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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. 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...

  3. 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....

  4. 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...

  5. Actively mode-locked Raman fiber laser.

    Science.gov (United States)

    Yang, Xuezong; Zhang, Lei; Jiang, Huawei; Fan, Tingwei; Feng, Yan

    2015-07-27

    Active mode-locking of Raman fiber laser is experimentally investigated for the first time. An all fiber connected and polarization maintaining loop cavity of ~500 m long is pumped by a linearly polarized 1120 nm Yb fiber laser and modulated by an acousto-optic modulator. Stable 2 ns width pulse train at 1178 nm is obtained with modulator opening time of > 50 ns. At higher power, pulses become longer, and second order Raman Stokes could take place, which however can be suppressed by adjusting the open time and modulation frequency. Transient pulse evolution measurement confirms the absence of relaxation oscillation in Raman fiber laser. Tuning of repetition rate from 392 kHz to 31.37 MHz is obtained with harmonic mode locking.

  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. Intensity-carrying modes in Raman and Raman optical activity spectroscopy.

    Science.gov (United States)

    Luber, Sandra; Reiher, Markus

    2009-08-24

    We describe a quantum-chemical approach for the determination of modes with maximum Raman and Raman optical activity (ROA) intensity by maximizing the intensities with respect to the Raman and Raman optical activity intensity, respectively, which is shown to lead to eigenvalue equations. The intensity-carrying modes are in general hypothetical modes and do not directly correspond to a certain normal mode in the spectrum. However, they provide information about those molecular distortions leading to intense bands in the spectrum. Modes with maximum Raman intensity are presented for propane-1,3-dione, propane-1,3-dionate, and Lambda-tris(propane-1,3-dionato)cobalt(III). Moreover, the mode with highest ROA intensity is examined for this chiral cobalt complex and also for the (chiral) amino acid L-tryptophan. The Raman and ROA high-intensity modes are an optimal starting guess for intensity-tracking calculations, in which selectively normal modes with high Raman or ROA intensity are converged. We present the first Raman and ROA intensity-tracking calculations. These reveal a high potential for large molecules, for which the selective calculation of normal modes with high intensity is desirable in view of the large computational effort required for the calculation of Raman and ROA polarizability property tensors.

  8. 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...

  9. On the Raman threshold of passive large mode area fibers

    Science.gov (United States)

    Jauregui, Cesar; Limpert, Jens; Tünnermann, Andreas

    2011-02-01

    The output power of fiber optic laser systems has been exponentially increasing in the last years. However, non-linear effects, and in particular stimulated Raman scattering (SRS), are threatening to seriously limit the development pace in the near future. SRS can take place anywhere along the laser system, however it is actually the passive delivery fiber at the end of the system, the section where SRS is most likely to occur. The common way to combat this problem is to use the so-called Large Mode Area (LMA) fibers. However, these fibers are expensive and have a multimode nature that will either reduce the beam quality of the laser output or require a careful excitation of the fundamental mode. Furthermore, the larger the core area, the more complicated it will be to sustain single-mode operation. Therefore, it is becoming increasingly important to be able to determine which is the minimum core area required in the delivery fiber to avoid SRS. This calculation is usually carried out using the conventional formula for the Raman Threshold published by R.G. Smith in 1972: Pth =16Aeff gRLeff . In this work we demonstrate that this formula and the conclusions derived from it are inaccurate for short (several meters long) LMA fibers. For example, one widely spread belief (obtained from this expression) is that there is no dependence of the Raman intensity threshold (Ith=Pth/Aeff) on the mode area. However, our calculations show otherwise. Additionally, we have obtained an improved Raman threshold formula valid for short LMA fibers.

  10. Mixed-Mode Fracture and Fatigue Analysis of Cracked 3D Complex Structures using a 3D SGBEM-FEM Alternating Method

    Science.gov (United States)

    Bhavanam, Sharada

    The aim of this thesis is to numerically evaluate the mixed-mode Stress Intensity Factors (SIFs) of complex 3D structural geometries with arbitrary 3D cracks using the Symmetric Galerkin Boundary Element Method-Finite Element Method (SGBEM-FEM) Alternating Method. Various structural geometries with different loading scenarios and crack configurations were examined in this thesis to understand the behavior and trends of the mixed-mode SIFs as well as the fatigue life for these complex structural geometries. Although some 3D structures have empirical and numerical solutions that are readily available in the open literature, some do not; therefore this thesis presents the results of fracture and fatigue analyses of these 3D complex structures using the SGBEM-FEM Alternating Method to serve as reference for future studies. Furthermore, there are advantages of using the SGBEM-FEM Alternating Method compared to traditional FEM methods. For example, the fatigue-crack-growth and fatigue life can be better estimated for a structure because different fatigue models (i.e. Walker, Paris, and NASGRO) can be used within the same framework of the SGBEM-FEM Alternating Method. The FEM (un-cracked structure)/BEM(crack model) meshes are modeled independently, which speeds up the computation process and reduces the cost of human labor. A simple coarse mesh can be used for all fracture and fatigue analyses of complex structures. In this thesis, simple coarse meshes were used for 3D complex structures, which were below 5000 elements as compared to traditional FEM, which require meshes where the elements range on the order of ˜250,000 to ˜106 and sometimes even more than that.

  11. Raman and surface-enhanced Raman spectroscopy of amino acids and nucleotide bases for target bacterial vibrational mode identification

    Science.gov (United States)

    Guicheteau, Jason; Argue, Leanne; Hyre, Aaron; Jacobson, Michele; Christesen, Steven D.

    2006-05-01

    Raman and surface-enhanced Raman spectroscopy (SERS) studies of bacteria have reported a wide range of vibrational mode assignments associated with biological material. We present Raman and SER spectra of the amino acids phenylalanine, tyrosine, tryptophan, glutamine, cysteine, alanine, proline, methionine, asparagine, threonine, valine, glycine, serine, leucine, isoleucine, aspartic acid and glutamic acid and the nucleic acid bases adenosine, guanosine, thymidine, and uridine to better characterize biological vibrational mode assignments for bacterial target identification. We also report spectra of the bacteria Bacillus globigii, Pantoea agglomerans, and Yersinia rhodei along with band assignments determined from the reference spectra obtained.

  12. Identification of LDPE Grades Focusing on Specific CH2 Raman Vibration Modes

    Directory of Open Access Journals (Sweden)

    Richard Jumeau

    2013-01-01

    Full Text Available The possibilities of applications of vibrational spectroscopy techniques (Raman spectroscopy in the analysis and characterization of polymers are more and more used and accurate. In this paper, our purpose is to characterize Low Density Poly(Ethylene (LDPE grades by Raman spectroscopy and in particular with CH2 Raman vibration modes. With temperature measurements, we determine different amorphous and crystalline Raman assignments. From these results and on the basis of the evolution of CH2 bending Raman vibration modes, we develop a phenomenological model in correlation with Differential Scanning Calorimetry and in particular with crystalline lamella thickness determination.

  13. Rigid-layer Raman-active modes in N -layer transition metal dichalcogenides: interlayer force constants and hyperspectral Raman imaging

    Science.gov (United States)

    Froehlicher, Guillaume; Lorchat, Etienne; Zill, Olivia; Romeo, Michelangelo; Berciaud, Stéphane

    2018-01-01

    We report a comparative study of rigid layer Raman-active modes in $N$-layer transition metal dichalcogenides. Trigonal prismatic (2Hc, such as MoSe$_2$, MoTe$_2$, WS$_2$, WSe$_2$) and distorted octahedral (1T', such as ReS$_2$ and ReSe$_2$) phases are considered. The Raman-active in-plane interlayer shear modes and out-of-plane interlayer breathing modes appear as well-defined features with wavenumbers in the range 0-40~cm$^{-1}$. These rigid layer modes are well-described by an elementary linear chain model from which the interlayer force constants are readily extracted. Remarkably, these force constants are all found to be of the same order of magnitude. Finally, we show that the prominent interlayer shear and breathing mode features allow high-precision hyperspectral Raman imaging of $N-$layer domains within a given transition metal dichalcogenide flake.

  14. Mode coupling mechanisms in liquids studied by 2D Raman scattering

    NARCIS (Netherlands)

    Steffen, T; Duppen, K.; Elsaesser, T; Fujimoto, JG; Wiersma, DA; Zinth, W

    1998-01-01

    Femtosecond temporally two-dimensional Raman scattering, that was originally designed to characterize the time scale(s) of intermolecular dynamics in liquids, also provides information on mode coupling mechanisms. Polarizability mode coupling suppresses the formation of motional echoes, that

  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 (<50 cm(-1)) in twisted bilayer MoS2 by Raman spectroscopy and first-principles modeling. Twisting significantly alters the interlayer stacking and coupling, leading to notable 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. Transition between Kerr comb and stimulated Raman comb in a silica whispering gallery mode microcavity

    Science.gov (United States)

    Fujii, Shun; Kato, Takumi; Suzuki, Ryo; Hori, Atsuhiro; Tanabe, Takasumi

    2018-01-01

    We theoretically and experimentally investigated the transition between modulation instability and Raman gain in a small silica microcavity with a large free-spectral range (FSR), which reveals that we can selectively switch from a four-wave mixing dominant state to a stimulated Raman scattering dominant state. Both the theoretical analysis and the experiment show that a Raman-dominant region is present between transitions of Kerr combs with different free-spectral range spacings. We can obtain a stable Kerr comb and a stable Raman state selectively by changing the driving power, coupling between the cavity and the waveguide, and laser detuning. Such a controllable transition is achieved thanks to the presence of gain competition between modulation instability and Raman gain in silica whispering gallery mode microcavities.

  17. Raman-active modes in homogeneous and inhomogeneous bundles of single-walled carbon nanotubes

    Energy Technology Data Exchange (ETDEWEB)

    Sbai, K; Rahmani, A; Chadli, H [Laboratoire de Physique des materiaux et Modelisation des Systemes, Universite Moulay Ismail, Faculte des Sciences, BP 11201, Zitoune, 50000 Meknes (Morocco); Sauvajol, J-L [Laboratoire des Colloides, Verres et Nanomateriaux (UMR CNRS 5587), Universite Montpellier II, F-34095 Montpellier Cedex 5 (France)], E-mail: rahmani@fs-umi.ac.ma

    2009-01-28

    In the present work, the non-resonant Raman-active modes are calculated for several diameters, chiralities and sizes for homogeneous and inhomogeneous bundles of single-walled carbon nanotubes (BWCNTs), using the spectral moment's method (SMM). Additional intense Raman-active modes are present in the breathing-like modes (BLM) spectra of these systems in comparison with a single fully symmetric A{sub 1g} mode characteristic of isolated nanotubes (SWCNTs). The dependence of the wavenumber of these modes in terms of diameters, lengths and number of tubes was investigated. We found that, for a finite (in)homogeneous bundle, additional breathing-like modes appear as a specific signature.

  18. FEM to

    Directory of Open Access Journals (Sweden)

    Moaz H. Ali

    2013-12-01

    Full Text Available Finite element modeling (FEM is considered a famous method belonging to the numerical simulation methods. First it is a dominant technique in structural mechanics. Hence, this paper is focused on the effect of feed rate (f on surface roughness (Ra and cutting force components (Fc,Ft during the face-milling operation of the titanium alloy (Ti–6Al–4V. The design of experiments was used to conduct the experiments to evaluate the effect of the feed rate on the machining responses such as surface roughness and cutting force components using a face milling operation during the cutting process of the titanium alloy (Ti–6Al–4V. The tests are performed at several feed rates (f while the axial depth of the cut and cutting speed remain constant in dry cutting conditions. The results showed that one could predict the surface roughness by measuring the feed cutting force instead of directly measuring the surface roughness experimentally through using the finite element method to build the model and to predict the surface roughness from the values of the feed cutting force. This is because a similar trend was found between the surface roughness and feed cutting force. Therefore, constructing a prediction model via finite element modeling (FEM led to the conclusion that we can estimate feed cutting force and thus surface roughness.

  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. 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

  1. Raman scattering by LO phonon-plasmon coupled modes in n-type InP

    OpenAIRE

    González Díaz, Germán; Blanco, N.; Artús, L.; Cuscó, R.; Ibáñez, J.

    1999-01-01

    We have studied LO phonon-plasmon coupled modes by means of Raman scattering in n-InP for carrier densities between 6x10(16) and 1x10(19) cm(-3). A line-shape theory based on the Lindhard-Mermin dielectric function that takes into account the nonparabolicity of the InP conduction band as well as temperature and finite wave-vector effects is used to fit the Raman spectra and extract accurate values of the electron density. The results obtained from the Lindhard-Mermin model are compared with t...

