diameter and 32-mm high vial to conduct measurement. 24 hours after gel synthesis, it was irradiated from 0 Gy to 20 Gy by 2 Gy using a Co-60 radiotherapy unit. With use of the Cryo FE-SEM, structural changes in the 0 Gy and 10 Gy gel dosimeters were investigated. The Raman spectra were acquired using 532-nm laser as the excitation source. In accordance with fitting the changes in C-COOH stretching (801 cm{sup -1}), C=C stretching (1639 cm{sup -1}) and vinyl CH{sub 2} stretching (3114 cm{sup -1}) vibrational modes for monomer and CH{sub 2} bending vibrational mode (1451 cm{sup -1}) for polymer, sensitive parameter S for each mode was calculated. The values of S for monomer bands and polymer band were ranged in 6.0 ± 2.6 Gy and 7.2 ± 2.3 Gy, respectively, which shows a relatively good conformity of the decreasing rate of monomer and the increasing rate of polymerization within the range of error.

  13. Raman scattering and band-gap variations of Al-doped ZnO nanoparticles synthesized by a chemical colloid process

    International Nuclear Information System (INIS)

    Lo, Shih-Shou; Huang, Dison; Tu, Chun Hsiang; Hou, Chia-Hung; Chen, Chii-Chang

    2009-01-01

    This study synthesizes Al-doped ZnO (AZO) nanoparticles using a chemical colloid process. Raman scattering analysis shows that Al doping increases the lattice defects and induces Raman vibration modes of 651 cm -1 . The Raman shift of the active mode E 2 (high) of AZO nanoparticles shows the presence and increase in the stress in nanoparticles when the Al dopant concentration increases. Room-temperature photoluminescence (RT-PL) spectra of synthesized AZO nanoparticles exhibit strong UV emissions near the band edges. The RT-PL peak shifts to a higher photon energy region as the Al concentration increases, indicating a broadening of the band gap.

  14. Induction Machine with Improved Operating Performances for Electric Trucks. A FEM-Based Analysis

    Directory of Open Access Journals (Sweden)

    MUNTEANU, A.

    2010-05-01

    Full Text Available The paper presents a study concerning the performance developed by induction motors destined for motorization of heavy electric vehicles such as trucks. Taking into consideration the imposed restrictions, one presents, in a comparative manner, the main geometrical parameters which come of the classical design algorithms. A special attention is dedicated to the winding design, since it has to ensure two synchronous speeds corresponding to 16 and 8 poles, respectively. Moreover, the influence of the rotor slots shape for the improvement of the start-up is analyzed. Finally, a FEM-based study (approach based on finite element method is performed to put in view specific torque and slip values such as rated, start-up and pull-out ones.

  15. Nodal DG-FEM solution of high-order Boussinesq-type equations

    DEFF Research Database (Denmark)

    Engsig-Karup, Allan Peter; Hesthaven, Jan S.; Bingham, Harry B.

    2006-01-01

    We present a discontinuous Galerkin finite element method (DG-FEM) solution to a set of high-order Boussinesq-type equations for modelling highly nonlinear and dispersive water waves in one and two horizontal dimensions. The continuous equations are discretized using nodal polynomial basis...... functions of arbitrary order in space on each element of an unstructured computational domain. A fourth order explicit Runge-Kutta scheme is used to advance the solution in time. Methods for introducing artificial damping to control mild nonlinear instabilities are also discussed. The accuracy...... and convergence of the model with both h (grid size) and p (order) refinement are verified for the linearized equations, and calculations are provided for two nonlinear test cases in one horizontal dimension: harmonic generation over a submerged bar; and reflection of a steep solitary wave from a vertical wall...

  16. Development of seismic analysis model for HTGR core on commercial FEM code

    International Nuclear Information System (INIS)

    Tsuji, Nobumasa; Ohashi, Kazutaka

    2015-01-01

    The aftermath of the Great East Japan Earthquake prods to revise the design basis earthquake intensity severely. In aseismic design of block-type HTGR, the securement of structural integrity of core blocks and other structures which are made of graphite become more important. For the aseismic design of block-type HTGR, it is necessary to predict the motion of core blocks which are collided with adjacent blocks. Some seismic analysis codes have been developed in 1970s, but these codes are special purpose-built codes and have poor collaboration with other structural analysis code. We develop the vertical 2 dimensional analytical model on multi-purpose commercial FEM code, which take into account the multiple impacts and friction between block interfaces and rocking motion on contact with dowel pins of the HTGR core by using contact elements. This model is verified by comparison with the experimental results of 12 column vertical slice vibration test. (author)

  17. FEM simulation study on relationship of interfacial morphology and residual stress in TBCs

    Energy Technology Data Exchange (ETDEWEB)

    Liqiang Chen; Shengkai Gong; Huibin Xu [School of Materials Science and Engineering, Beihang Univ., Beijing, BJ (China)

    2005-07-01

    It is generally believed that the failure of TBCs is attributed to the spallation occurred in the ceramic coat. The spallation is closed linked with sinuate morphology factors, including its amplitude and period, at the TGO/bond coat interface. In this work, dependence of the residual stress distribution on the sinuate morphology in the TBCs has been studied by means of finite element method (FEM) simulation for isothermally annealed specimens. The simulation results indicated that the maximum value of residual stress existed inside the TGO layer. It was also found that the maximum residual stress occurred at different points, near the TGO/bond coat interface at the peak of the sinuate interface, while near the TGO/ceramic coat interface at the valley, respectively. And the maximum residual stress increased with increasing the ratio of the amplitude to period in the sine morphology, which has been proved by the thermal cycle experimental results. (orig.)

  18. FEM BASED PARAMETRIC DESIGN STUDY OF TIRE PROFILE USING DEDICATED CAD MODEL AND TRANSLATION CODE

    Directory of Open Access Journals (Sweden)

    Nikola Korunović

    2014-12-01

    Full Text Available In this paper a finite element method (FEM based parametric design study of the tire profile shape and belt width is presented. One of the main obstacles that similar studies have faced is how to change the finite element mesh after a modification of the tire geometry is performed. In order to overcome this problem, a new approach is proposed. It implies automatic update of the finite elements mesh, which follows the change of geometric design parameters on a dedicated CAD model. The mesh update is facilitated by an originally developed mapping and translation code. In this way, the performance of a large number of geometrically different tire design variations may be analyzed in a very short time. Although a pilot one, the presented study has also led to the improvement of the existing tire design.

  19. FEM analysis of an single stator dual PM rotors axial synchronous machine

    Science.gov (United States)

    Tutelea, L. N.; Deaconu, S. I.; Popa, G. N.

    2017-01-01

    The actual e - continuously variable transmission (e-CVT) solution for the parallel Hybrid Electric Vehicle (HEV) requires two electric machines, two inverters, and a planetary gear. A distinct electric generator and a propulsion electric motor, both with full power converters, are typical for a series HEV. In an effort to simplify the planetary-geared e-CVT for the parallel HEV or the series HEV we hereby propose to replace the basically two electric machines and their two power converters by a single, axial-air-gap, electric machine central stator, fed from a single PWM converter with dual frequency voltage output and two independent PM rotors. The proposed topologies, the magneto-motive force analysis and quasi 3D-FEM analysis are the core of the paper.