  2. Raman scattering from ZnO incorporating Fe nanoparticles: Vibrational modes and low-frequency acoustic modes

    Energy Technology Data Exchange (ETDEWEB)

    Romcevic, N., E-mail: romcevi@ipb.ac.r [Institute of Physics, University of Belgrade, Pregrevica 118, 11080 Belgrade (Serbia); Kostic, R.; Hadzic, B.; Romcevic, M. [Institute of Physics, University of Belgrade, Pregrevica 118, 11080 Belgrade (Serbia); Kuryliszyn-Kudelska, I.; Dobrowolski, W.D. [Institute of Physics PAS, Al. Lotnikow 32/46, 02/668 Warsaw (Poland); Narkiewicz, U.; Sibera, D. [Szcecin University of Tehnology, Institute of Chemical and Environmental Engineering, Puleskiego 10, 70-322 Szczecin, Warsaw (Poland)

    2010-10-08

    Research highlights: Nanocrystaline samples of ZnO(Fe) were synthesized by wet chemical method. Samples were characterized by X-ray diffraction to determine composition of the samples (ZnO, Fe{sub 2}O{sub 3}, ZnFe{sub 2}O{sub 4}) and the mean crystalline size (8-52 nm). Small amount (5 wt.%) of Fe{sub 2}O{sub 3} at the beginning of the synthesis results in forming of ZnFe{sub 2}O{sub 4} nanoparticles. Large amount (90 wt.%) of Fe{sub 2}O{sub 3} at the beginning of the synthesis results in forming Fe{sub 2}O{sub 3} nanoparticles. Both samples contain ZnO phase which is not registered by XRD, but is clearly seen in the Raman spectra. Main characteristics of experimental Raman spectrum in 200-1600 cm{sup -1} spectral region are: sharp peak at 436 cm{sup -1} and broad two-phonon structure at {approx}1150 cm{sup -1}, typical for ZnO; broad structure below 700 cm{sup -1} that has different position and shape in case of ZnFe{sub 2}O{sub 4} or Fe{sub 2}O{sub 3} nanoparticles. In low-frequency Raman spectra of ZnFe{sub 2}O{sub 4} nanoparticles registered peaks agree well with the calculated frequencies of acoustic phonons. As a result we identified (0,2), (0,0), (2,2) and (1,0) modes. - Abstract: Nanocrystaline samples of ZnO(Fe) were synthesized by wet chemical method. Samples were characterized by X-ray diffraction to determine composition of the samples (ZnO, Fe{sub 2}O{sub 3}, ZnFe{sub 2}O{sub 4}) and the mean crystalline size (8-52 nm). In this paper we report the experimental spectra of Raman scattering. Main characteristics of experimental Raman spectrum in 200-1600 cm{sup -1} spectral region are: sharp peak at 436 cm{sup -1} and broad two-phonon structure at {approx}1150 cm{sup -1}, typical for ZnO; broad structure below 700 cm{sup -1} that has different position and shape in case of ZnFe{sub 2}O{sub 4} or Fe{sub 2}O{sub 3} nanoparticles. Low-frequency Raman modes were measured and assigned according to confined acoustic vibrations of spherical nanoparticles

  3. 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.

  4. 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.

  5. Stimulated Stokes and Antistokes Raman Scattering in Microspherical Whispering Gallery Mode Resonators.

    Science.gov (United States)

    Farnesi, Daniele; Berneschi, Simone; Cosi, Franco; Righini, Giancarlo C; Soria, Silvia; Nunzi Conti, Gualtiero

    2016-04-04

    Dielectric microspheres can confine light and sound for a length of time through high quality factor whispering gallery modes (WGM). Glass microspheres can be thought as a store of energy with a huge variety of applications: compact laser sources, highly sensitive biochemical sensors and nonlinear phenomena. A protocol for the fabrication of both the microspheres and coupling system is given. The couplers described here are tapered fibers. Efficient generation of nonlinear phenomena related to third order optical non-linear susceptibility Χ((3)) interactions in triply resonant silica microspheres is presented in this paper. The interactions here reported are: Stimulated Raman Scattering (SRS), and four wave mixing processes comprising Stimulated Anti-stokes Raman Scattering (SARS). A proof of the cavity-enhanced phenomenon is given by the lack of correlation among the pump, signal and idler: a resonant mode has to exist in order to obtain the pair of signal and idler. In the case of hyperparametric oscillations (four wave mixing and stimulated anti-stokes Raman scattering), the modes must fulfill the energy and momentum conservation and, last but not least, have a good spatial overlap.

  6. E’’ Raman Mode in Thermal Strain-Fractured CVD-MoS2

    Directory of Open Access Journals (Sweden)

    Di Wu

    2016-11-01

    Full Text Available Molybdenum disulfide (MoS2 has recently attracted considerable interests due to its unique properties and potential applications. Chemical vapor deposition (CVD method is used widely to grow large-area and high-quality MoS2 single crystals. Here, we report our investigation on thermal strain-fractured (SF single crystalline MoS2, oxidation-fractured MoS2, and normal MoS2 by atomic force microscopy (AFM, Raman and photoluminescence (PL measurements. Several new Raman modes are observed for SF-MoS2. The band gap of SF-MoS2 is enlarged by 150 meV and the PL intensity is reduced substantially. These results imply that a structural transformation occurs in SF-MoS2. Our findings here are useful for the design of MoS2-based nanocatalysts with relative high catalytic activity.

  7. 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)

  8. Solid-state Raman quantum memory in whispering gallery mode resonators: signal-to-noise ratio

    Directory of Open Access Journals (Sweden)

    Berezhnoi Alexander

    2017-01-01

    Full Text Available The possibility of implementation of optical quantum memory via off-resonant Raman absorption and emission of single-photon pulses in rare-earth-ion-doped crystals is theoretically analysed taking into account signal-to-noise ratio at the output of the memory device. The crystal 143Nd3+:Y7LiF4 is considered as an example. It is shown that the signal-to-noise ratio can exceed unity for single-photon input pulses provided that storage and retrieval of them is performed in the doped crystals forming a microcavity such as whispering gallery mode resonator.

  9. raman

    Indian Academy of Sciences (India)

    also had the devoted and loyal assistance of Asutosh Dey, known to everyone in the Association as Ashu Babu. Raman soon ...... Even after reaching the hotel, the stream of photographers and news- paper reporters continued to show us their ...... My affection, loyalty and respect for him were something extraordinary and I ...

  10. 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)

  11. ZORRO: zirconium oxide resonators for all-in-one Raman and whispering-gallery-mode optical sensing.

    Science.gov (United States)

    Bontempi, N; Vassalini, I; Danesi, S; Alessandri, I

    2017-09-25

    We report the observation of whispering-gallery modes in 2 μm-sized SiO 2 /ZrO 2 core/shell beads utilized as all-dielectric Raman enhancers. This allows us to achieve simultaneous optical and Raman ultrasensitive detection with a single spectral analysis. This opportunity opens exciting perspectives for the multimodal chemical sensing and fabrication of optical fiber devices.

  12. 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.

  13. Theory of the low frequency mechanical modes and Raman spectra of the M13 bacteriophage capsid with atomic detail

    International Nuclear Information System (INIS)

    Dykeman, Eric C; Sankey, Otto F

    2009-01-01

    We present a theoretical study of the low frequency vibrational modes of the M13 bacteriophage using a fully atomistic model. Using ideas from electronic structure theory, the few lowest vibrational modes of the M13 bacteriophage are determined using classical harmonic analysis. The relative Raman intensity is estimated for each of the mechanical modes using a bond polarizability model. Comparison of the atomic mechanical modes calculated here with modes derived from elastic continuum theory shows that a much richer spectrum emerges from an atomistic picture.

  14. Nonlinear backward stimulated Raman scattering from electron beam acoustic modes in the kinetic regime

    International Nuclear Information System (INIS)

    Yin, L.; Daughton, W.; Albright, B. J.; Bowers, K. J.; Montgomery, D. S.; Kline, J. L.; Fernandez, J. C.; Roper, Q.

    2006-01-01

    The backward stimulated Raman scattering (BSRS) of a laser from electron beam acoustic modes (BAM) in the presence of self-consistent non-Maxwellian velocity distributions is examined by linear theory and particle-in-cell (PIC) simulations in one and two dimensions (1D and 2D). The BAM evolve from Langmuir waves (LW) as electron trapping modifies the distribution to a non-Maxwellian form that exhibits a beam component. Linear dispersion relations using the nonlinearly modified distribution from simulations are solved for the electrostatic modes involved in the parametric coupling. Results from linear analysis agree well with electrostatic spectra from simulations. It is shown that the intersection of the Stokes root with BAM (instead of LW) determines the matching conditions for BSRS at a nonlinear stage. As the frequency of the unstable Stokes mode decreases with increasing wave number, the damping rate and the phase velocity of BAM decreases with the phase velocity of the Stokes mode, providing a self-consistently evolving plasma linear response that favors continuation of the nonlinear frequency shift. Coincident with the emergence of BAM is a rapid increase in BSRS reflectivity. The details of the wave-particle interaction region in the electron velocity distribution determine the growth/damping rate of these electrostatic modes and the nonlinear frequency shift; in modeling this behavior, the use of sufficiently large numbers of particles in the simulations is crucial. Both the reflectivity scaling with laser intensity and the spectral features from simulations are discussed and are consistent with recent Trident experiments

  15. Internal DNA modes below 25 cm-1: a resonance Raman spectroscopy observation.

    Science.gov (United States)

    Lisy, V; Miskovsky, P; Brutovsky, B; Chinsky, L

    1997-02-01

    The first resonance Raman scattering observation of the low-frequency (LF) region (below 40 up to 12 cm-1) of DNA motions is presented. Since the concentration of the studied DNA solution was very low (1 mg/ml), the spectra features reflect internal vibrations of the macromolecule. The decomposition of the spectra into Lorentzians clearly indicate three intrahelical DNA modes: the corresponding peaks are located at the frequencies 16, 19, and 23 (+/- 1) cm-1. This result is in agreement with our quasi-continuity model of the LF B-form DNA dynamics (V. Lisy, P. Miskovsky and P. Schreiber, J. Biomol. Struct. Dyn. 13, 707 (1996)). The fit of the experimental frequencies to the theory, using the Genetic Algorithms approach, allowed us to make some conclusions about the model force constants which could be found by independent conformational energy calculations. Possible positions of five lowest-frequency DNA peaks, predicted by the model, are discussed.

  16. Size and environment dependence of surface phonon modes of gallium arsenide nanowires as measured by Raman spectroscopy.

    Science.gov (United States)

    Spirkoska, D; Abstreiter, G; Fontcuberta I Morral, A

    2008-10-29

    Gallium arsenide nanowires were synthesized by gallium-assisted molecular beam epitaxy. By varying the growth time, nanowires with diameters ranging from 30 to 160 nm were obtained. Raman spectra of the nanowire ensembles were measured. The small linewidth of the optical phonon modes agree with an excellent crystalline quality. A surface phonon mode was also revealed, as a shoulder at lower frequencies of the longitudinal optical mode. In agreement with the theory, the surface mode shifts to lower wavenumbers when the diameter of the nanowires is decreased or the environment dielectric constant increased.

  17. Versatile Gap Mode Plasmon under ATR Geometry towards Single Molecule Raman, Laser Trapping and Photocatalytic Reactions.

    Science.gov (United States)

    Futamata, Masayuki; Akai, Keitaro; Iida, Chiaki; Akiba, Natsumi

    2017-01-01

    We have investigated various aspects of a gap mode plasmon to establish it as an analytical tool. First, markedly large (10 7 - 10 9 ) enhancement factors for the Raman scattering intensity from a thiophenol (TP) monolayer sandwiched by Ag films on a prism and silver nanoparticles (AgNPs) were obtained under attenuated total reflection (ATR) geometry. Second, AgNPs with a radius of ∼20 nm were optically trapped and immobilized on TP-covered Ag films under a gap mode resonance with extremely weak laser power density of ∼1 μW/μm 2 at 532 nm. The observed optical trapping and immobilization were theoretically rationalized using a dipole-dipole coupling and van der Waals interaction between AgNPs and Ag films. Third, p-alkyl TP molecules such as p-methyl TP, p-ethyl TP, p-isopropyl TP, and p-tertiary butyl TP were photocatalytically oxidized into p-carboxyl TP, whereas o- and m-methyl TP did not show such reactions.

  18. Raman modes of 6H polytype of silicon carbide to ultrahigh pressures: A comparison with silicon and diamond

    Science.gov (United States)

    Liu, Jun; Vohra, Yogesh K.

    1994-06-01

    We report the Raman study on 6H-SiC to ultrahigh pressures of 90 GPa in a diamond anvil cell. The LO (Γ) and TO(Γ) Raman frequencies increase with increasing pressures. A very interesting turnaround in the LO-TO splitting is observed above 60 GPa. The density variation of the mode Grüneisen parameters for 6H-SiC is compared to that of silicon, cubic boron nitride, and diamond. The SiC is transparent to the visible light at 95 GPa and the anticipated metallic phase was not observed.

  19. The intermediate frequency modes of single- and double-walled carbon nanotubes: a Raman spectroscopic and in situ Raman spectroelectrochemical study.

    Science.gov (United States)

    Kalbac, Martin; Kavan, Ladislav; Zukalová, Markéta; Dunsch, Lothar

    2006-05-24

    The intermediate frequency modes (IFM) of single-walled carbon nanotubes (SWCNTs) and double-walled carbon nanotubes (DWCNTs) were analyzed by Raman spectroscopy and in situ Raman spectroelectrochemistry. The inner and outer tubes of DWCNTs manifested themselves as distinct bands in the IFM region. This confirmed the diameter dependence of IFM frequencies. Furthermore, the analysis of inner tubes of DWCNTs allowed a more-precise assignment of the bands in the IFM region to features intrinsic for carbon nanotubes. Although the inner tubes in DWCNTs are assumed to be structurally perfect, the role of defects on IFM was discussed. The dependence of IFM on electrochemical charging was also studied. In situ spectroelectrochemical data provide a means to distinguish the bands of the outer and inner tubes.

  20. HIRENASD Beam FEM

    Data.gov (United States)

    National Aeronautics and Space Administration — This contains attempts to create BEAM FEM model. I have started a Blog to discuss this... please put your comments there and I will attempt to keep everything...

  1. Raman scattering investigations on Co and Mn doped ZnO epitaxial films: local vibration modes and defect associated ferromagnetism

    Science.gov (United States)

    Cao, Qiang; Liu, Guolei; Yan, Shishen; Mei, Liangmo

    2014-03-01

    The studies of local vibration modes (LVMs) of Co or Mn substitution in wurtzite ZnO lattice have been rather limited, and evolution of LVM bound defects as well as associated ferromagnetism are still poorly understood.In this paper, Raman scattering spectroscopy has been performed on high quality Co and Mn doped ZnO epitaxial films, which were grown on Al2O3 (0001) by oxygen-plasma assisted molecular beam epitaxy. Raman measurements revealed two local vibration modes (LVMs) at 723 and 699 cm?1 due to the substitution of Co2+ in wurtzite ZnO lattice. The LVM at 723 cm?1 is found to be an elemental sensitive vibration mode for Co substitution. The LVM at 699cm-1 can be attributed to enrichment of Co2+ bound with oxygen vacancy, the cobalt?oxygen vacancy?cobalt complexes, which associated with ferromagnetism. It reveals two competitive local vibration modes (LVMs) at 712 and 523 cm-1 due to the substitution of Mn ions in wurtzite ZnO lattice. The LVM at 712cm-1 is found to be an elemental vibration mode of Mn substitution in wurtzite ZnO lattice, while the LVM at 523cm-1 can be attributed to the local vibration mode of acceptor bound Mn substitution in wurtzite ZnO lattice. the NSF Grant NO. 11374189 and 51231007.

  2. 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.

  3. 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

  4. Angular dispersion of oblique phonon modes in BiFeO.sub.3./sub. from micro-Raman scattering

    Czech Academy of Sciences Publication Activity Database

    Hlinka, Jiří; Pokorný, Jan; Karimi, S.; Reaney, I. M.

    2011-01-01

    Roč. 83, č. 2 (2011), "020101-1"-"020101-4" ISSN 1098-0121 R&D Projects: GA ČR GAP204/10/0616 Institutional research plan: CEZ:AV0Z10100520 Keywords : BiFeO 3 * Raman scattering * phonon modes * multiferroic Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 3.691, year: 2011 http://link.aps.org/doi/10.1103/PhysRevB.83.020101

  5. 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.

  6. 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

  7. Resonance Raman studies of Escherichia coli sulfite reductase hemoprotein. 2. Fe4S4 cluster vibrational modes

    International Nuclear Information System (INIS)

    Madden, J.F.; Siegel, L.M.; Han, Sanghwa; Spiro, T.G.

    1989-01-01

    Resonance Raman (RR) spectra from the hemoprotein subunit of Escherichia coli sulfite reductase (SiR-HP) are examined in the low-frequency (200-500 cm -1 ) region where Fe-S stretching modes are expected. In spectra obtained with excitation in the siroheme Soret or Q bands, this region is dominated by siroheme modes. Modes assignable to the Fe 4 S 4 cluster are selectively enhanced, however, with excitation at 488.0 or 457.9 nm. The assignments are confirmed by observation of the expected frequency shifts in SiR-HP extracted from E. coli grown on 34 S-labeled sulfate. The mode frequencies and isotopic shifts resemble those seen in RR spectra of other Fe 4 S 4 proteins and analogues, but the breathing mode of the cluster at 342 cm -1 is higher than that observed in the other species. Spectra of various ligand complexes of SiR-HP reveal only slight sensitivity of the cluster terminal ligand modes to the presence of exogenous heme ligands, at variance with a model of ligand binding in a bridged mode between heme and cluster. Close examination of RR spectra obtained with siroheme Soret-band excitation reveals additional 34 S-sensitive features at 352 and 393 cm -1 . These may be attributed to a bridging thiolate ligand

  8. Normal mode analysis of isotopic shifts in Raman spectrum of TNT-d5

    Science.gov (United States)

    Liu, Yuemin; Tzeng, Nianfeng; Liu, Yucheng; Junk, Thomas

    2017-09-01

    A combined experimental-computational study was conducted on the Raman spectrum of TNT-d5 in the present study. It was found that among the 24 hybrid density functional theory (DFT) methods, O3LYP, tHCTHhyb, and B3LYP simulations yielded the strongest Raman bands which were closest to those measured from experiments. Simulations of hybrid DFT methods did not show that deuterium replacements alter orientations of 2- and 6-nitro with respect to phenyl ring, considering a larger size of the methyl group. However, the deuterium replacements apparently changed the reduced masses for all deuterium related vibrations. Although no difference of structural parameters was shown between TNT and its deuterated analogue, discrepancy was indicated in vibrational zero energy from our simulations. O3LYP simulation exhibited 24 deuterium involved vibrations, which were coupled into seven Raman bands of TNT-d5. This phenomenon can account for the experimental Raman band shifts or split of TNT-d5 when compared with the corresponding bands of TNT. The present study and its outcomes provide in-depth microchemical insights of Raman characteristics of TNT and may facilitate the design of nano-structures of SERS substrates for detection of TNT and its degradation products. All intensities displayed in this study were calculated from numerical simulations.

  9. 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)

  10. Nonlinear development of stimulated Raman scattering from electrostatic modes excited by self-consistent non-Maxwellian velocity distributions

    International Nuclear Information System (INIS)

    Yin, L.; Albright, B.J.; Bezzerides, B.; DuBois, D.F.; Kindel, J.M.; Daughton, W.; Vu, H.X.

    2006-01-01

    The parametric coupling involving backward stimulated scattering of a laser and electron beam acoustic modes (BAM) is described as observed in particle-in-cell (PIC) simulations. The BAM modes evolve from Langmuir waves (LW) as the electron velocity distribution is nonlinearly modified to be non-Maxwellian by backward stimulated Raman scattering (BSRS). With a marginal damping rate, BAM can be easily excited and allow an extended chirping in frequency to occur as later SRS pulses encounter modified distributions. Coincident with the emergence of this non-Maxwellian distribution is a rapid increase in BSRS reflectivities with laser intensities. Both the reflectivity scaling with laser intensity and the observed spectral features from PIC simulations are consistent with recent Trident experiments

  11. 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.

  12. [A study of phonon vibration like modes for aggregation structure in silicate melts by high temperature Raman spectrum].

    Science.gov (United States)

    Xu, Pei-Cang; Li, Ru-Bi; Shang, Tong-Ming; Zhou, Jian; Sun, Jian-Hua; You, Jing-Lin

    2010-05-01

    Silicate melts are special fractal dimension system that is metastable state of near-way order and far-way disorder. In this paper, the size of nanometer aggregation structure and the frequences of phonon vibration like mode in the low dimension silicate series (CaO-Al2O3-SiO2 and Na2-Al2O3-SiO2 series) synthesized via high temperature melting and sol gel methods were measured by means of small-angle X-ray scattering (SAXS), low wavenumber Raman spectrum (LWRS) and high temperature Raman spectrum (HTRS in situ measuring). The nanometer self-similarity aggregation structure(it's size is about a few nm to a few tens nm) and phonic phonon vibration like modes of low temperature silicate gel, high temperature silicate melts and it's quenching glasses phases were obtained. So a quantitative method by HTRS for measuring the aggregation size in the high temperature melts was established. The results showed that the aggregation size of the silicate melts is smaller at high temperature than at room temperature and the number of bridge oxygen in one Si-O tetrahedron in network structure units is decreasing at high temperature. This study work provides important theory and information for deliberating geochemistry characteristic, crystallization & evolution of natural magma and enhancing performance of low dimension silicate matelials.

  13. Optical phonon features of triclinic montebrasite : dispersion analysis and non-polar Raman modes.

    OpenAIRE

    Almeida, Rafael M.; Höfer, Sonja; Mayerhöfer, Thomas G.; Popp, Jürgen; Krambrock, Klaus; Lobo, Ricardo P. S. M.; Dias, Anderson; Moreira, Roberto Luiz

    2015-01-01

    Polarized infrared and Raman spectra of triclinic LiAl(PO4)(OH) [montebrasite] single crystal were recorded for appropriate optical configurations. Dispersion analysis was applied on the infrared reflectivity spectra taken at low incidence angle (11 ) to determine the oscillator parameters and the dipole directions of the polar phonons. In particular, all the 27 polar phonons, predicted by group theory for triclinic P1 structure,were determined. The obtained dielectric tensor para...

  14. 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.

  15. Finite-size effect on the Raman-active modes of double-walled carbon nanotubes

    Energy Technology Data Exchange (ETDEWEB)

    Sbai, K [Equipe de Physique Informatique et Modelisation des Systemes, Universite MY Ismail, Faculte des Sciences, BP 11201, Zitoune, 50000 Meknes (Morocco); Rahmani, A [Equipe de Physique Informatique et Modelisation des Systemes, Universite MY Ismail, Faculte des Sciences, BP 11201, Zitoune, 50000 Meknes (Morocco); Chadli, H [Equipe de Physique Informatique et Modelisation des Systemes, Universite MY Ismail, Faculte des Sciences, BP 11201, Zitoune, 50000 Meknes (Morocco); Sauvajol, J-L [Laboratoire des Colloides, Verres et Nanomateriaux (UMR CNRS 5587), Universite Montpellier II, 34095 Montpellier Cedex 5 (France)

    2008-01-09

    The dependence of the breathing-like phonon modes (BLM) and tangential-like phonon modes (TLM) of individual, finite and infinite bundles of double-walled carbon nanotubes (DWCNTs) as a function of the relative lengths of the inner (L{sub i}) and outer (L{sub o}) tubes is calculated by using the spectral moments method in the framework of the bond-polarization theory. Depending on the relative lengths of the inner (L{sub i}) and outer (L{sub o}) tubes, additional modes are evidenced in the BLM region. These modes must be considered in the analysis of the experimental data.

  16. High resolution Raman study of the soft mode in the incommensurate bis(4-chlorophenyl)sulfone

    Science.gov (United States)

    Ecolivet, C.; Sougoti, M.; Delugeard, Y.; Beaufils, S.

    1994-10-01

    The soft optical mode of bis(4-chlorophenyl)sulfone is analysed up to the incommensurate transition temperature T_i with both a tandem of Fabry-Perot interferometers and a triple monochromator. High resolution spectra (sim 4 GHz ) of the soft mode reveal a mean field behaviour up to T_i - 4 K, but between T_i and this temperature the frequency of the soft mode saturates whereas its linewidth increases and its intensity decreases. The occurrence of second order scattering with a very slow decrease of its intensity above T_i precludes the explanation of the observed soft mode blocking by a divergence of the second order scattering. Different spectral profiles of the soft mode have been recorded in the (bb) and (γ γ) polarizations, γ being the principal dielectric axis parallel to the molecular long axis. Within single mode analysis, excess intensity is found between the soft mode and the longitudinal acoustic mode in the (γ γ) polarization. This intensity is assigned to a coupling effect between these modes whereas a phason contribution is ruled out for reasons of symmetry and temperature behaviour.

  17. Investigation of the Stability of the Ruthenium based Dye (N719) Utilizing the Polarization Properties of Dispersive Raman Modes and/or of the Fluorescent Emission

    DEFF Research Database (Denmark)

    Hassing, Søren; Jernshøj, Kit Drescher; Phuong, Nguyen

    2013-01-01

    for short) is possible by exploiting a combination of the polarization properties of the dispersive Raman modes with the small spectral change in the visible absorption spectrum and/or the difference in the polarization of the fluorescence related to the difference in molecular configuration. By measuring...

  18. Vibrational Relaxation of the Backbone and Base Modes in LacDNA Complexes by UV Resonance Raman Spectroscopy.

    Science.gov (United States)

    Muntean, Cristina M; Bratu, Ioan; Hernanz, Antonio

    2017-07-20

    Vibrational band shape analysis through time correlation function concept is widely used to obtain experimental information on the molecular dynamics of medium-size molecules in different environments. Interesting details are revealed by extending this technique to biomolecules such as functional groups of the nucleic acids in media approaching the physiological conditions. In this work a study into the UV resonance Raman (UVRR) vibrational half bandwidths of functional groups in LacDNA, upon lowering the pH (pH 6.4, pH 3.45) and in the presence of Mn 2+ and Ca 2+ ions, respectively, was of interest. The corresponding global relaxation times have been derived. Also, the 793 cm -1 UVRR band, corresponding to ν (backbone O-P-O, dT) oscillator of LacDNA in aqueous solutions, was selected for band shape-analysis. Vibrational relaxation appears as the dominant relaxation process for this mode, with vibrational dephasing being the most efficient for this oscillator. Current theories developed for vibrational dephasing have been applied to this profile, and relevant relaxation parameters have been obtained and discussed. To our knowledge this is the first study on DNA oligomers vibrational band shape analysis through time correlation function concept.

  19. 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)

  20. 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...

  1. 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.

  2. 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.

  3. 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

  4. 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.

  5. The nature of in-plane skeleton Raman modes of P3HT and their correlation to the degree of molecular order in P3HT:PCBM blend thin films.

    Science.gov (United States)

    Tsoi, Wing C; James, David T; Kim, Jong Soo; Nicholson, Patrick G; Murphy, Craig E; Bradley, Donal D C; Nelson, Jenny; Kim, Ji-Seon

    2011-06-29

    The nature of main in-plane skeleton Raman modes (C=C and C-C stretch) of poly(3-hexylthiophene) (P3HT) in pristine and its blend thin films with [6,6]-phenyl-C(61)-butyric acid methyl ester (PCBM) is studied by resonant and nonresonant Raman spectroscopy and Raman simulations. Under resonant conditions, the ordered phase of P3HT with respect to its disordered phase is identified by (a) a large shift in the C=C mode peak position to lower wavenumber (~21 cm(-1) shift), (b) a narrower fwhm of the C=C mode (~9 cm(-1) narrower), (c) a larger intensity of the C-C mode relative to the C=C mode (~56% larger), and (d) a very small Raman dispersion (~5 cm(-1)) of the C=C mode. The behavior of the C=C and C-C modes of the ordered and disordered phases of P3HT can be explained in terms of different molecular conformations. The C=C mode of P3HT in P3HT:PCBM blend films can be reproduced by simple superposition of the two peaks observed in different phases of P3HT (ordered and disordered). We quantify the molecular order of P3HT after blending with PCBM and the subsequent thermal annealing to be 42 ± 5% and 94 ± 5% in terms of the fraction of ordered P3HT phase, respectively. The increased molecular order of P3HT in blends upon annealing correlates well with enhanced device performance (J(SC), -4.79 to -8.72 mA/cm(2) and PCE, 1.07% to 3.39%). We demonstrate that Raman spectroscopy (particularly under resonant conditions) is a simple and powerful technique to study molecular order of conjugated polymers and their blend films.

  6. 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.)

  7. 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.

  8. 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.

  9. 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

  10. 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.

  11. HIRENASD FEM wing only HEX20

    Data.gov (United States)

    National Aeronautics and Space Administration — The finite element model being used by the AePW is based on the model provided at HIRENASD website The NASTRAN FEM's using HEXA solid elements and identified as...

  12. 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.

  13. 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.

  14. 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...

  15. 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

    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...... for the NbV oxosulfato complexes pertain to NbdO modes: (i) at 937 cm-1 for the mono-oxo NbdO mode of NbO(SO4)3; (ii) at 958 cm-1 for the mono-oxo NbdO mode of NbO(SO4)4S2O7; and (iii) at 926 cm-1 for the symmetric dioxo Nb(=O)2 mode of NbO2(SO4)2....