  20. A continuum based fem model for friction stir welding-model development

    Energy Technology Data Exchange (ETDEWEB)

    Buffa, G. [Ohio State University, Department of Industrial, Welding and Systems Engineering, 1971 Neil Avenue, 210 Baker Systems, Columbus, OH 43210 (United States) and Dipartimento di Tecnologia Meccanica, Produzione e Ingegneria Gestionale, Universita di Palermo, Viale delle Scienze, 90128 Palermo (Italy)]. E-mail: g.buffa@dtpm.unipa.it; Hua, J. [Ohio State University, Department of Industrial, Welding and Systems Engineering, 1971 Neil Avenue, 210 Baker Systems, Columbus, OH 43210 (United States)]. E-mail: hua.14@osu.edu; Shivpuri, R. [Ohio State University, Department of Industrial, Welding and Systems Engineering, 1971 Neil Avenue, 210 Baker Systems, Columbus, OH 43210 (United States)]. E-mail: shivpuri.1@osu.edu; Fratini, L. [Dipartimento di Tecnologia Meccanica, Produzione e Ingegneria Gestionale, Universita di Palermo, Viale delle Scienze, 90128 Palermo (Italy)]. E-mail: abaqus@dtpm.unipa.it

    2006-03-15

    Although friction stir welding (FSW) has been successfully used to join materials that are difficult-to-weld or unweldeable by fusion welding methods, it is still in its early development stage and, therefore, a scientific knowledge based predictive model is of significant help for thorough understanding of FSW process. In this paper, a continuum based FEM model for friction stir welding process is proposed, that is 3D Lagrangian implicit, coupled, rigid-viscoplastic. This model is calibrated by comparing with experimental results of force and temperature distribution, then is used to investigate the distribution of temperature and strain in heat affect zone and the weld nugget. The model correctly predicts the non-symmetric nature of FSW process, and the relationships between the tool forces and the variation in the process parameters. It is found that the effective strain distribution is non-symmetric about the weld line while the temperature profile is almost symmetric in the weld zone.

  1. 3D-FEM Analysis on Geogrid Reinforced Flexible Pavement Roads

    Science.gov (United States)

    Calvarano, Lidia Sarah; Palamara, Rocco; Leonardi, Giovanni; Moraci, Nicola

    2017-12-01

    Nowadays, the need to increase pavement service life, guarantee high performance, reduce service and maintenance costs has been turned a greater attention on the use of reinforcements. This paper presents findings of a numerical investigation on geogrid reinforced flexible pavement roads, under wheel traffic loads, using a three-dimensional Finite Element Method (FEM). The results obtained show the effectiveness of glass fibre grids as reinforcement which, with appropriate design and correct installation, by improving interface shear resistance, can be used to expand the performance of flexible pavements in different ways: by increasing the road service life providing a relevant contribution against superficial rutting or by decreasing the construction costs due to the reduction in the reinforced HMA layer thickness and thus of mineral aggregate required for its construction.

  2. Body Composition Assessment in Axial CT Images Using FEM-Based Automatic Segmentation of Skeletal Muscle.

    Science.gov (United States)

    Popuri, Karteek; Cobzas, Dana; Esfandiari, Nina; Baracos, Vickie; Jägersand, Martin

    2016-02-01

    The proportions of muscle and fat tissues in the human body, referred to as body composition is a vital measurement for cancer patients. Body composition has been recently linked to patient survival and the onset/recurrence of several types of cancers in numerous cancer research studies. This paper introduces a fully automatic framework for the segmentation of muscle and fat tissues from CT images to estimate body composition. We developed a novel finite element method (FEM) deformable model that incorporates a priori shape information via a statistical deformation model (SDM) within the template-based segmentation framework. The proposed method was validated on 1000 abdominal and 530 thoracic CT images and we obtained very good segmentation results with Jaccard scores in excess of 90% for both the muscle and fat regions.

  3. Mass conservation for instantaneous sources in FEM3 simulations of material dispersion

    International Nuclear Information System (INIS)

    Rodean, H.C.

    1987-11-01

    This report presents the results of a systematic study in which it is shown that the numerical integration errors in determining material mass content are negligible; the material phase-change model by itself is not a cause of material mass variation; and a linear relation between fractional mass change and fractional density change at the source center for given mesh and source geometries exists over a range of values from 10 -5 to 10 -1 . This suggests that the omission of the ∂ rho/∂t term from the mass conservation equation is the cause of the observed non-conservation of mass by FEM3. It is shown that these mass variations can be minimized by minimizing the initial density gradients in the source region. 5 refs., 18 figs., 4 tabs

  4. An Experimental Simulation to Validate FEM to Predict Transverse Young’s Modulus of FRP Composites

    Directory of Open Access Journals (Sweden)

    V. S. Sai

    2013-01-01

    Full Text Available Finite element method finds application in the analysis of FRP composites due to its versatility in getting the solution for complex cases which are not possible by exact classical analytical approaches. The finite element result is questionable unless it is obtained from converged mesh and properly validated. In the present work specimens are prepared with metallic materials so that the arrangement of fibers is close to hexagonal packing in a matrix as similar arrangement in case of FRP is complex due to the size of fibers. Transverse Young’s moduli of these specimens are determined experimentally. Equivalent FE models are designed and corresponding transverse Young’s moduli are compared with the experimental results. It is observed that the FE values are in good agreement with the experimental results, thus validating FEM for predicting transverse modulus of FRP composites.

  5. FEM simulation of friction testing method based on combined forward rod-backward can extrusion

    DEFF Research Database (Denmark)

    Nakamura, T; Bay, Niels; Zhang, Z. L

    1997-01-01

    A new friction testing method by combined forward rod-backward can extrusion is proposed in order to evaluate frictional characteristics of lubricants in forging processes. By this method the friction coefficient mu and the friction factor m can be estimated along the container wall and the conical...... curves are obtained by rigid-plastic FEM simulations in a combined forward rod-backward can extrusion process for a reduction in area R-b = 25, 50 and 70 percent in the backward can extrusion. It is confirmed that the friction factor m(p) on the punch nose in the backward cart extrusion has almost...... in a mechanical press with aluminium alloy A6061 as the workpiece material and different kinds of lubricants. They confirm the analysis resulting in reasonable values for the friction coefficient and the friction factor....

  6. Thermal modal analysis of novel non-pneumatic mechanical elastic wheel based on FEM and EMA

    Science.gov (United States)

    Zhao, Youqun; Zhu, Mingmin; Lin, Fen; Xiao, Zhen; Li, Haiqing; Deng, Yaoji

    2018-01-01

    A combination of Finite Element Method (FEM) and Experiment Modal Analysis (EMA) have been employed here to characterize the structural dynamic response of mechanical elastic wheel (ME-Wheel) operating under a specific thermal environment. The influence of high thermal condition on the structural dynamic response of ME-Wheel is investigated. The obtained results indicate that the EMA results are in accordance with those obtained using the proposed Finite Element (FE) model, indicting the high reliability of this FE model applied in analyzing the modal of ME-Wheel working under practical thermal environment. It demonstrates that the structural dynamic response of ME-Wheel operating under a specific thermal condition can be predicted and evaluated using the proposed analysis method, which is beneficial for the dynamic optimization design of the wheel structure to avoid tire temperature related vibration failure and improve safety of tire.

  7. FEM Analysis of Brushless DC Servomotor with Fractional Number of Slots per Pole

    Directory of Open Access Journals (Sweden)

    BALUTA, G.

    2014-02-01

    Full Text Available The authors present in this paper the analysis with Finite Element Method (FEM of the magnetic circuit for a Brushless DC servomotor with fractional number of slots/pole (9 slots and 10 poles. For this purpose, FEMM 4.2 software package was used for the analysis. To obtain the waveforms of Back-ElectroMotive Forces (BEMFs, electromagnetic and cogging torque for servomotor a program in LUA scripting language (integrated into interactive shell of FEMM4.2 has been created. A comparation with a structure with integer number of slots/pole (18 slots and 6 poles was also realized. The analysis results prove that the structure chosen is an optimal solution: sinusoidal waveforms of BEMFs, improved electromagnetic torque and reduced cogging torque. Therefore, the operating characteristics of the servomotor with 9/10 slots/poles manufactured by Sistem Euroteh Company and included in an integrated electrical drives system are presented in this paper.

  8. Optimization of a Centrifugal Boiler Circulating Pump's Casing Based on CFD and FEM Analyses

    Directory of Open Access Journals (Sweden)

    Zhigang Zuo

    2014-04-01

    Full Text Available It is important to evaluate the economic efficiency of boiler circulating pumps in manufacturing process from the manufacturers' point of view. The possibility of optimizing the pump casing with respect to structural pressure integrity and hydraulic performance was discussed. CFD analyses of pump models with different pump casing sizes were firstly carried out for the hydraulic performance evaluation. The effects of the working temperature and the sealing ring on the hydraulic efficiency were discussed. A model with casing diameter of 0.875D40 was selected for further analyses. FEM analyses were then carried out on different combinations of casing sizes, casing wall thickness, and materials, to evaluate its safety related to pressure integrity, with respect to both static and fatigue strength analyses. Two models with forging and cast materials were selected as final results.

  9. Application of FEM analytical method for hydrogen migration behaviour in Zirconium alloys

    Energy Technology Data Exchange (ETDEWEB)

    Arioka, K; Ohta, H [Takasago Research and Development Center, Mitsubishi Heavy Industries Ltd, Hyogo-ken (Japan)

    1997-02-01

    It is well recognized that the hydriding behaviours of Zirconium alloys are very significant problems as a safety issues. Also, it is well known that the diffusion of hydrogen in Zirconium alloys are affected not only by concentration but also temperature gradient. But in actual component, especially heat transfer tube such as fuel rod, we can not avoid the temperature gradient in some degree. So, it is very useful to develop the computer code which can analyze the hydrogen diffusion and precipitation behaviours under temperature gradient as a function of the structure of fuel rod. For this objective, we have developed the computer code for hydrogen migration behaviour using FEM analytical methods. So, following items are presented and discussed. Analytical method and conditions; correlation between the computed and test results; application to designing studies. (author). 8 refs, 4 figs, 2 tabs.

  10. Evaluation of Package Stress during Temperature Cycling using Metal Deformation Measurement and FEM Simulation

    International Nuclear Information System (INIS)

    Hoeglauer, J.; Bohm, C.; Otremba, R.; Maerz, J.; Nelle, P.; Stecher, M.; Alpern, P.

    2006-01-01

    Plastic encapsulated devices that are exposed to Temperature Cycling (TC) tests undergo an excessive mechanical stress due to different Coefficients of Thermal Expansion (CTE) of the various materials used in the system. Especially in the corners of the die, passivation cracks and shifted metal lines can be observed, which demonstrates an increasing mechanical stress from chip center to the corners of the die. This effect has been known for a long time. This paper presents a simple measurement technique to quantify the mechanical shear stress at the chip-Mold Compound (MC) interface by measuring the deformation of a periodical metal structure. Based on this deformation measurement, we evaluated the stress distribution within the package, and the influence of different parameters such as number of cycles and chip size. Furthermore, these experimental results were compared with FEM simulation, and showed good agreement but could not account in all cases for the total amount of observed shift

  11. A continuum based fem model for friction stir welding-model development

    International Nuclear Information System (INIS)

    Buffa, G.; Hua, J.; Shivpuri, R.; Fratini, L.

    2006-01-01

    Although friction stir welding (FSW) has been successfully used to join materials that are difficult-to-weld or unweldeable by fusion welding methods, it is still in its early development stage and, therefore, a scientific knowledge based predictive model is of significant help for thorough understanding of FSW process. In this paper, a continuum based FEM model for friction stir welding process is proposed, that is 3D Lagrangian implicit, coupled, rigid-viscoplastic. This model is calibrated by comparing with experimental results of force and temperature distribution, then is used to investigate the distribution of temperature and strain in heat affect zone and the weld nugget. The model correctly predicts the non-symmetric nature of FSW process, and the relationships between the tool forces and the variation in the process parameters. It is found that the effective strain distribution is non-symmetric about the weld line while the temperature profile is almost symmetric in the weld zone

  12. Spin modes

    International Nuclear Information System (INIS)

    Gaarde, C.

    1985-01-01

    An analysis of spectra of (p,n) reactions showed that they were very selective in exciting spin modes. Charge exchange reactions at intermediate energies give important new understanding of the M1-type of excitations and of the spin structure of continuum p spectra in general. In this paper, the author discusses three charge exchange reactions: (p,n); ( 3 H,t); and (d,2p) at several targets. Low-lying states and the Δ region are discussed separately. Finally, the charge exchange reaction with heavy ion beams is briefly discussed. (G.J.P./Auth.)

  13. Thermodynamics of Silica Dissolution From In-situ Raman +Spectroscopy

    Science.gov (United States)

    Davis, M. K.; Fumagalli, P.; Stixrude, L. P.

    2001-12-01

    Solubilities of cations, such as silicon, in water strongly effect both the physical and thermodynamical properties of supercritical metamorphic fluids. Modeling the thermodynamics of fluid-rock interactions requires therefore a profound understanding of cation dissolution and aqueous speciation. In-situ Raman experiments of the silica-water system were performed in an externally heated Bassett-type diamond-anvil cell at the Department of Geological Sciences, University of Michigan. Natural quartz samples (from Owl Creek Mountains, Wyoming) were loaded in the sample chamber with de-ionized or spectrographic water. All experiments used doubly polished rhenium gaskets with a thickness of 200 μ m, diameter of 1.0 mm, and a 500 μ m drillhole for the sample chamber. Temperature was measured using K-type thermocouples wrapped around both the upper and lower diamond anvils. Pressures are obtained on the basis of the shift of the 464 cm-1 Raman mode of quartz. In-situ Raman spectra were collected from 250-1200 cm-1, focusing on the vibrational modes of aqueous silica species at temperatures up to 700 ° C and pressures up to 14 kbar. We observed Si-O stretching modes attributable to dimer (H6Si2O7, 965 cm-1) and monomer (H4SiO4, 771 cm-1) aqueous silica species. The relative intensities of these two bands as a function of isochoric heating place constraints on the energetics of the polymerization reaction, if we assume that the intensity ratio is linearly related to concentration ratio. We have been able to perform experiments along two different isochores (0.9 and 0.75 g/cm3, respectively) from which we are able to derive the enthalpy of reaction.