  16. Spectres infrarouge et Raman de l'acide stéarique et d'une série d'acides gras forme C: modes de squelette, couplage des modes longitudinaux acoustiques (LAM1, LAM3) avec les modes dans le plan de la liaison hydrogène du dimère en dessous de 700 cm -1

    Science.gov (United States)

    Vogel-Weill, C.; Corset, J.

    1995-11-01

    A vibrational study of the skeletal modes of stearic acid ( n = 18) in the C form is interpreted on the basis of the calculated dispersion curves for the aliphatic chain C n H n + 2 . The Raman spectra below 200 cm -1, obtained at 90 K, display one very intense band at 70 cm -1 that is assigned to the longitudinal acoustic mode LAM1. The observed frequencies, together with those of LAM3, follow accurately the selection rules of those expected for a C 36 alkane chain of structure C2h. This led us to consider the overall dimer as a molecular entity located on a Ci, site of the crystal. The result, in agreement with the calculations of Zerbi, can be extended to the entire set of acids studied ( n = 26, 23, 16, 14, 12). The observed coupling between the vibrational skeletal modes of the two chains and the in-plane modes of the hydrogen bonded dimer δ(OH⋯O) and ν(O⋯O) is responsible for the behaviour of the C form. Finally, we present the description of the vibrational modes and their classification in the different symmetry classes for polymethylene and paraffins ( neven) accounting for the conventions used in this work and in the literature.

  17. 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

  18. 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...

  19. 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

  20. 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....

  1. 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...

  2. The identification of dispersive and non-dispersive intermediate frequency modes of HiPco single walled carbon nanotubes by in situ Raman spectroelectrochemistry

    Czech Academy of Sciences Publication Activity Database

    Kalbáč, Martin; Kavan, Ladislav; Zukalová, Markéta; Dunsch, L.

    2006-01-01

    Roč. 243, č. 13 (2006), s. 3134-3137 ISSN 0370-1972 R&D Projects: GA AV ČR IAA4040306; GA AV ČR KJB400400601 Institutional research plan: CEZ:AV0Z40400503 Keywords : electrochemistry * in situ Raman spectroelectrochemistry * IFM features Subject RIV: CG - Electrochemistry Impact factor: 0.967, year: 2006

  3. 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)

  4. Raman Spectroscopy.

    Science.gov (United States)

    Gerrard, Donald L.

    1984-01-01

    Reviews literature on Raman spectroscopy from late 1981 to late 1983. Topic areas include: instrumentation and sampling; liquids and solutions; gases and matrix isolation; biological molecules; polymers; high-temperature and high-pressure studies; Raman microscopy; thin films and surfaces; resonance-enhanced and surface-enhanced spectroscopy; and…

  5. 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.

  6. Direct measurement of beta-agonists in swine hair extract in multiplexed mode by surface-enhanced Raman spectroscopy and microfluidic paper.

    Science.gov (United States)

    Dou, Bin; Luo, Yong; Chen, Xu; Shi, Bo; Du, Yuguang; Gao, Zhigang; Zhao, Weijie; Lin, Bingcheng

    2015-02-01

    Bare gold nanoparticles selectively enhance the Raman signal of beta-agnonists in swine hair extract at 780 nm, which enables analysis of beta-agonists in swine hair extract without chemical labeling, purification, or separation. The analysis is multiplexable and the LOD of beta-agonists is around ng/mL in the assistance of microfluidic paper. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  7. 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.

  8. 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.

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

    DEFF Research Database (Denmark)

    Rottwitt, Karsten; Povlsen, Jørn Hedegaard

    2005-01-01

    to the nonlinear refractive index due to nuclear motions and the Raman response function in the time domain. It is demonstrated that the Raman-gain coefficient may be reduced up to 60% if the signal propagates in the fundamental mode while the pump alternates between the fundamental mode and a higher order mode...

  10. 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.)

  11. 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

  12. Numerical modeling of fiber specklegram sensors by using finite element method (FEM).

    Science.gov (United States)

    Arístizabal, V H; Vélez, F J; Rueda, E; Gómez, N D; Gómez, J A

    2016-11-28

    Although experimental advances in the implementation and characterization of fiber speckle sensor have been reported, a suitable model to interpret the speckle-pattern variation under perturbation is desirable but very challenging to be developed due to the various factors influencing the speckle pattern. In this work, a new methodology based on the finite element method (FEM) for modeling and optimizing fiber specklegram sensors (FSSs) is proposed. The numerical method allows computational visualization and quantification, in near field, of changes of a step multi-mode fiber (SMMF) specklegram, due to the application of a uniformly distributed force line (UDFL). In turn, the local modifications of the fiber speckle produce changes in the optical power captured by a step single-mode fiber (SSMF) located just at the output end of the SMMF, causing a filtering effect that explains the operation of the FSSs. For each external force, the stress distribution and the propagations modes supported by the SMMF are calculated numerically by means of FEM. Then, those modes are vectorially superposed to reconstruct each perturbed fiber specklegram. Finally, the performance of the sensing mechanism is evaluated for different radius of the filtering SSMF and force-gauges, what evidences design criteria for these kinds of measuring systems. Results are in agreement with those theoretical and experimental ones previously reported.

  13. 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.

  14. CV Raman

    Indian Academy of Sciences (India)

    style, philosophy and motivations. We thus have here an authoritative biography of the most .... What motivated Raman to do the extraordinary things he did against all odds? What was the secret of his success? ... to Professor S. Chandrasekhar for permission to quote some of his statements. I am very indebted to Prof.

  15. Changes in the Electronic States of Single Walled Carbon Nanotubes as Followed by a Raman Spectroelectrochemical Analysis of the Radial Breathing Mode

    Czech Academy of Sciences Publication Activity Database

    Kalbáč, Martin; Kavan, Ladislav; Dunsch, L.

    2008-01-01

    Roč. 112, č. 43 (2008), s. 16759-16763 ISSN 1932-7447 R&D Projects: GA AV ČR KJB400400601; GA AV ČR IAA400400804; GA AV ČR KAN200100801; GA ČR GC203/07/J067; GA MŠk LC510 Institutional research plan: CEZ:AV0Z40400503 Keywords : carbon nanotubes * spectroelectrochemistry * radial breathing mode Subject RIV: CG - Electrochemistry Impact factor: 3.396, year: 2008

  16. FEM model based optimization of transducer geometry for photoacoustic imaging

    NARCIS (Netherlands)

    Xia, W.; Piras, D.; van Veldhoven, S.; Prins, C; van Leeuwen, Ton; Steenbergen, Wiendelt; Manohar, Srirang

    2012-01-01

    We optimize the design of an ultrasound transducer for photoacoustic breast imaging using FEM analysis. We arrive at a detector design which shows significant improvement in image quality when used in photoacoustic tomographic simulations.

  17. 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.

  18. 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 well-suited...... growth direction criterion by Richard. The applicability of the implemented approach is validated against a previously published experimental result, which tests a mixed mode I + III fatigue loading of a modified CT specimen. The proposed approach may be used as a computational framework for modeling...

  19. Beregning av lokk, håndberegningsmetoder versus FEM

    OpenAIRE

    Bruder, Ørjan Myklestad

    2014-01-01

    Ved dimensjonering av lokk benyttes vanligvis elementmetoden (FEM) til å fastlegge spenning og deformasjon i konstruksjonen. Det finnes flere håndberegningsmetoder for å verifisere FEM-resultatene, men det er lite tilgjengelig litteratur om temaet, og lite er gjort for å sammenligne metodene. IMT ved NMBU ønsker å styrke fagkunnskapen innenfor dette temaet og har derfor initiert denne mastergradsoppgaven. Målsettingen med denne oppgaven har vært å sammenligne ulike håndberegningsformler for ...

  20. 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

  1. 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

  2. Dynamics of a three-level Raman coupled atom interacting with two classical and two quantized modes of the electromagnetic field

    Science.gov (United States)

    Hach, Edwin Ellison, III

    We examine the dynamics of a gas of three level atoms. Each atom is taken to exhibit the so-called lambda configuration. This system has been considered previously by G. S. Agarwal. In the present work we refine and extend these earlier considerations. We assume the atomic system to be driven by two co-propagating, resonant classical fields. We assume the classical fields to be undepleted by the interaction. We further assume that the interaction takes place within an optical cavity which has two modes available to interact with the medium. All atom-field interactions are assumed to occur by way of the electric dipole coupling. Our principal focus is the quantized field which develops within the cavity. We develop a Master equation for the time evolution of this field. We then use this equation to study certain properties of the optical field. In particular, we study the system as it operates near the Rabi side bands for the semi-classical system. We find some evidence for the nonclassical nature of the field in this regime. In the course of developing the general equation of motion for the system we derive results for the resonant semi-classical system. Our approach to this treatment is novel and does reproduce results familiar to those working in Coherent Population Trapping, Lasing Without Inversion and Electromagnetically Induced Transparency . We also present numerical results concerning a system in which a single atom interacts within the cavity. These results are generated by a numerical integration of the Master equation for the system. The integration implements a fourth order Runge-Kutta algorithm. In the single atom system we see clear evidence for such nonclassical effects as quadrature squeezing and photon antibunching. We see throughout this work that inter-mode correlations exist between the cavity photons. It is clearly possible for information to shared between the modes. As such, this system may be worthwhile for study by those interested in

  3. 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).

  4. 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

    Science.gov (United States)

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

    2017-12-01

    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, high quality quantitative vapor-phase infrared spectra of all three isomers over the 6500 - 540 cm-1 range are reported. 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, an arbitrary choice to discuss the Cs conformer for meta-xylene and the C2v conformer for para-xylene is made. Integrated band intensities for all isomers are reported. Using the quantitative infrared data, the global warming potential values of each isomer are determined. Potential bands for atmospheric monitoring are also discussed.

  5. 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.)

  6. Three-beam double stimulated Raman scatterings

    Science.gov (United States)

    Cho, Minhaeng

    2018-01-01

    Two-beam stimulated Raman scattering with pump and Stokes beams is manifest in both the Raman loss of the pump beam and the Raman gain of the Stokes beam, and it has been used in various label-free bioimaging applications. Here, a three-beam stimulated Raman scattering that involves pump, Stokes, and depletion beams is considered, where two stimulated Raman gain-loss processes are deliberately made to compete with each other. It is shown that the three-beam Raman scattering process can be described by coupled differential equations for the increased numbers of Stokes and depletion beam photons. From approximate solutions of the coupled differential equations and numerical calculation results, it is shown that a highly efficient suppression of the Stokes Raman gain is possible by using an intense depletion beam whose frequency difference from that of the pump beam is identical to another acceptor Raman mode frequency. I anticipate that the present work will provide a theoretical framework for super-resolution stimulated Raman scattering microscopy.

  7. 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.

  8. 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

  9. Resonance Raman study of benzyl radical

    DEFF Research Database (Denmark)

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

    1992-01-01

    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...

  10. 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)

  11. Detection of biologically active diterpenoic acids by Raman Spectroscopy

    DEFF Research Database (Denmark)

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

    2010-01-01

    is not suitable for their unambiguous identification, especially not in solution. We attempted to increase the sensitivity by applying UV-resonance Raman spectroscopy and surface-enhanced Raman spectroscopy (SERS) techniques. The UV-Raman spectra of the three compounds in ethanol/water 50 : 50 showed only very......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...

  12. An assessment of spacecraft target mode selection methods

    Science.gov (United States)

    Mercer, J. F.; Aglietti, G. S.; Remedia, M.; Kiley, A.

    2017-11-01

    Coupled Loads Analyses (CLAs), using finite element models (FEMs) of the spacecraft and launch vehicle to simulate critical flight events, are performed in order to determine the dynamic loadings that will be experienced by spacecraft during launch. A validation process is carried out on the spacecraft FEM beforehand to ensure that the dynamics of the analytical model sufficiently represent the behavior of the physical hardware. One aspect of concern is the containment of the FEM correlation and update effort to focus on the vibration modes which are most likely to be excited under test and CLA conditions. This study therefore provides new insight into the prioritization of spacecraft FEM modes for correlation to base-shake vibration test data. The work involved example application to large, unique, scientific spacecraft, with modern FEMs comprising over a million degrees of freedom. This comprehensive investigation explores: the modes inherently important to the spacecraft structures, irrespective of excitation; the particular 'critical modes' which produce peak responses to CLA level excitation; an assessment of several traditional target mode selection methods in terms of ability to predict these 'critical modes'; and an indication of the level of correlation these FEM modes achieve compared to corresponding test data. Findings indicate that, although the traditional methods of target mode selection have merit and are able to identify many of the modes of significance to the spacecraft, there are 'critical modes' which may be missed by conventional application of these methods. The use of different thresholds to select potential target modes from these parameters would enable identification of many of these missed modes. Ultimately, some consideration of the expected excitations is required to predict all modes likely to contribute to the response of the spacecraft in operation.

  13. IAR-99 GVT CORRELATION FOR DYNAMICS STORES FEM

    Directory of Open Access Journals (Sweden)

    Radu BÎSCĂ

    2011-03-01

    Full Text Available In this presentation, we will concentrate on typical Ground Vibration Test (GVT and FiniteElement (FE comparisons software. It is necessary to note, that standard GVT are obligatory for anynew aircraft configuration. We can mention here the investigations of the IAR-99, modern trainer andground attack aircraft, using PRODERA® GVT equipment. A Finite Element Model (FEM of the IAR-99 has been developed in PATRAN/NASTRAN®, partly from a previous ANSYS® model. FEM can beused to investigate potential structural modifications or changes with realistic component corrections.Model validation should be part of every modern engineering analysis and quality assuranceprocedure.

  14. Novel Techniques using FEM for Material Production and Processing

    CERN Document Server

    Al-Shammaa, A I; Shaw, A; Stuart, R A; Wright, C C; Houghton, M

    2005-01-01

    The objectives of this European project are to use high frequency microwave technology to develop focussed energy sources for industrial applications. The microwaves, generated in the 10GHz to 20GHz frequency range by using a table top FEM has been used to investigate novel solutions for material processing and material production, including microwave heating of substrates, microwave chemistry for increasing the speed of thermal reactions, microwave plasma chemistry for aiding gaseous reactions in the reduction of combustion pollutants and the production of UV/ozone for germicidal activities. In this paper we report unique results and analysis in using tuneable FEM system compared with the conventional magnetron 2.45 GHz system.