  14. A Validation of FEM3MP with Joint Urban 2003 Data

    Energy Technology Data Exchange (ETDEWEB)

    Chan, S T; Leach, M J

    2006-08-29

    Under the sponsorship of the U.S. DOE and DHS, we have recently developed a computational fluid dynamics (CFD) model for simulating airflow and dispersion of chemical/biological agents released in urban areas. Our model, FEM3MP, is based on solving the three-dimensional, time-dependent Navier-Stokes equations with appropriate physics submodels on massively parallel computer platforms. It employs finite-element discretization for effective treatment of complex geometries and a semi-implicit projection scheme for efficient time-integration. A simplified CFD approach, using both explicitly resolved and virtual buildings, was implemented to further improve the model's efficiency. Predictions from our model are continuously being verified against measured data from wind tunnel and field studies. Herein our model is further evaluated using observed data from IOPs (intensive operation periods) 3 and 9 of the Joint Urban 2003 field study conducted in Oklahoma City, Oklahoma, in July 2003. Our model predictions of wind and concentration fields in the near and intermediate regions, as well as profiles of wind speed, wind direction, friction velocity, and turbulent kinetic energy (TKE) in the urban wake region, are generally consistent with and compared reasonably well with field observations. In addition, our model was able to predict the observed split plume of IOP 3 and the end vortices along Park Avenue in IOP 9. The dispersion results and TKE profiles at the crane station indicate the effects of convective mixing are relatively important for the daytime release of IOP 3 but the stable effects are relatively unimportant for the nighttime release of IOP 9. Results of this study also suggest that the simplified CFD approach implemented in FEM3MP can be a cost-effective tool for simulating urban dispersion problems.

  15. Pregnancy and contraceptive use among women participating in the FEM-PrEP trial.

    Science.gov (United States)

    Callahan, Rebecca; Nanda, Kavita; Kapiga, Saidi; Malahleha, Mookho; Mandala, Justin; Ogada, Teresa; Van Damme, Lut; Taylor, Douglas

    2015-02-01

    Pregnancy among study participants remains a challenge for trials of new HIV prevention agents despite promotion and provision of contraception. We evaluated contraceptive use, pregnancy incidence, and study drug adherence by contraceptive method among women enrolled in the FEM-PrEP trial of once-daily oral tenofovir disoproxil fumarate and emtricitabine (TDF-FTC) for HIV prevention. We required women to be using effective non-barrier contraception at enrollment. At each monthly follow-up visit, women were counseled on contraceptive use and tested for pregnancy. TDF-FTC adherence was determined by measuring plasma drug concentrations at 4-week intervals. We used Cox proportional hazards models to assess factors associated with incident pregnancy and multivariate logistic regression to examine the relationship between contraceptive method used at enrollment and TDF-FTC adherence. More than half of women were not using effective contraception before enrollment. Ninety-eight percent of these women adopted either injectable (55%) or oral (43%) contraceptives. The overall pregnancy rate was 9.6 per 100 woman-years. Among injectable users and new users of combined oral contraceptives (COCs), the rates were 1.6 and 35.1, respectively. New users of injectables had significantly greater odds of adhering to TDF-FTC than new COC users [odds ratio (95% confidence interval): 4.4 (1.7 to 11.6), P = 0.002], existing COC users [3.1 (1.3 to 7.3), P = 0.01], and existing injectable users [2.4 (1.1 to 5.6), P = 0.04]. Women using COCs during FEM-PrEP, particularly new adopters, were more likely to become pregnant and less likely to adhere to study product than injectable users. HIV prevention trials should consider requiring long-acting methods, including injectables, for study participation.

  16. Numerical survey of pressure wave propagation around and inside an underground cavity with high order FEM

    Science.gov (United States)

    Esterhazy, Sofi; Schneider, Felix; Schöberl, Joachim; Perugia, Ilaria; Bokelmann, Götz

    2016-04-01

    The research on purely numerical methods for modeling seismic waves has been more and more intensified over last decades. This development is mainly driven by the fact that on the one hand for subsurface models of interest in exploration and global seismology exact analytic solutions do not exist, but, on the other hand, retrieving full seismic waveforms is important to get insides into spectral characteristics and for the interpretation of seismic phases and amplitudes. Furthermore, the computational potential has dramatically increased in the recent past such that it became worthwhile to perform computations for large-scale problems as those arising in the field of computational seismology. Algorithms based on the Finite Element Method (FEM) are becoming increasingly popular for the propagation of acoustic and elastic waves in geophysical models as they provide more geometrical flexibility in terms of complexity as well as heterogeneity of the materials. In particular, we want to demonstrate the benefit of high-order FEMs as they also provide a better control on the accuracy. Our computations are done with the parallel Finite Element Library NGSOLVE ontop of the automatic 2D/3D mesh generator NETGEN (http://sourceforge.net/projects/ngsolve/). Further we are interested in the generation of synthetic seismograms including direct, refracted and converted waves in correlation to the presence of an underground cavity and the detailed simulation of the comprehensive wave field inside and around such a cavity that would have been created by a nuclear explosion. The motivation of this application comes from the need to find evidence of a nuclear test as they are forbidden by the Comprehensive Nuclear-Test Ban Treaty (CTBT). With this approach it is possible for us to investigate the wave field over a large bandwidth of wave numbers. This again will help to provide a better understanding on the characteristic signatures of an underground cavity, improve the protocols for

  17. ULTRAVIOLET RAMAN SPECTRAL SIGNATURE ACQUISITION: UV RAMAN SPECTRAL FINGERPRINTS.

    Energy Technology Data Exchange (ETDEWEB)

    SEDLACEK,III, A.J.FINFROCK,C.

    2002-09-01

    As a member of the science-support part of the ITT-lead LISA development program, BNL is tasked with the acquisition of UV Raman spectral fingerprints and associated scattering cross-sections for those chemicals-of-interest to the program's sponsor. In support of this role, the present report contains the first installment of UV Raman spectral fingerprint data on the initial subset of chemicals. Because of the unique nature associated with the acquisition of spectral fingerprints for use in spectral pattern matching algorithms (i.e., CLS, PLS, ANN) great care has been undertaken to maximize the signal-to-noise and to minimize unnecessary spectral subtractions, in an effort to provide the highest quality spectral fingerprints. This report is divided into 4 sections. The first is an Experimental section that outlines how the Raman spectra are performed. This is then followed by a section on Sample Handling. Following this, the spectral fingerprints are presented in the Results section where the data reduction process is outlined. Finally, a Photographs section is included.

  18. Microtearing modes

    International Nuclear Information System (INIS)

    Garbet, X.; Mourgues, F.; Samain, A.; Zou, X.