  15. Nanoscale Stress Field Evaluation with Shallow Trench Isolation Structure Assessed by Cathodoluminescence Spectroscopy, Raman Spectroscopy, and Finite Element Method Analyses

    Science.gov (United States)

    Kodera, Masako; Iguchi, Tadashi; Tsuchiya, Norihiko; Tamura, Mizuki; Kakinuma, Shigeru; Naka, Nobuyuki; Kashiwagi, Shinsuke

    2008-04-01

    Stress engineering related to the LSI process is required. With shallow trench isolation (STI) structures, a high stress field causes a variation in electrical characteristics. Although stress fields in a Si substrate can be detected by Raman spectroscopy, no effective technique has been reported for the measurement of nanoscale stress fields in a dielectric material used for STI filling. Recently, we have reported that “cathodoluminescence (CL) spectroscopy” enables us to detect nanometer-scale stress fields in LSI structures. In this study, we performed the first estimation of the stress fields with a STI structure by CL and Raman spectroscopy, as well as finite element method (FEM) calculation. We were able to repeatedly acquire clear stress distributions by CL and Raman spectroscopy. Moreover, CL, Raman, and FEM results showed excellent agreement with one another, revealing that a large variation in stresses along the AA/STI boundary was induced by the intrinsic tensile stress of the SiO2 film.

  16. 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

  17. 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.

  18. 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.

  19. Internal dynamics around static-deformation FEM states

    NARCIS (Netherlands)

    Ligterink, N.E.

    2005-01-01

    Constant velocity or constant force FEM solutions are static-deformation states, where the elastic deformation is stationary. These are the typical operation conditions. Time-dependence, or fluctuations, of the static-deformation states are treated as perturbations, leading to a fast-converging

  20. Considerations regarding asynchronous motor rotor parameters determination by FEM

    Directory of Open Access Journals (Sweden)

    Olivian Chiver

    2010-12-01

    Full Text Available The paper presents some considerations about asynchronous motor rotor parameters determination, using software based on finite elements method (FEM. For this, 2D magnetostatic and time harmonic analysis will be realized, at different frequencies, in case of a three phase asynchronous motor.

  1. 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

  2. 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

  3. 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),

  4. 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.

  5. 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,

  6. 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,

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

    Indian Academy of Sciences (India)

    Unknown

    Abstract. The paper discusses the design of a low cost Raman spectrometer. Single- walled nanotubes (SWNT) have been studied to demonstrate the reach of such a system. We observe both the radial-breathing mode (RBM) and the tangential mode from the SWNT. The tube diameters of the SWNT used in these ...

  8. Infrared and Raman Spectroscopic Study of Carbon-Cobalt Composites

    Directory of Open Access Journals (Sweden)

    André Tembre

    2011-01-01

    Full Text Available Analysis of carbon-cobalt thin films using infrared spectroscopy has shown existence of carbon-cobalt stretching mode and great porosity. The Raman spectroscopy and high-resolution transmission electron microscopy have been used in order to investigate the microstructure of the films. These films exhibit complex Raman spectra suggesting the presence of amorphous and crystallized phases. The different fractions of phases and the correlation between the atomic bond structures and the Raman features depend on the cobalt content.

  9. Infrared and Raman Spectroscopic Study of Carbon-Cobalt Composites

    OpenAIRE

    André Tembre; Jacques Hénocque; Martial Clin

    2011-01-01

    Analysis of carbon-cobalt thin films using infrared spectroscopy has shown existence of carbon-cobalt stretching mode and great porosity. The Raman spectroscopy and high-resolution transmission electron microscopy have been used in order to investigate the microstructure of the films. These films exhibit complex Raman spectra suggesting the presence of amorphous and crystallized phases. The different fractions of phases and the correlation between the atomic bond structures and the Raman feat...

  10. 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.

  11. 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.

  12. Similitude Conditions Modeling Geosynthetic-Reinforced Piled Embankments Using FEM and FDM Techniques

    OpenAIRE

    Jennings, Keith; Naughton, Patrick J.

    2012-01-01

    The numerical modelling of geosynthetic-reinforced piled embankments using both the finite element method (FEM) and finite difference method (FDM) are compared. Plaxis 2D (FEM) was utilized to replicate FLAC (FDM) analysis originally presented by Han and Gabr on a unit cell axisymmetric model within a geosynthetic reinforced piled embankment (GRPE). The FEM and FED techniques were found to be in reasonable agreement, in both characteristic trend and absolute value. FEM consistently replicated...

  13. 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 ...

  14. Low-frequency Raman scattering in alkali tellurite glasses

    Indian Academy of Sciences (India)

    Wintec

    TeO3 units with a varying number of non-bridging oxygen atoms. Emphasis has also been given to the low- frequency modes and particular points related to the low-frequency Raman phenomenology are discussed in view of the experimental findings. Keywords. Tellurites; Raman spectroscopy; alkali tellurite glasses. 1.

  15. 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.

  16. [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.

  17. Capabilities of Using Fem in Sheet-Metal Forming

    Directory of Open Access Journals (Sweden)

    Korga S.

    2016-06-01

    Full Text Available The aim of this study was to determine and select boundary conditions of modeling and FEM simulation for plastic processing on the example of sheet-metal forming. For sheet-metal deformation analysis, Deform 3D has been used. The study presents research methods for real and virtual conditions. There are also described common features and these differentiating obtained results. Research of conducted process of sheet-metal forming allows to determine the effectiveness of computer research methods. The finite-element method can be used as an effective tool for the study of plastic processing phenomena considering various operating conditions of individual elements provided the appropriate tools for FEM analysis.

  18. 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.

  19. 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

  20. 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.

  1. 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...

  2. CORRECTING ACCOUNTING RESULTS OF TENSIONS USING FEM BY HSS METHOD

    Directory of Open Access Journals (Sweden)

    D. O. Bannikov

    2011-05-01

    Full Text Available The usage of the Hot Spot Stress (HSS method by means of linear surface extrapolation (LSE approach was analyzed for the correction of results of the Finite-Element Method (FEM in case of singularity of stresses. The given examples of structures and testing examples were computed on the base of design-and-computation software SCAD for Windows (version 11.3.

  3. 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.

  4. CFD and FEM Model of an Underwater Vehicle Propeller

    Directory of Open Access Journals (Sweden)

    Chruściel Tadeusz

    2014-10-01

    Full Text Available Within the framework of the project for design and optimization of the Remotely Operated Vehicle (ROV, research on its propulsion has been carried out. Te entire project was supported by CFD and FEM calculations taking into account the characteristics of the underwater vehicle. One of the tasks was to optimize the semi-open duct for horizontal propellers, which provided propulsion and controllability in horizontal plane. In order to create a measurable model of this task it was necessary to analyze numerical methodology of propeller design, along with the structure of a propellers with nozzles and contra-rotating propellers. It was confronted with theoretical solutions which included running of the analyzed propeller near an underwater vehicle. Also preliminary qualitative analyses of a simplified system with contra-rotating propellers and a semi-open duct were carried out. Te obtained results enabled to make a decision about the ROVs duct form. Te rapid prototyping SLS (Selective Laser Sintering method was used to fabricate a physical model of the propeller. As a consequence of this, it was necessary to verify the FEM model of the propeller, which based on the load obtained from the CFD model. Te article contains characteristics of the examined ROV, a theoretical basis of propeller design for the analyzed cases, and the results of CFD and FEM simulations.

  5. INNOVATION OF DOCTORAL STUDIES AT THE FEM CULS PRAGUE

    Directory of Open Access Journals (Sweden)

    FLÉGL, Martin

    2013-12-01

    Full Text Available Research results and university performance measures have been frequently discussed topic in the Czech higher education system. Performance can be improved by establishing innovations in education in many areas. At higher education sector the performance within research activities is of the same importance. Various authorities have been making an effort to establish a set of measures to assess research performance at institutional level. This paper focuses on the assessment of research activity within an institution – the Faculty of Economics and Management (FEM, Czech University of Life Sciences (CULS Prague – with the use of Data Envelopment Analysis model (DEA. The measured units (DMUs are 12 FEM departments. Based on the findings revealed by the DEA model application various measures adopted by the faculty in order to improve research and education performance are introduced. Following the widespread trend in many countries the focus of the effort is in training of university teachers and students. This aim is being partially accomplished by the Project Operational Program Prague – Adaptability (OPPA, which is focused on the innovation of the Ph.D. studies at the FEM. The main project aims are i to improve students’ research experiences, ii to provide appropriate conditions for Ph.D. students at the departments/faculty and iii to launch tools for better communication among Ph.D. students and their supervisors.

  6. 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.

  7. Raman-Kerr frequency combs in microresonators with normal dispersion.

    Science.gov (United States)

    Cherenkov, A V; Kondratiev, N M; Lobanov, V E; Shitikov, A E; Skryabin, D V; Gorodetsky, M L

    2017-12-11

    We generalize the coupled mode formalism to study the generation of frequency combs in microresonators with simultaneous Raman and Kerr nonlinearities and investigate an impact of the former on the formation of frequency combs and dynamics of platicons in the regime of the normal group velocity dispersion. We demonstrate that the Raman effect initiates generation of sidebands, which cascade further in four-wave mixing and reshape into the Raman-Kerr frequency combs. We reveal that the Raman scattering induces a strong instability of the platicon pulses associated with the Kerr effect and normal dispersion. This instability results in branching of platicons and complex spatiotemporal dynamics.

  8. Coherent Raman spectroscopy

    CERN Document Server

    Eesley, G L

    1981-01-01

    Coherent Raman Spectroscopy provides a unified and general account of the fundamental aspects of nonlinear Raman spectroscopy, also known as coherent Raman spectroscopy. The theoretical basis from which coherent Raman spectroscopy developed is described, along with its applications, utility, and implementation as well as advantages and disadvantages. Experimental data which typifies each technique is presented. This book is comprised of four chapters and opens with an overview of nonlinear optics and coherent Raman spectroscopy, followed by a discussion on nonlinear transfer function of matter

  9. Modern Trends in Imaging VI: Raman Scattering in Pathology

    Directory of Open Access Journals (Sweden)

    Zachary J. Smith

    2012-01-01

    Full Text Available Raman scattering is the inelastic scattering of light by chemical bonds, and can therefore show molecular specificity. It can be used both in pure spectroscopy mode, and in imaging mode. While many applications of Raman spectroscopy and imaging in the biomedical field have been so far demonstrated, the use of this technology for pathology applications is still in early stages. In this paper we review some of the most important recent developments in this field, including a description of relevant technologies, applications to molecular sensing, characterization of cells and tissues of interest, and disease detection via Raman scattering.

  10. Enhancement of Raman scattering in dielectric nanostructures with electric and magnetic Mie resonances

    Science.gov (United States)

    Frizyuk, Kristina; Hasan, Mehedi; Krasnok, Alex; Alú, Andrea; Petrov, Mihail

    2018-02-01

    Resonantly enhanced Raman scattering in dielectric nanostructures has been recently proven to be an efficient tool for nanothermometry and for the experimental determination of their mode composition. In this paper we develop a rigorous analytical theory based on the Green's function approach to calculate the Raman emission from crystalline high-index dielectric nanoparticles. As an example, we consider silicon nanoparticles which have a strong Raman response due to active optical phonon modes. We relate enhancement of Raman signal emission to the Purcell effect due to the excitation of Mie modes inside the nanoparticles. We also employ our numerical approach to calculate inelastic Raman emission in more sophisticated geometries, which do not allow a straightforward analytical form of the Green's function. The Raman response from a silicon nanodisk has been analyzed with the proposed method, and the contribution of various Mie modes has been revealed.

  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. Fem1b promotes ubiquitylation and suppresses transcriptional activity of Gli1.

    Science.gov (United States)

    Gilder, Andrew S; Chen, Yong-Bin; Jackson, Ramon J; Jiang, Jin; Maher, Joseph F

    2013-10-25

    The mammalian Fem1b gene encodes a homolog of FEM-1, a protein in the sex-determination pathway of the nematode Caenorhabditis elegans. Fem1b and FEM-1 proteins each contain a VHL-box motif that mediates their interaction with certain E3 ubiquitin ligase complexes. In C. elegans, FEM-1 negatively regulates the transcription factor TRA-1, and functions as an E3 ubiquitin ligase substrate recognition subunit to target TRA-1 for ubiquitylation. TRA-1 is homologous to the mammalian Gli1 protein, a transcription factor that mediates Hedgehog signaling as well as having Hedgehog-independent functions. Whether the interaction between nematode FEM-1 and TRA-1 proteins is conserved, between corresponding mammalian homologs, has not been reported. Herein, we show that Fem1b interacts with Gli1 within cells, and directly binds Gli1. Fem1b also promotes ubiquitylation of Gli1, suppresses transcriptional activation by Gli1, and attenuates an oncogenic Gli1 autoregulatory loop in cancer cells, all dependent on the VHL-box of Fem1b. These findings have implications for understanding the cellular functions of Fem1b, and the regulation of Gli1 oncoprotein activity. Copyright © 2013 Elsevier Inc. All rights reserved.

  14. Remote Raman Efficiencies and Cross-Sections of Organic and Inorganic Chemicals.

    Science.gov (United States)

    Acosta-Maeda, Tayro E; Misra, Anupam K; Porter, John N; Bates, David E; Sharma, Shiv K

    2017-05-01

    We determined Raman cross-sections of various organic liquids and inorganic polyatomic ions in aqueous solutions with a 532 nm pulsed laser using remote Raman systems developed at the University of Hawaii. Using a calibrated integrating sphere as a light source, we converted the intensity counts in the spectrum of the light from the integrating sphere measured with UH remote Raman instrument to spectral radiance. From these data, a response function of the remote Raman instrument was obtained. With the intensity-calibrated instrument, we collected remote Raman data from a standard 1 mm path length fused silica spectrophotometer cell filled with cyclohexane. The measured value of the differential Raman cross-section for the 801 cm -1 vibrational mode of cyclohexane is 4.55 × 10 -30 cm 2 sr -1 molecule -1 when excited by a 532 nm laser, in good agreement with the values reported in the literature. Using the measured cyclohexane Raman cross-section as a reference and relative Raman mode intensities of the various ions and organic liquids, we calculated the Raman cross-sections of the strongest Raman lines of nitrate, sulfate, carbonate, phosphate ions, and organic liquids by maintaining same experimental conditions for remote Raman detection. These relative Raman cross-section values will be useful for estimating detection capabilities of remote Raman systems for planetary exploration.