    1990-01-01

    A serious degradation of confinement with additional heating is commonly observed on most tokamaks. The microtearing modes could provide an explanation for this experimental fact. They are driven linearly unstable by diamagnetism in collisional regimes, but it may be shown that the collisions in non linear regimes provide a small diffusion coefficient which can be only significant at the plasme edge. In the bulk of the plasma, the microtearing turbulence could play a basic role if it is unstable in the collisionless regime. While it is linearly stable without collisions, it could be driven unstable in realistic regimes by the radial diffusion it induces. To study this effect, we have used a model where the non linear action of the modes on a given helicity component is represented by a diffusion operator. They are found unstable for reasonable β p =2μ o nT/B 2 p , with a special radial profile of the potential vector A. The problem arises the validity of this model where non linearities in the trajectories behaviour are replaced by the diffusion which broadens resonances. To test this procedure, we calculate the actual electron distribution function when it is determined by the ergodicity of the field lines. We compute the correlations of the distribution function with the magnetic perturbation and compare them with the analytical expressions derived from the resonance broadening model. (author) 3 refs., 2 figs

  19. Raman scattering of quasimodes in ZnO

    International Nuclear Information System (INIS)

    Alarcon-Llado, E; Cusco, R; Artus, L; Jimenez, J; Wang, B; Callahan, M

    2008-01-01

    The angular dependence of the optical phonons of high-quality bulk ZnO has been systematically studied by means of Raman scattering. We report the observation of quasi-TO and quasi-LO modes for propagation directions covering the whole a-c mixing plane using a beveled ZnO single crystal sample. Scattering experiments performed in two different configuration geometries indicate that birefringence effects are not relevant for the phonon analysis in this material. The observed angular dependence of the quasimode frequencies is in good agreement with Loudon's model.

  20. Double resonance Raman effects in InN nanowires

    Energy Technology Data Exchange (ETDEWEB)

    Domenech-Amador, N.; Cusco, R.; Artus, L. [Institut Jaume Almera, Consell Superior d' Investigacions Cientifiques (CSIC), Lluis Sole i Sabaris s.n., Barcelona, Catalonia (Spain); Calarco, R. [Institute of Bio- and Nanosystems, Research Center Juelich GmbH, Juelich (Germany); Paul-Drude-Institut fuer Festkoerperelektronik, Berlin (Germany); Yamaguchi, T.; Nanishi, Y. [Faculty of Science and Engineering, Ritsumeikan University, Noji-Higashi, Kusatsu, Shiga 525-8577 (Japan)

    2012-04-15

    We study the excitation wavelength dependence of the Raman spectra of InN nanowires. The E{sub 1}(LO) phonon mode, which is detected in backscattering configuration because of light entering through lateral faces, exhibits an upward frequency shift that can be explained by Martin's double resonance. The E{sub 1} (LO)/E{sub 2}{sup h} intensity ratio increases with the excitation wavelength more rapidly than the A{sub 1}(LO)/E{sub 2}{sup h} ratio measured in InN thin films. (copyright 2012 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  1. The Influence of Pressure Distribution on the Maximum Values of Stress in FEM Analysis of Plain Bearings

    Directory of Open Access Journals (Sweden)

    Vasile Cojocaru

    2016-12-01

    Full Text Available Several methods can be used in the FEM studies to apply the loads on a plain bearing. The paper presents a comparative analysis of maximum stress obtained for three loading scenarios: resultant force applied on the shaft – bearing assembly, variable pressure with sinusoidal distribution applied on the bearing surface, variable pressure with parabolic distribution applied on the bearing surface.

  2. Effect of the drift gap between the undulator sections on the operation of the Fusion-FEM

    NARCIS (Netherlands)

    van der Geer, C. A. J.; Militsyn, B. L.; Bongers, W. A.; Bratman, V. L.; Denisov, G. G.; Manintveld, P.; Savilov, A. V.; Varfolomeev, A. A.; Verhoeven, A. G. A.; Urbanus, W. H.

    2000-01-01

    The 'Fusion-FEM' is a free electron MASER based on an electrostatic accelerator. An electron beam of 12 A, 1.35-2 MeV is injected into a step-tapered undulator to generate 1 MW of radiation in the range 130-250 GHz. The undulator is built from two sections with different field strength

  3. Elasto-viscoplastic FEM simulations of the aluminium flow in the bearing area for extrusion of thin-walled sections

    NARCIS (Netherlands)

    Lof, J.

    2001-01-01

    The use of the finite element method (FEM) is getting increasingly important in the understanding of processes that occur during aluminium extrusion. The bearing area is one of the most difficult areas to model in a numerical simulation. To investigate the phenomena that occur in the bearing,

  4. Ps laser pulse induced stimulated Raman scattering of ammonium nitrate dissolved in water

    Science.gov (United States)

    Kumar, V. Rakesh; Kiran, P. Prem

    2018-04-01

    An intense picosecond laser pulse focused into a liquid medium generates a shock wave in the focal region. This shock wave while propagating into the medium varies the pressure and temperature of the liquid locally leading to the appearance of novel phases which are manifested by the appearance of Raman peaks. We present the phase changes of ammonium nitrate (AN) dissolved in water by studying the forward and backward stimulated Raman Scattering (FSRS and BSRS) signals due to propagation of 30 ps laser pulse induced shockwaves. The dominant peak corresponding to the NO3- symmetric stretching mode is observed with a Raman shift of 1045 cm-1 which represents phase IV of AN with an orthogonal crystalline structure. Apart from this peak, the dominant mode of liquid phase of water with a Raman shift of 3400 cm-1 and an ice VII peak at a Raman shift of 3050 cm-1 confirming the pressure of 10 GPa is observed. The effect of the concentration and input energy on the appearance of the phases will be presented.

  5. Flexible Microsphere-Embedded Film for Microsphere-Enhanced Raman Spectroscopy.

    Science.gov (United States)

    Xing, Cheng; Yan, Yinzhou; Feng, Chao; Xu, Jiayu; Dong, Peng; Guan, Wei; Zeng, Yong; Zhao, Yan; Jiang, Yijian

    2017-09-27

    Dielectric microspheres with extraordinary microscale optical properties, such as photonic nanojets, optical whispering-gallery modes (WGMs), and directional antennas, have drawn interest in many research fields. Microsphere-enhanced Raman spectroscopy (MERS) is an alternative approach for enhanced Raman detection by dielectric microstructures. Unfortunately, fabrication of microsphere monolayer arrays is the major challenge of MERS for practical applications on various specimen surfaces. Here we report a microsphere-embedded film (MF) by immersing a highly refractive microsphere monolayer array in the poly(dimethylsiloxane) (PDMS) film as a flexible MERS sensing platform for one- to three-dimensional (1D to 3D) specimen surfaces. The directional antennas and wave-guided whispering-gallery modes (WG-WGMs) contribute to the majority of Raman enhancement by the MFs. Moreover, the MF can be coupled with surface-enhanced Raman spectroscopy (SERS) to provide an extra >10-fold enhancement. The limit of detection is therefore improved for sensing of crystal violet (CV) and Sudan I molecules in aqueous solutions at concentrations down to 10 -7 M. A hybrid dual-layer microsphere enhancer, constructed by depositing a MF onto a microsphere monolayer array, is also demonstrated, wherein the WG-WGMs become dominant and boost the enhancement ratio >50-fold. The present work opens up new opportunities for design of cost-effective and flexible MERS sensing platforms as individual or associated techniques toward practical applications in ultrasensitive Raman detection.

  6. Simulations of the polarisation-dependent Raman intensity of β-carotene in photosystem II crystals

    International Nuclear Information System (INIS)

    Brose, K.; Zouni, A.; Müh, F.; Mroginski, M.A.; Maultzsch, J.

    2013-01-01

    Highlights: • First polarisation-dependent Raman spectroscopy on photosystem II crystals. • Orientation-dependent Raman intensity simulations for di- and monomeric crystals. • Simulations account for all β-carotenes (β-Car) in the unit cell for the first time. • Prediction for identificationy of the β-Car cation in side-path electron transport. - Abstract: In order to clarify possibilities to identify the β-carotene (β-Car) radicals in secondary electron transfer (ET) reactions in the photosystem II core complex (PSIIcc), Raman intensities of all 96 β-Car cofactors in the unit cell of PSIIcc-dimer crystals as a function of polarisation and crystal orientation were simulated based on the 2.9 Å resolution structure. The Raman-active symmetry A g in the C 2h group is assigned to the β-Car modes ν 66 and ν 67 . Simulations are in agreement with experiment for off-resonant excitation at 1064 nm. Resonant measurements at 476 and 532 nm excitation can not be explained, which is attributed to mode mixing in the excited state and the existence of different spectral pools. The identity of the β-Car oxidised in secondary ET can not be resolved by Raman measurements on PSIIcc-dimer crystals. Additional simulations show that similar measurements on PSIIcc-monomer crystals could provide a possible route to solve this issue

  7. Novel routes to electromagnetic enhancement and its characterisation in surface- and tip-enhanced Raman scattering.

    Science.gov (United States)

    Dawson, P; Frey, D; Kalathingal, V; Mehfuz, R; Mitra, J

    2017-12-04

    Quantitative understanding of the electromagnetic component in enhanced Raman spectroscopy is often difficult to achieve on account of the complex substrate structures utilised. We therefore turn to two structurally simple systems amenable to detailed modelling. The first is tip-enhanced Raman scattering under electron scanning tunnelling microscopy control (STM-TERS) where, appealing to understanding developed in the context of photon emission from STM, it is argued that the localised surface plasmon modes driving the Raman enhancement exist in the visible and near-infrared regime only by virtue of significant modification to the optical properties of the tip and sample metals (gold here). This is due to the strong dc field-induced (∼10 9 V m -1 ) non-linear corrections to the dielectric function of gold via the third order susceptibility term in the polarisation. Also, sub-5 nm spatial resolution is shown in the modelling. Secondly, we suggest a novel deployment of hybrid plasmonic waveguide modes in surface enhanced Raman scattering (HPWG-SERS). This delivers strong confinement of electromagnetic energy in a ∼10 nm oxide 'gap' between a high-index dielectric material of nanoscale width (a GaAs nanorod and a 100 nm Si slab are considered here) and a metal, yielding a monotonic variation in the Raman enhancement factor as a function of wavelength with no long-wavelength cut-off, both features that contrast with STM-TERS.

  8. Simulations of the polarisation-dependent Raman intensity of β-carotene in photosystem II crystals

    Energy Technology Data Exchange (ETDEWEB)

    Brose, K., E-mail: katharina.brose@gmx.net [Institut für Festkörperphysik, Technische Universität Berlin, Hardenbergstraße 36, 10623 Berlin (Germany); Zouni, A. [Institut für Chemie, Max-Volmer-Laboratorium, Technische Universität Berlin, Straße des 17. Juni 135, 10623 Berlin (Germany); Müh, F. [Institut für Theoretische Physik, Johannes Kepler Universität Linz, Altenberger Straße 69, 4040 Linz (Austria); Mroginski, M.A. [Institut für Chemie, Max-Volmer-Laboratorium, Technische Universität Berlin, Straße des 17. Juni 135, 10623 Berlin (Germany); Maultzsch, J. [Institut für Festkörperphysik, Technische Universität Berlin, Hardenbergstraße 36, 10623 Berlin (Germany)

    2013-06-03

    Highlights: • First polarisation-dependent Raman spectroscopy on photosystem II crystals. • Orientation-dependent Raman intensity simulations for di- and monomeric crystals. • Simulations account for all β-carotenes (β-Car) in the unit cell for the first time. • Prediction for identificationy of the β-Car cation in side-path electron transport. - Abstract: In order to clarify possibilities to identify the β-carotene (β-Car) radicals in secondary electron transfer (ET) reactions in the photosystem II core complex (PSIIcc), Raman intensities of all 96 β-Car cofactors in the unit cell of PSIIcc-dimer crystals as a function of polarisation and crystal orientation were simulated based on the 2.9 Å resolution structure. The Raman-active symmetry A{sub g} in the C{sub 2h} group is assigned to the β-Car modes ν{sub 66} and ν{sub 67}. Simulations are in agreement with experiment for off-resonant excitation at 1064 nm. Resonant measurements at 476 and 532 nm excitation can not be explained, which is attributed to mode mixing in the excited state and the existence of different spectral pools. The identity of the β-Car oxidised in secondary ET can not be resolved by Raman measurements on PSIIcc-dimer crystals. Additional simulations show that similar measurements on PSIIcc-monomer crystals could provide a possible route to solve this issue.

  9. Utilizing Raman Spectroscopy and Surface-Enhanced Raman Spectroscopy to investigate healthy and cancerous colon samples

    International Nuclear Information System (INIS)

    Barzegar, A.; Rezaei, H.; Malekfar, R.

    2012-01-01

    In this study, spontaneous Raman scattering and surface-enhanced Raman scattering, Surface-Enhanced Raman Spectroscopy spectra have been investigated. The samples which were kept in the formalin solution selected from the human's healthy and cancerous colon tissues. The Surface-Enhanced Raman Spectroscopy spectra were collected by adding colloidal solution contained silver nanoparticles to the top of the samples. The recorded spectra were compared for the spontaneous Raman spectra of healthy and cancerous colon samples. The spontaneous and surface enhanced Raman scattering data were also collected and compared for both healthy and damaged samples.

  10. Probing Pharmaceutical Mixtures during Milling: The Potency of Low-Frequency Raman Spectroscopy in Identifying Disorder.