  15. 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.

  16. FEM simulation of CMUT cell for NDT application

    Science.gov (United States)

    Aditi, .; Mukhiya, Ravindra; Gopal, Ram; Khanna, V. K.

    2012-10-01

    This paper presents the simulation of various electromechanical performance parameters for an efficient and broadband air coupled Capacitive Micromachined Ultrasonic Transducer (CMUT) for Non Destructive Testing and Evaluation (NDT/NDE) using FEM simulation tool, Coventor Ware. The non contact ultrasonic inspection performed in ambient air reduces the complexity and cost. Various critical parameters like collapse voltage, resonant frequency, coupling coefficient, squeeze film damping, bandwidth, quality factor and transient response of the single cell of CMUT are discussed. We employ a hexagonal CMUT cell for the modeling to improve the CMUT's transmission/reception efficiency as the average membrane displacement is high.

  17. 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.

  18. 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

  19. Asperity Degradation and Damage in the Direct Shear Test: A Hybrid FEM/DEM Approach

    Science.gov (United States)

    Karami, A.; Stead, D.

    2008-04-01

    This paper investigates the processes of joint surface damage and near-surface intact rock tensile failure using a hybrid FEM/DEM code. Selected Barton and Choubey JRC profiles were simulated in direct shear tests and the surface damage mechanisms investigated in terms of joint surface wear or tensile fracturing of intact rock along the joint plane. Shear strength and displacement profiles for each joint profile are numerically simulated. Numerical results agree closely with published experimental observations. Furthermore, results show that dilation along the joint is controlled dominantly by the joint surface geometry and the applied normal stress. Significant dilation is expected to occur where there is a large asperity provided the applied normal stress is low. In this case, joint surface damage is limited to surface wear. In contrast, when the applied normal stress is high, dilation will be low and damage is composed of both surface wear and asperity breakage through near-joint-surface intact rock tensile failure. Local joint dilation angles vary in proportion to the magnitude of the dilation. Several joint profiles with different geometrical configurations were simulated within a slope and the possible modes of joint surface damage were investigated. It was found that due to low normal stresses acting on the joint surfaces within a slope the dominant mode of joint surface damage is by yielding and surface wear of asperities.

  20. FEM modelling of firing temperature and stress zones

    Energy Technology Data Exchange (ETDEWEB)

    Schulle, W.; Schultz, K. [Bergakademie Freiberg (Germany)

    1999-03-01

    In the introduction, the principal possibilities of using finite element modelling (FEM) for problem solving in the firing processes of ceramics are given. Subsequently, two concrete application examples are described. In the first example, the temperature and stress calculation during biscuit firing of porcelain is discussed. The results are given for the influence of the heating rate for stacked firing and single-layer firing of flat tableware, the influence of the positioning of the individual plates in the plate stack, and changes in shape of the article during the formation of temperature and stress fields could be estimated. In a second example, the heat stresses that arise during the firing of high voltage insulators were calculated. It can be shown how the progression of the stresses is influenced by the body geometry, especially with the insulators ''cup'' design. During the course of the firing process, a regulating influence is possible. The examples should encourage further problem solving by specific use of FEM. (orig.)

  1. 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.

  2. 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......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...

  3. Raman spectrometric studies of selected lanthanide tribromides and trichlorides

    International Nuclear Information System (INIS)

    Daniel, J.F.

    1988-03-01

    Laser Raman spectroscopy was used to identify the crystal structures of lanthanide and actinide compounds. The phonon Raman spectrum is characteristic of the particular crystal structure. GdCl 3 exhibits two crystal structures, the UCl 3 -type hexagonal and the PuBr 3 -type orthorhombic. In the literature it is reported that the low temperature form is orthorhombic; results of experiments here suggest that it is hexagonal. Interconversion between these two forms can be accomplished with temperature andor pressure. In the present work laser Raman spectrometry was used to monitor crystal structure changes in GdCl 3 as a function of temperature or pressure to determine the temperature or pressure at which the hexagonal-to-orthorhombic transformation occurs. Raman spectroscopy was also used to determine the symmetry assignments for the Raman-active bands of a single crystal. Raman spectra of polycrystalline NdBr 3 have been recorded at room temperature and pressure and at approximately 100/degree/K. In addition, polarized Raman spectra of a single crystal NdBr 3 have been measured. Based on these polarization measurements, symmetry assignments of eight Raman-active modes were made. These assignments are useful in interpreting the phonon Raman spectrum of any compound exhibiting the PuBr 3 -type orthorhombic structure. 24 figs., 5 tabs

  4. 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.

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

    Indian Academy of Sciences (India)

    1/)( /) 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. The values of ...

  6. V V Raman

    Indian Academy of Sciences (India)

    Home; Journals; Resonance – Journal of Science Education. V V Raman. Articles written in Resonance – Journal of Science Education. Volume 13 Issue 6 June 2008 pp 596-605 Reflections. The Scientific Enterprise - Science: Some Definitions and Views · V V Raman · More Details Fulltext PDF. Volume 13 Issue 8 August ...

  7. Raman crystallography of RNA.

    Science.gov (United States)

    Gong, Bo; Chen, Jui-Hui; Yajima, Rieko; Chen, Yuanyuan; Chase, Elaine; Chadalavada, Durga M; Golden, Barbara L; Carey, Paul R; Bevilacqua, Philip C

    2009-10-01

    Raman crystallography is the application of Raman spectroscopy to single crystals. This technique has been applied to a variety of protein molecules where it has provided unique information about biopolymer folding, substrate binding, and catalysis. Here, we describe the application of Raman crystallography to functional RNA molecules. RNA represents unique opportunities and challenges for Raman crystallography. One issue that confounds studies of RNA is its tendency to adopt multiple non-functional folds. Raman crystallography has the advantage that it isolates a single state of the RNA within the crystal and can evaluate its fold, metal ion binding properties (ligand identity, stoichiometry, and affinity), proton binding properties (identity, stoichiometry, and affinity), and catalytic potential. In particular, base-specific stretches can be identified and then associated with the binding of metal ions and protons. Because measurements are carried out in the hanging drop at ambient, rather than cryo, conditions and because RNA crystals tend to be approximately 70% solvent, RNA dynamics and conformational changes become experimentally accessible. This review focuses on experimental setup and procedures, acquisition and interpretation of Raman data, and determination of physicochemical properties of the RNA. Raman crystallographic and solution biochemical experiments on the HDV RNA enzyme are summarized and found to be in excellent agreement. Remarkably, characterization of the crystalline state has proven to help rather than hinder functional characterization of functional RNA, most likely because the tendency of RNA to fold heterogeneously is limited in a crystalline environment. Future applications of Raman crystallography to RNA are briefly discussed.

  8. Karthik Raman Nagasuma Chandra

    Indian Academy of Sciences (India)

    Karthik Raman1 Nagasuma Chandra2. Department of Biochemistry, University of Zurich, Winterthurerstrasse 190, CH-8057, Switzerland; Bioinformatics Centre, Raman building, Indian Institute of Science, Bangalore 560 012, India. Resonance – Journal of Science Education. Current Issue : Vol. 23, Issue 2. Current Issue

  9. 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...

  10. Raman spectra of acoustooptic NaBi(MoO4)2 crystals

    International Nuclear Information System (INIS)

    Moiseenko, V.N.; Bogatyrev, Yu.I.; Eremenko, A.M.; Akimov, S.V.

    2000-01-01

    Raman spectra of NaBi(MoO 4 ) 2 single crystals are measured and the frequencies of phonon modes are determined using a fitting procedure. The symmetry species are found by selection rules. The interpretation of the Raman spectra is made in terms of the influence of defects: Mo nonstoichiometry and disordered structure in dispositions of Na + and Bi 3+ ions. The peculiarity of Raman spectra is their large Raman scattering efficiency. The obtained value of the Raman scattering cross-section is 10 3 times more than that in CaCo 3 crystals. It can be a reason for a high acoustooptic efficiency of this material

  11. Reliability of cranes built to European (FEM) regulations

    International Nuclear Information System (INIS)

    Biot, Dominique; Stoufflet, Rene

    1987-01-01

    Safety regulations used in French nuclear reprocessing plants require that load dropping hazards induced by cranes be kept under allowable limits. The aim of this article is to present the evaluation of the load dropping occurrence rate for standard cranes built according to European regulations. The failure rate of each component is evaluated by stress and strength computation or determined using information from reliability data banks. This article considers two types of hoisting system: a simple (non-redundant) system that has only one load brake and a system identical to the above but fitted with an additional safety brake located as close as possible to the rope drum. The study refers to examples of cranes that SGN has had installed at nuclear facilities in France and covers all classes of cranes defined in FEM rules. (author)

  12. FEM and BIEM - A new infinite hybrid finite element

    International Nuclear Information System (INIS)

    Drakaliev, P.

    1993-01-01

    The finite element method (MFE) and the boundary integral equation method (BIEM) are general approximation procedures applicable to a wide variety of engineering problems. Each of them has many variants and each possesses certain merits and limitations of its own. The FEM may be easier to apply in domains with anisotropic or nonlinear behaviour. On the other hand the BEM is more attractive for unbounded domains or regions of high stress concentration. Therefore, the idea of combining both numerical techniques is of great interest in many practical problems, especially in solid and fluid mechanics, such as soil-structure and structure-fluid interaction problems. In the developments to follow an energy approach for symmetrizing the indirect BIEM is being used to obtain the stiffness matrix for the infinite or semi-infinite elastic medium. Thus the subdomain is considered as an infinite super element with an arbitrary shaped boundary and can be easily implemented into existing finite element codes

  13. DFT study on the Raman spectra of Fe(II-porphin

    Directory of Open Access Journals (Sweden)

    Hovorun D. M.

    2009-02-01

    Full Text Available DFT quantum-chemical calculations of the Raman spectra of Fe(II-porphin in quintet (ground state were performed. Spin-unrestricted UB3LYP functional in 6-311G basis was used for geometry optimization and Raman calculation. All active modes of Raman spectrum were analyzed in detail. It was noted that the insertion of Fe(II ion into porphin leads to the considerable changes in frequencies and intensities for those vibrational modes which involve nitrogen atoms displacement. The Raman depolarization ratio for plane polarized incident light is discussed

  14. CT image segmentation using FEM with optimized boundary condition.

    Directory of Open Access Journals (Sweden)

    Hiroyuki Hishida

    Full Text Available The authors propose a CT image segmentation method using structural analysis that is useful for objects with structural dynamic characteristics. Motivation of our research is from the area of genetic activity. In order to reveal the roles of genes, it is necessary to create mutant mice and measure differences among them by scanning their skeletons with an X-ray CT scanner. The CT image needs to be manually segmented into pieces of the bones. It is a very time consuming to manually segment many mutant mouse models in order to reveal the roles of genes. It is desirable to make this segmentation procedure automatic. Although numerous papers in the past have proposed segmentation techniques, no general segmentation method for skeletons of living creatures has been established. Against this background, the authors propose a segmentation method based on the concept of destruction analogy. To realize this concept, structural analysis is performed using the finite element method (FEM, as structurally weak areas can be expected to break under conditions of stress. The contribution of the method is its novelty, as no studies have so far used structural analysis for image segmentation. The method's implementation involves three steps. First, finite elements are created directly from the pixels of a CT image, and then candidates are also selected in areas where segmentation is thought to be appropriate. The second step involves destruction analogy to find a single candidate with high strain chosen as the segmentation target. The boundary conditions for FEM are also set automatically. Then, destruction analogy is implemented by replacing pixels with high strain as background ones, and this process is iterated until object is decomposed into two parts. Here, CT image segmentation is demonstrated using various types of CT imagery.

  15. 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.

  16. 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

  17. 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)

  18. Non-traditional whispering gallery modes inside microspheres visualized with Fourier analysis

    NARCIS (Netherlands)

    Chang, Lantian; Timmermans, Frank; Otto, Cees

    2017-01-01

    Non-traditional whispering gallery modes are studied in a glass microsphere. Geometrical ray tracing is used to explain and calculate these modes. Thermal emission and Raman scattering are used as an internal light source to excite these modes inside the glass microsphere. The thermal and Raman

  19. In-situ Raman Spectroelectrochemistry on Fullerene Peapods

    Science.gov (United States)

    Kavan, Ladislav; Dunsch, Lothar; Kataura, Hiromichi

    2002-10-01

    The population of valence-band electronic states of fullerene peapods (C60@SWCNT) was tuned electrochemically in acetonitrile medium. Electrochemical charging caused reversible bleaching of the transitions between Van Hove singularities. The bleaching was mirrored by quenching of resonance Raman spectra of the tube-related modes. The Ag(2) mode of C60 exhibited considerable intensity increase upon anodic doping of peapods, but this mode was not enhanced at cathodic charging.

  20. 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.

  1. 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.

  2. 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.

  3. The resonance Raman excitation profile of lutein

    Science.gov (United States)

    Hoskins, L. C.

    The resonance Raman excitation profiles for the ν 1, ν 2 and ν 3 vibrations of lutein in acetone, toluene and carbon disulfide solvents have been measured. The results are interpreted in terms of a three-mode vibrational theory which includes both homogeneous and inhomogeneous broadening effects. Excellent agreement between calculated and observed excitation profiles and visible spectra was found in acetone and toluene, but the results in carbon disulfide indicate a possible breakdown in the three-mode model. The major broadening mechanism is homogeneous, with about a 25% contribution from inhomogeneous broadening.

  4. 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)

  5. 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.

  6. A mass-redistributed finite element method (MR-FEM) for acoustic problems using triangular mesh

    Science.gov (United States)

    He, Z. C.; Li, Eric; Liu, G. R.; Li, G. Y.; Cheng, A. G.

    2016-10-01

    The accuracy of numerical results using standard finite element method (FEM) in acoustic problems will deteriorate with increasing frequency due to the ;dispersion error;. Such dispersion error depends on the balance between the ;stiffness; and ;mass; of discretization equation systems. This paper reports an improved finite element method (FEM) for solving acoustic problems by re-distributing the mass in the mass matrix to ;tune; the balance, aiming to minimize the dispersion errors. This is done by shifting the integration point locations when computing the entries of the mass matrix, while ensuring the mass conservation. The new method is verified through the detailed numerical error analysis, and a strategy is also proposed for the best mass redistribution in terms of minimizing dispersion error. The relative dispersion error of present mass-redistributed finite element method (MR-FEM) is found to be much smaller than the FEM solution, in both theoretical prediction and numerical examination. The present MR-FEM works well by using the linear triangular elements that can be generated automatically, which enables automation in computation and saving computational cost in mesh generation. Numerical examples demonstrate the advantages of MR-FEM, in comparison with the standard FEM using the same triangular meshes and quadrilateral meshes.

  7. 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.

  8. Triplet State Resonance Raman Spectrum of all-trans-diphenylbutadiene

    DEFF Research Database (Denmark)

    Wilbrandt, Robert Walter; Grossman, W.E.L.; Killough, P.M

    1984-01-01

    The resonance Raman spectrum of all-trans-diphenylbutadiene (DPB) in its ground state and the resonance Raman spectrum (RRS) of DPB in its short-lived electronically excited triplet state are reported. Transient spectra were obtained by a pump-probe technique using two pulsed lasers....... The preresonance spectrum of the ground state is not significantly changed from that of the nonresonance spectrum. In the resonance spectrum of the triplet state the double-bond stretching mode of the butadiene part is shifted by 43 cm-1 downward to 1582 cm-1 whereas the single-bond stretching mode is essentially...

  9. 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.

  10. 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.

  11. Identification of Soil Models by Simulation of Ground Anchor Tests, Using FEM

    OpenAIRE

    Aliciuc, Constantin-Lucian; Muşat, Vasile

    2013-01-01

    Several types of soil models have been developed during time in order to simulate the soil behavior in finite element (FEM) analysis, so choosing the right soil model has a great importance on results. This study presents a method to establish the most suitable soil model used in FEM in order to calculate a temporary anchored retaining structure, method which is based on field tests. The test fields are simulated with FEM and are used several types of soil models, taken into consideration the...

  12. 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.

  13. 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

  14. 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.

  15. Two-dimensional analysis of spurious modes in aluminum nitride film resonators.

    Science.gov (United States)

    Gong, Xun; Han, Min; Shang, Xiaoli; Xiong, Jun; Duan, Jie; Sekimoto, Hitoshi

    2007-06-01

    In this paper, a hybrid method, which combines the traditional concept of guided waves and the finite element method (FEM), is proposed to analyze the spurious modes of aluminum nitride (AIN) film with electrodes. First, the guided wave modes in the plated area are obtained by 1-D FEM. Second, a mode-match method is used to satisfy the boundary conditions. The vibration of the film resonator is a superposition of all of the guided modes. With respect to an A1N film resonator, which is a thickness-stretch mode resonator, we have identified three families of spurious modes: extension, thickness-stretch, and thickness-shear. The spectrum of spurious modes is calculated and the influence of the spurious modes is discussed.

  16. Metrological Array of Cyber-Physical Systems. Part 8. Elaboration of Raman Method

    Directory of Open Access Journals (Sweden)

    Bohdan STADNYK

    2015-06-01

    Full Text Available The work presents experimental investigations of Raman method for different objects. In particular, there are performed the modeling, estimation and defining the Raman wavelengths shift. A number of modes to improve the accuracy and reduce measurement uncertainty are studied.

  17. 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

  18. Raman and Surface Enhanced Raman of Biological Material

    National Research Council Canada - National Science Library

    Guicheteau, Jason A; Gonser, Kristina; Christesen, Steven Dale

    2004-01-01

    .... Vibrational spectroscopic methods such as Raman and surface enhanced Raman scattering (SERS) provide rapid detailed fingerprint information about the molecular composition of biomaterial in a non-destructive manner...

  19. HIRENASD Comparisons of FEM modal frequencies and modeshapes

    Data.gov (United States)

    National Aeronautics and Space Administration — Below are frequency comparisons of different models with experiment Note Modeshapes aren't very descriptive for higher modes. There is coupling between them so this...

  20. FEM/SINDA: Combining the strengths of NASTRAN, SINDA, I-DEAS, and PATRAN for thermal and structural analysis

    Science.gov (United States)

    Zarda, P. Richard; Anderson, Ted; Baum, Fred

    1993-01-01

    This paper describes the interface/integration between FEM/SINDA, a general purpose geometry driven thermal analysis code, and the FEM software: I-DEAS, PATRAN, and NASTRAN. FEM/SINDA brings together the advantages of the finite element method to model arbitrary geometry and anisotropic materials and SINDA's finite difference capability to model thermal properties, loads, and boundary conditions that vary with time or temperature. I-DEAS and PATRAN thermal entities are directly supported since FEM/SINDA uses the nodes of the FEM model as the point at which the temperature is determined. Output from FEM/SINDA (as well as the FEM/SINDA input deck) can be used directly by NASTRAN for structural analysis.

  1. Polarized Raman scattering of epitaxial vanadium dioxide films with low-temperature monoclinic phase

    Science.gov (United States)

    Shibuya, Keisuke; Sawa, Akihito

    2017-07-01

    A polarized Raman scattering study was carried out on epitaxial VO2 thin films on MgF2(001) and (110) substrates to investigate the Raman symmetry and tensor elements of the phonon modes of the films in a low-temperature monoclinic phase. From the polarization angular dependence of the Raman intensity, we assigned the phonon modes at 137, 194, 310, 340, 499, 612, and 663 cm-1 to Ag symmetry and the phonon modes at 143, 262, 442, 480, 582, and 820 cm-1 to Bg symmetry. The angular-dependence measurements also revealed that two phonon modes with Ag and Bg symmetries are present at about 224 and 393 cm-1, although only a single peak was observed in the Raman spectra at around these wavenumbers. On the basis of the experimental results, we evaluated the Raman tensors of the identified phonon modes. From the Raman tensors, we found that the atomic displacements of the 194 and 340 cm-1 phonon modes are approximately perpendicular and parallel, respectively, to the V-V dimer direction. This is consistent with a previous theoretical prediction, i.e., these modes are attributable to the tilting motion and the stretching vibration of the V-V dimers, respectively.

  2. 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)

  3. Raman and surface enhanced Raman spectroscopic investigation on Lamiaceae plants

    Science.gov (United States)

    Rösch, P.; Popp, J.; Kiefer, W.

    1999-05-01

    The essential oils of Thymus vulgaris and Origanum vulgaris are studied by means of micro-Raman spectroscopy. The containing monoterpenes can be identified by their Raman spectra. Further the essential oils are investigated in their natural environment, the so-called oil cells of these Lamiaceae plants, with surface enhanced Raman spectroscopy (SERS). This method has the advantage to enhance Raman signals and furthermore the SERS effect leads to fluorescence quenching.

  4. Raman study on single-walled carbon nanotubes with different laser ...

    Indian Academy of Sciences (India)

    The grown sample is excited with two laser excitation wavelengths, 633 nm from He–Ne laser and 514.5 nm from Ar+ laser. Raman spectrum in the backscattering geometry provides the characteristic spectra of SWCNTs with its radial breathing mode (RBM), defect-induced disorder mode (D band), and highenergy modes ...

  5. Relationship between molecular structure and Raman spectra of quinolines

    Science.gov (United States)

    Frosch, Torsten; Popp, Jürgen

    2009-04-01

    DFT calculations were applied to investigate the relationship between the molecular structure and the Raman spectra of quinolines. A variety of different quinolines with increasing complexity was investigated and an aminoquinoline nucleus was found that describes the Raman spectrum of protonated chloroquine. It was discovered that the biological important, rigid C7-chloro group and C4-side chain of chloroquine significantly disturb certain molecular vibrations. The protonation at the N1 position causes dramatic changes of the Raman bands in the wavenumber region between 1500 cm -1 and 1650 cm -1. These bands are putative marker bands of the aminoquinoline drugs for π-π interactions to the hematin targets in malaria infected cells. The calculation of the normal modes and the illustration of the associated atomic displacements are very valuable for a deeper understanding of the associated bands in the Raman spectra.

  6. 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....

  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. 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 ...

  9. 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)

  10. 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

  11. Raman scattering studies on PEG functionalized hydroxyapatite nanoparticles.

    Science.gov (United States)

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

    2014-01-03

    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. Copyright © 2013 Elsevier B.V. All rights reserved.

  12. High pressure Raman study of BaMoO4

    International Nuclear Information System (INIS)

    Christofilos, D.; Kourouklis, G.A.; Arvanitidis, J.; Kampasakali, E.; Papagelis, K.; Ves, S.

    2004-01-01

    The structural stability of polycrystalline BaMoO 4 under hydrostatic pressure has been investigated by means of Raman spectroscopy up to 8 GPa. Raman spectra reveal a pressure induced phase transition at ∝5.8 GPa. Upon pressure release the structure reverts to its ambient pressure scheelite (CaWO 4 ) structure with no observable hysteresis. The large number of Raman active modes of the high pressure phase suggests either an increase of the size of the unit cell and/or a non-centrosymmetric structure leading to the activation of the ungerade modes of the scheelite structure. (copyright 2004 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  13. Directional surface enhanced Raman scattering on gold nano-gratings

    International Nuclear Information System (INIS)

    Gillibert, Raymond; Yasukuni, Ryohei; Chapelle, Marc Lamy de la; Sarkar, Mitradeep; Bryche, Jean-François; Moreau, Julien; Besbes, Mondher; Canva, Michael; Barbillon, Grégory; Bartenlian, Bernard

    2016-01-01

    Directional plasmon excitation and surface enhanced Raman scattering (SERS) emission were demonstrated for 1D and 2D gold nanostructure arrays deposited on a flat gold layer. The extinction spectrum of both arrays exhibits intense resonance bands that are redshifted when the incident angle is increased. Systematic extinction analysis of different grating periods revealed that this band can be assigned to a propagated surface plasmon of the flat gold surface that fulfills the Bragg condition of the arrays (Bragg mode). Directional SERS measurements demonstrated that the SERS intensity can be improved by one order of magnitude when the Bragg mode positions are matched with either the excitation or the Raman wavelengths. Hybridized numerical calculations with the finite element method and Fourier modal method also proved the presence of the Bragg mode plasmon and illustrated that the enhanced electric field of the Bragg mode is particularly localized on the nanostructures regardless of their size. (paper)

  14. Plasmonic nanopillar structures for surface-enhanced raman scattering applications

    DEFF Research Database (Denmark)

    Rindzevicius, Tomas; Schmidt, Michael Stenbæk; Wu, Kaiyu

    2016-01-01

    Noble metal nanostructures support localized surface plasmon (LSPR) resonances that depend on their dimensions, shapes and compositions. Particle LSPR's can be used to spatially confine the incident light and produce enormous electromagnetic (EM) field enhancement spots, i.e. hot spots. Hot spots...... have been utilized in surfaceenhanced Raman spectroscopy (SERS) for biological and chemical sensing. We present Au nanopillar (NP) SERS structures that are excellent for molecular detection. The NP structures can be fabricated using a simple two-step process. We analyze NP optical properties...... experimentally and theoretically. Simulations show that that a single Agcoated NP supports two LSPR modes, i.e. the particle mode and the Ag cap resonant cavity mode. The Ag cap resonant cavity mode contributes most to the enhancement of the Raman scattering signal. The electric field distribution calculations...

  15. Evidence of low intermolecular coupling in rubrene single crystals by Raman scattering

    International Nuclear Information System (INIS)

    Weinberg-Wolf, J R; McNeil, L E; Liu Shubin; Kloc, Christian

    2007-01-01

    The observed Raman spectra for single crystals of rubrene and tetracene are compared with the calculated spectra for the isolated molecules. The Raman measurements presented are of the bulk properties of the material, and they confirmed that the vapour growth process yields very pure, unstrained rubrene crystals. Finally, Raman measurements indicate that rubrene, unlike many other oligoacenes, has very weak intermolecular coupling and no observable intermolecular Raman vibrational modes. We discuss the apparent conflict between the high mobility and the weak π-electron overlap in this material

  16. Raman spectroscopic study of solid solution spinel oxides

    Science.gov (United States)

    Hosterman, Brian D.

    Solid solution spinel oxides of composition MgxNi1-x Cr2O4, NiFexCr2-xO 4, and FexCr3-xO4 were synthesized and characterized using x-ray diffraction and Raman spectroscopy. Frequencies of the Raman-active modes are tracked as the metal cations within the spinel lattice are exchanged. This gives information about the dependence of the lattice vibrations on the tetrahedral and octahedral cations. The highest frequency Raman-active mode, A1g, is unaffected by substitution of the divalent tetrahedral cation, whereas the lower frequency vibrations are more strongly affected by substitution of the tetrahedral cation. The change in frequency of many phonons is nonlinear upon cation exchange. All detected modes of MgxNi1-xCr2O4 and FexCr3-xO4 exhibit one-mode behavior. Additional modes are detected in NiFexCr2-xO4 due to cation inversion of the spinel lattice. Results from the FexCr3-xO4 spinels are applied to identifying the corrosion layers of several stainless steel samples exposed to lead-bismuth eutectic in a high-temperature, oxygen controlled environment. The Raman spectrum of the outer corrosion layer in all steels is identified as Fe3O4. The position of the A 1g mode for the inner corrosion layer indicates an iron chromium spinel oxide. Micro-Raman spectroscopy proves capable of determining structural and compositional differences between complex corrosion layers of stainless steels.

  17. 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.