    Science.gov (United States)

    Walker, Greg; Römann, Philipp; Poller, Bettina; Löbmann, Korbinian; Grohganz, Holger; Rooney, Jeremy S; Huff, Gregory S; Smith, Geoffrey P S; Rades, Thomas; Gordon, Keith C; Strachan, Clare J; Fraser-Miller, Sara J

    2017-12-04

    This study uses a multimodal analytical approach to evaluate the rates of (co)amorphization of milled drug and excipient and the effectiveness of different analytical methods in detecting these changes. Indomethacin and tryptophan were the model substances, and the analytical methods included low-frequency Raman spectroscopy (785 nm excitation and capable of measuring both low- (10 to 250 cm -1 ) and midfrequency (450 to 1800 cm -1 ) regimes, and a 830 nm system (5 to 250 cm -1 )), conventional (200-3000 cm -1 ) Raman spectroscopy, Fourier transform infrared spectroscopy (FTIR), and X-ray powder diffraction (XRPD). The kinetics of amorphization were found to be faster for the mixture, and indeed, for indomethacin, only partial amorphization occurred (after 360 min of milling). Each technique was capable of identifying the transformations, but some, such as low-frequency Raman spectroscopy and XRPD, provided less ambiguous signatures than the midvibrational frequency techniques (conventional Raman and FTIR). The low-frequency Raman spectra showed intense phonon mode bands for the crystalline and cocrystalline samples that could be used as a sensitive probe of order. Multivariate analysis has been used to further interpret the spectral changes. Overall, this study demonstrates the potential of low-frequency Raman spectroscopy, which has several practical advantages over XRPD, for probing (dis-)order during pharmaceutical processing, showcasing its potential for future development, and implementation as an in-line process monitoring method.

  11. The Raman spectrum and lattice parameters of MgB2 as a function of temperature

    International Nuclear Information System (INIS)

    Shi Lei; Zhang Huarong; Chen Lin; Feng Yong

    2004-01-01

    The temperature dependences of the Raman spectrum and lattice parameters of polycrystalline MgB 2 have been investigated by means of Raman spectroscopy and x-ray diffraction. It is found that the lattice parameters show an approximately linear change with the temperature decrease, giving different thermal expansions along the a- and c-axes, which is caused by the comparatively weak metal-boron bonding in MgB 2 . The grain size of MgB 2 determined by means of x-ray diffraction is around 45 nm for both [100] and [001] directions. There is no evidence for any structural transition while the temperature changes from 300 K down to 12 K. An anomalous Raman band at 603 cm -1 is observed, which is consistent with the theoretical prediction for the E 2g in-plane boron stretching mode. The Raman frequency increases and the linewidth decreases as the temperature decreases. A possible origin of the temperature dependences of the Raman frequency and the linewidth is discussed. It is suggested that the grain size effect of MgB 2 on the nanometric scale will have a clear influence on the frequency and the linewidth of the Raman spectrum

  12. Mineralogical composition of the meteorite El Pozo (Mexico): a Raman, infrared and XRD study.

    Science.gov (United States)

    Ostrooumov, Mikhail; Hernández-Bernal, Maria del Sol

    2011-12-01

    The Raman (RMP), infrared (IR) and XRD analysis have been applied to the examination of mineralogical composition of El Pozo meteorite (an ordinary chondrite L5 type; village Valle of Allende, founded in State of Chihuahua, Mexico: 26°56'N and 105°24'W, 1998). RMP measurements in the range of 100-3500 cm(-1) revealed principal characteristic bands of the major minerals: olivine, two polymorph modifications of pyroxene (OPx and CPx) and plagioclase. Some bands of the minor minerals (hematite and goethite) were also identified. All these minerals were clearly distinguished using IR and XRD techniques. XRD technique has shown the presence of some metallic phases such as kamacite and taenite as well as troilite and chromite. These minerals do not have characteristic Raman spectra because Fe-Ni metals have no active modes for Raman spectroscopy and troilite is a weak Raman scatterer. Raman mapping microspectroscopy was a key part in the investigation of El Pozo meteorite's spatial distribution of the main minerals because these samples are structurally and chemically complex and heterogeneous. The mineral mapping by Raman spectroscopy has provided information for a certain spatial region on which a spatial distribution coexists of the three typical mineral assemblages: olivine; olivine+orthopyroxene; and orthopyroxene. Copyright © 2011 Elsevier B.V. All rights reserved.

  13. Raman spectral properties of squamous cell carcinoma of oral tissues and cells

    Science.gov (United States)

    Su, L.; Sun, Y. F.; Chen, Y.; Chen, P.; Shen, A. G.; Wang, X. H.; Jia, J.; Zhao, Y. F.; Zhou, X. D.; Hu, J. M.

    2012-01-01

    Early diagnosis is the key of the improved survival rates of oral cancer. Raman spectroscopy is sensitive to the early changes of molecular composition and structure that occur in benign lesion during carcinogenesis. In this study, in situ Raman analysis provided distinct spectra that can be used to discriminate between normal and malignant tissues, as well as normal and cancer cells. The biochemical variations between different groups were analyzed by the characteristic bands by comparing the normalized mean spectra. Spectral profiles of normal, malignant conditions show pronounced differences between one another, and multiple Raman markers associated with DNA and protein vibrational modes have been identified that exhibit excellent discrimination power for cancer sample identification. Statistical analyses of the Raman data and classification using principal component analysis (PCA) are shown to be effective for the Raman spectral diagnosis of oral mucosal diseases. The results indicate that the biomolecular differences between normal and malignant conditions are more obviously at the cellular level. This technique could provide a research foundation for the Raman spectral diagnosis of oral mucosal diseases.

  14. Raman Spectroscopy of DNA Packaging in Individual Human Sperm Cells distinguishes Normal from Abnormal Cells

    Energy Technology Data Exchange (ETDEWEB)

    Huser, T; Orme, C; Hollars, C; Corzett, M; Balhorn, R

    2009-03-09

    Healthy human males produce sperm cells of which about 25-40% have abnormal head shapes. Increases in the percentage of sperm exhibiting aberrant sperm head morphologies have been correlated with male infertility, and biochemical studies of pooled sperm have suggested that sperm with abnormal shape may contain DNA that has not been properly repackaged by protamine during spermatid development. We have used micro-Raman spectroscopy to obtain Raman spectra from individual human sperm cells and examined how differences in the Raman spectra of sperm chromatin correlate with cell shape. We show that Raman spectra of individual sperm cells contain vibrational marker modes that can be used to assess the efficiency of DNA-packaging for each cell. Raman spectra obtained from sperm cells with normal shape provide evidence that DNA in these sperm is very efficiently packaged. We find, however, that the relative protein content per cell and DNA packaging efficiencies are distributed over a relatively wide range for sperm cells with both normal and abnormal shape. These findings indicate that single cell Raman spectroscopy should be a valuable tool in assessing the quality of sperm cells for in-vitro fertilization.

  15. First-principles simulation of Raman spectra and structural properties of quartz up to 5 GPa

    International Nuclear Information System (INIS)

    Liu Lei; Lv Chao-Jia; Yi Li; Liu Hong; Du Jian-Guo; Zhuang Chun-Qiang

    2015-01-01

    The crystal structure and Raman spectra of quartz are calculated by using first-principles method in a pressure range from 0 to 5 GPa. The results show that the lattice constants (a, c, and V) decrease with increasing pressure and the a-axis is more compressible than the c axis. The Si–O bond distance decreases with increasing pressure, which is in contrast to experimental results reported by Hazen et al. [Hazen R M, Finger L W, Hemley R J and Mao H K 1989 Solid State Communications 725 507–511], and Glinnemann et al. [Glinnemann J, King H E Jr, Schulz H, Hahn T, La Placa S J and Dacol F 1992 Z. Kristallogr. 198 177–212]. The most striking changes are of inter-tetrahedral O–O distances and Si–O–Si angles. The volume of the tetrahedron decreased by 0.9% (from 0 to 5 GPa), which suggests that it is relatively rigid. Vibrational models of the quartz modes are identified by visualizing the associated atomic motions. Raman vibrations are mainly controlled by the deformation of the tetrahedron and the changes in the Si–O–Si bonds. Vibrational directions and intensities of atoms in all Raman modes just show little deviations when pressure increases from 0 to 5 GPa. The pressure derivatives (dν i /dP) of the 12 Raman frequencies are obtained at 0 GPa–5 GPa. The calculated results show that first-principles methods can well describe the high-pressure structural properties and Raman spectra of quartz. The combination of first-principles simulations of the Raman frequencies of minerals and Raman spectroscopy experiments is a useful tool for exploring the stress conditions within the Earth. (paper)

  16. Synthesis and temperature dependent Raman studies of large crystalline faces topological GeBi4Te7 single crystal

    Science.gov (United States)

    Mal, Priyanath; Bera, G.; Turpu, G. R.; Srivastava, Sunil K.; Das, Pradip

    2018-05-01

    We present a study of structural and vibrational properties of topological insulator GeBi4Te7. Modified Bridgeman technique is employed to synthesize the single crystal with relatively large crystalline faces. Sharp (0 0 l) reflection confirms the high crystallinity of the single crystal. We have performed temperature dependent Raman measurement for both parallel and perpendicular to crystallographic c axis geometry. In parallel configuration we have observed seven Raman modes whereas in perpendicular geometry only four of these are identified. Appearance and disappearance of Raman modes having different intensities for parallel and perpendicular to c measurement attribute to the mode polarization. Progressive blue shift is observed with lowering temperature, reflects the increase in internal stress.

  17. Transcutaneous Raman Spectroscopy of Bone

    Science.gov (United States)

    Maher, Jason R.

    Clinical diagnoses of bone health and fracture risk typically rely upon measurements of bone density or structure, but the strength of a bone is also dependent upon its chemical composition. One technology that has been used extensively in ex vivo, exposed-bone studies to measure the chemical composition of bone is Raman spectroscopy. This spectroscopic technique provides chemical information about a sample by probing its molecular vibrations. In the case of bone tissue, Raman spectra provide chemical information about both the inorganic mineral and organic matrix components, which each contribute to bone strength. To explore the relationship between bone strength and chemical composition, our laboratory has contributed to ex vivo, exposed-bone animal studies of rheumatoid arthritis, glucocorticoid-induced osteoporosis, and prolonged lead exposure. All of these studies suggest that Raman-based predictions of biomechanical strength may be more accurate than those produced by the clinically-used parameter of bone mineral density. The utility of Raman spectroscopy in ex vivo, exposed-bone studies has inspired attempts to perform bone spectroscopy transcutaneously. Although the results are promising, further advancements are necessary to make non-invasive, in vivo measurements of bone that are of sufficient quality to generate accurate predictions of fracture risk. In order to separate the signals from bone and soft tissue that contribute to a transcutaneous measurement, we developed an overconstrained extraction algorithm that is based upon fitting with spectral libraries derived from separately-acquired measurements of the underlying tissue components. This approach allows for accurate spectral unmixing despite the fact that similar chemical components (e.g., type I collagen) are present in both soft tissue and bone and was applied to experimental data in order to transcutaneously detect, to our knowledge for the first time, age- and disease-related spectral

  18. Raman spectroscopy peer review report

    International Nuclear Information System (INIS)

    Winkelman, W.D.; Eberlein, S.J.

    1994-09-01

    The Hanford Site in eastern Washington includes 177 underground storage tanks (UST), which contain waste materials produced during the production of nuclear fuels. The materials in the tanks must be characterized to support the retrieval, processing, and final disposition of the waste. Characterization is currently performed by removing waste samples for analyses in a hot cell or laboratory. A review of the Hanford Raman Spectroscopy Program was held in Richland on March 23 and 24, 1994. A team of principal investigators and researchers made presentations that covered both technical and programmatic aspects of the Hanford Site Raman work. After these presentations and discussions, the review panel met in a closed session to formalize a list of findings. The reviewers agreed that Raman spectroscopy is an excellent method to attack the tank waste characterization and screening problems that were presented. They agreed that there was a good chance that the method would be successful as presently envisioned. The reviewers provided the following primary recommendations: evaluation a laser with wavelength in the near infrared; provide optical filters at or near the sampling end of the fiber-optic probe; develop and implement a strategy for frequent calibration of the system; do not try to further increase Raman resolution at the expense of wavelength range; clearly identify and differentiate between requirements for providing a short-term operational system and requirements for optimizing a system for long-term field use; and determine the best optical configuration, which may include reduced fiber-optic diameter and/or short focal length and low F-number spectrographs

  19. Raman spectroscopic study of uranyl complex in alkali chloride melts

    International Nuclear Information System (INIS)

    Fujii, Toshiyuki; Uda, Takeshi; Iwadate, Yasuhiko; Nagai, Takayuki; Uehara, Akihiro; Yamana, Hajimu

    2013-01-01

    Raman spectra of alkali chloride melts containing 3 mol% U(VI) were measured at 823 K. The complexation of UO 2 Cl 4 2- in binary mixtures of LiCl-KCl, LiCl-RbCl, and LiCl-CsCl was investigated. The spectrum of UO 2 Cl 4 2- obtained was characterized by Raman active vibration modes, that is, totally symmetric stretching vibrations A 1g (ν 1 : OUO) and A 1g (ν 2 : UCl 4 ), and bending vibration E g (ν 8: UO 2 Cl 2 ). The dependence of polarizing power of solvent cations on the vibrational frequencies was clarified. The ν 8 frequencies were insensitive to the change in the polarizing power. On the other hand, the ν 1 and ν 2 frequencies increased with the rise of polarizing power. The Raman shifts suggest that the square bipyramidal structure of UO 2 Cl 4 2- is kept in various binary alkali chlorides, while O 2− and Cl − around U(VI) are clearly polarized by the increase of polarizing power

  20. Raman spectroscopic studies on bacteria

    Science.gov (United States)

    Maquelin, Kees; Choo-Smith, Lin-P'ing; Endtz, Hubert P.; Bruining, Hajo A.; Puppels, Gerwin J.

    2000-11-01

    Routine clinical microbiological identification of pathogenic micro-organisms is largely based on nutritional and biochemical tests. Laboratory results can be presented to a clinician after 2 - 3 days for most clinically relevant micro- organisms. Most of this time is required to obtain pure cultures and enough biomass for the tests to be performed. In the case of severely ill patients, this unavoidable time delay associated with such identification procedures can be fatal. A novel identification method based on confocal Raman microspectroscopy will be presented. With this method it is possible to obtain Raman spectra directly from microbial microcolonies on the solid culture medium, which have developed after only 6 hours of culturing for most commonly encountered organisms. Not only does this technique enable rapid (same day) identifications, but also preserves the sample allowing it to be double-checked with traditional tests. This, combined with the speed and minimal sample handling indicate that confocal Raman microspectroscopy has much potential as a powerful new tool in clinical diagnostic microbiology.