  18. Raman imaging and spectroscopy of individual single-wall carbon nanotubes

    Science.gov (United States)

    Zhang, Li

    Single-wall carbon nanotubes (SWNT) are unique one-dimensional materials that are promising for many potential applications in various important areas. Their vibrational properties reflect the electron and phonon confinement as well as the structures of the tubes. Resonant Raman spectroscopy has been proven to be an exceedingly powerful tool for the characterization of the vibrational and electronic properties of SWNTs. This thesis focuses on the study of Raman spectroscopy of individual single carbon nanotubes. Single tube spectroscopy allows probing the structure dependent properties of SWNTs. A beam-scanning confocal Raman microscope system capable of large-area Raman imaging is first developed for characterizing SWNTs at the single tube level. Raman images and first-order Raman spectra of nanotubes, consisting of both semicoducting and metallic nanotubes, are systemically studied at room temperature in ambient air. The diameter of the nanotubes is determined from their radial breathing mode (RBM) frequency. A broad diameter distribution is observed for nanotubes synthesized by chemical vapor deposition. The tangential G mode Raman spectra of individual metallic nanotubes are found to exhibit a broad distribution of line shapes, which is attributed to shift of the Fermi level due to O2 adsorption. The doping dependence of Raman spectra of metallic tubes is further studied by both electrostatic gating and electrochemical gating. Significant changes in the G band Raman spectra of nanotubes are observed, suggesting the effect of doping on electron-phonon interaction. The observation of a gradual evolution of G band spectrum from a semiconducting type to the broad BWF type reveals evidence of phonon interaction between two G band modes. Raman imaging and Raman spectra of isolated SWNTs and single-layer graphenen are investigated at both room temperature and low temperature. The temperature-induced Raman spectral change of individual nanotubes is observed to be tube

  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. [EMD Time-Frequency Analysis of Raman Spectrum and NIR].

    Science.gov (United States)

    Zhao, Xiao-yu; Fang, Yi-ming; Tan, Feng; Tong, Liang; Zhai, Zhe

    2016-02-01

    This paper analyzes the Raman spectrum and Near Infrared Spectrum (NIR) with time-frequency method. The empirical mode decomposition spectrum becomes intrinsic mode functions, which the proportion calculation reveals the Raman spectral energy is uniform distributed in each component, while the NIR's low order intrinsic mode functions only undertakes fewer primary spectroscopic effective information. Both the real spectrum and numerical experiments show that the empirical mode decomposition (EMD) regard Raman spectrum as the amplitude-modulated signal, which possessed with high frequency adsorption property; and EMD regards NIR as the frequency-modulated signal, which could be preferably realized high frequency narrow-band demodulation during first-order intrinsic mode functions. The first-order intrinsic mode functions Hilbert transform reveals that during the period of empirical mode decomposes Raman spectrum, modal aliasing happened. Through further analysis of corn leaf's NIR in time-frequency domain, after EMD, the first and second orders components of low energy are cut off, and reconstruct spectral signal by using the remaining intrinsic mode functions, the root-mean-square error is 1.001 1, and the correlation coefficient is 0.981 3, both of these two indexes indicated higher accuracy in re-construction; the decomposition trend term indicates the absorbency is ascending along with the decreasing to wave length in the near-infrared light wave band; and the Hilbert transform of characteristic modal component displays, 657 cm⁻¹ is the specific frequency by the corn leaf stress spectrum, which could be regarded as characteristic frequency for identification.

  1. Subframe burst gating for Raman spectroscopy in combustion.

    Science.gov (United States)

    Kojima, Jun; Fischer, David; Nguyen, Quang-Viet

    2010-05-01

    We describe an architecture for spontaneous Raman scattering utilizing a frame-transfer CCD sensor operating in a subframe burst-gating mode to realize time-resolved combustion diagnostics. The technique permits all-electronic optical gating with microsecond shutter speeds (noise.

  2. 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)

  3. 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)

  4. 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

  5. Parimala, Prof. Raman

    Indian Academy of Sciences (India)

    Parimala, Prof. Raman Ph.D. (Mumbai), FNA, FNASc. Date of birth: 21 November 1948. Specialization: Algebra Address: Professor, Department of Mathematics and Computer Science, Emory University, 400 Dowman Drive W 401, Atlanta, GA 30322, USA Contact: Office: 001-404 727 7577. Residence: 001-404 444 8870

  6. Raman, Prof. Rajiva

    Indian Academy of Sciences (India)

    Raman, Prof. Rajiva Ph.D. (Banaras), FNA, FNASc. Date of birth: 9 December 1948. Specialization: Human Molecular Genetics & Cytogenetics, Gene Expression & Chromatin Organization in Development and Sex Determination Address: Professor Emeritus, Department of Zoology, Banaras Hindu University, Varanasi 221 ...

  7. 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.

  8. Modeling of single mode optical fiber having a complicated refractive index profile by using modified scalar finite element method

    OpenAIRE

    Raghuwanshi, S.K.; Rahman, B. M.

    2016-01-01

    A numerical method based on modified scalar finite element method (SC-FEM) is presented and programmed on MATLAB platform for optical fiber modeling purpose. We have estimated the dispersion graph, mode cut off condition, and group delay and waveguide dispersion for highly complicated chirped type refractive index profile fiber. The convergence study of our FEM formulation is carried out with respect to the number of division in core. It has been found that the numerical error becomes less th...

  9. 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.

  10. Micro Structural Analysis of In2S3 Thin Films by Raman Spectroscopy

    Science.gov (United States)

    Izadneshana, H.; Gremenok, V. F.

    2014-11-01

    In2S3 thin films with different thicknesses were deposited on glass substrates using the thermal evaporation method. The as-deposited films were annealed in vacuum at 330 and 400°C for 30 and 60 min. We used Raman spectroscopy and X-ray diffraction to evaluate the effect of thermal treatment on the film structures. Raman active modes that can be classified as 9A1 and 14E modes have been observed in the Raman spectra of the In2S3 thin films. Variations in the Raman shift and bandwidth of different In2S3 thin films reveal the influence of the annealing effect. Results of Raman spectroscopy and XRD show that the annealing effect changes the crystallization phase from tetragonal to cubic at high temperatures.

  11. 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.

  12. Self-referenced directional enhanced Raman scattering using plasmon waveguide resonance for surface and bulk sensing

    Science.gov (United States)

    Wan, Xiu-mei; Gao, Ran; Lu, Dan-feng; Qi, Zhi-mei

    2018-01-01

    Surface plasmon-coupled emission has been widely used in fluorescence imaging, biochemical sensing, and enhanced Raman spectroscopy. A self-referenced directional enhanced Raman scattering for simultaneous detection of surface and bulk effects by using plasmon waveguide resonance (PWR) based surface plasmon-coupled emission has been proposed and experimentally demonstrated. Raman scattering was captured on the prism side in Kretschmann-surface plasmon-coupled emission. The distinct penetration depths (δ) of the evanescent field for the transverse electric (TE) and transverse magnetic (TM) modes result in different detected distances of the Raman signal. The experimental results demonstrate that the self-referenced directional enhanced Raman scattering of the TE and TM modes based on the PWR can detect and distinguish the surface and bulk effects simultaneously, which appears to have potential applications in researches of chemistry, medicine, and biology.

  13. Raman spectral features of single walled carbon nanotubes synthesized by laser vaporization

    CSIR Research Space (South Africa)

    Moodley, MK

    2006-07-05

    Full Text Available Breathing Mode (RBM) • Tangential stretching mode-in plane • Experimental • Results and Discussion • Conclusions Page 3 © CSIR 2006 www.csir.co.za Raman scattering in SWCNTs • In Raman spectra of SWCNTs there many features which...= 120 micron 20x objective on microscope Page 5 © CSIR 2006 www.csir.co.za Radial Breathing Mode (RBM) • this frequency mode determines whether there is SWCNTs in the sample • diameter and diameter distribution can...

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

    Directory of Open Access Journals (Sweden)

    Nandan K. Das

    2017-07-01

    Full Text Available 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.

  15. Raman spectroscopy and in situ Raman spectroelectrochemistry of bilayer ¹²C/¹³C graphene.

    Science.gov (United States)

    Kalbac, Martin; Farhat, Hootan; Kong, Jing; Janda, Pavel; Kavan, Ladislav; Dresselhaus, Mildred S

    2011-05-11

    Bilayer graphene was prepared by the subsequent deposition of a (13)C single-layer graphene and a (12)C single-layer graphene on top of a SiO(2)/Si substrate. The bilayer graphene thus prepared was studied using Raman spectroscopy and in situ Raman spectroelectrochemistry. The Raman frequencies of the (13)C graphene bands are significantly shifted with respect to those of (12)C graphene, which allows us to investigate the single layer components of bilayer graphene individually. It is shown that the bottom layer of the bilayer graphene is significantly doped from the substrate, while the top layer does not exhibit a signature of the doping from the environment. The electrochemical doping has the same effect on the charge carrier concentration at the top and the bottom layer despite the top layer being the only layer in contact with the electrolyte. This is here demonstrated by essentially the same frequency shifts of the G and G' bands as a function of the electrode potential for both the top and bottom layers. Nevertheless, analysis of the intensity of the Raman modes showed an anomalous bleaching of the Raman intensity of the G mode with increasing electrode potential, which was not observed previously in one-layer graphene.

  16. 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...

  17. Magnetic equations with FreeFem++: The Grad-Shafranov equation & the current hole

    Directory of Open Access Journals (Sweden)

    Sadaka Georges

    2011-11-01

    Full Text Available FreeFem++ [11] is a software for the numerical solution of partial differential equations. It is based on finite element method. The FreeFem++ platform aims at facilitating teaching and basic research through prototyping. For the moment this platform is restricted to the numerical simulations of problems which admit a variational formulation. Our goal in this work is to evaluate the FreeFem++ tool on basic magnetic equations arising in Fusion Plasma in the context of the ITER project. First we consider the Grad-Shafranov equation, which is derived from the static ideal MHD equations assuming axisymetry. Some of the properties of the equation and its analytical solutions are discussed. Second we discretize a reduced resistive MHD model which admits solutions of the Grad-Shafranov equation as stationary solutions. Then the physical stability of these stationary solutions is investigated through numerical experiments and the numerical stability of the algorithm is discussed.

  18. IMPROVED EFFECT AND FEM ANALYSIS OF VACUUM CONSOLIDATION METHOD USES PRELOAD EMBANKMENT

    Science.gov (United States)

    Hirata, Masafumi; Fukuda, Jun; Nobuta, Junichi; Nishikawa, Kouji; Yamada, Kouichi; Kawaida, Minoru

    In the vacuum consolidation method, the vacuum pressure acts on the direction of the inside of the improvement region. When the embankment is used together, the lateral deformation decrease and the rapid construction of the embankment are possible. However, the FEM analysis is necessary to forecast such an improved effect. In this paper, the improved effect and the deformation characteristic were verified about the vacuum consolidation method executed by the Wakasa construction. Moreover, soil-water coupled FEM analysis was executed, and the use method to the execution management etc. were examined. In the Wakasa construction, it was confirmed that the vacuum consolidation method demonstrated a high effect in the deformation decrease of the surrounding soil, the accelerating consolidation, and the term of works shortening. The executed FEM analysis can reproduce the improved effect of the vacuum consolidation by high accuracy. In the Wakasa construction, a stable construction of embankment has been achieved by using this analytical result for the execution management.

  19. 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.

  20. 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.

  1. 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.

  2. Pulsed Raman fiber laser and multispectral imaging in three dimensions

    DEFF Research Database (Denmark)

    Andersen, Joachim F.; Busck, Jens; Heiselberg, Henning

    2006-01-01

    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......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...

  3. Interference-free optical detection for Raman spectroscopy

    Science.gov (United States)

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

  4. Fourier-transform Raman spectroscopic study of human hair

    Science.gov (United States)

    Akhtar, W.; Edwards, H. G. M.; Farwell, D. W.; Nutbrown, M.

    1997-07-01

    Fourier-transform Raman microscopic spectra of normal, untreated and bleached hair fibres are presented. Vibrational assignments are made and differences are ascribed to the production of cysteic acid from cysteine. Changes in conformation associated with the disulphide bond in the keratotic component are noted from the ν(CSSC) vibrational modes at wave numbers near 500 cm -1. Raman spectra of hair root ends have also been investigated with a diminution in cysteine content being observed. Application of the technique to the biomedical investigation of healthy and diseased hair is proposed.

  5. 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.

  6. 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.

  7. 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)

  8. An Efficient Hybrid MoM/FEM Method for Analyzing the Enclosures With Apertures

    Directory of Open Access Journals (Sweden)

    SİBEL YENİKAYA

    2011-03-01

    Full Text Available In this paper a hybrid formulation is presented which combines edge-based vector finite method (FEM and Method of Moments (MoM in frequency domain to predict electromagnetic field distribution inside an enclosure with aperture. While MoM is used for solving the surface integrals related with the aperture field components via equivalent surface currents, FEM is used for solving electromagnetic fields inside of the enclosure. Numerical results for shielding effectiveness and electrical energy of enclosure with aperture are calculated by the hybrid method and they are presented and validated with the existing literature. Then the method is applied to different enclosures with different aperture sizes.

  9. 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%.

  10. Pulse fracture simulation in shale rock reservoirs: DEM and FEM-DEM approaches

    Science.gov (United States)

    González, José Manuel; Zárate, Francisco; Oñate, Eugenio

    2017-11-01

    In this paper we analyze the capabilities of two numerical techniques based on DEM and FEM-DEM approaches for the simulation of fracture in shale rock caused by a pulse of pressure. We have studied the evolution of fracture in several fracture scenarios related to the initial stress state in the soil or the pressure pulse peak. Fracture length and type of failure have been taken as reference for validating the models. The results obtained show a good approximation to FEM results from the literature.

  11. In situ Vis NIR and Raman spectroelectrochemistry at fullerene peapods

    Science.gov (United States)

    Kavan, Ladislav; Dunsch, Lothar; Kataura, Hiromichi

    2002-07-01

    The population of valence-band electronic states of fullerene peapods (C 60@SWCNT) was tuned electrochemically in acetonitrile solutions. Electrochemistry of peapods was dominated by their capacitive charging without distinct faradaic processes. In situ Vis-NIR spectra of peapods showed similar features as those of empty nanotubes. Electrochemical charging caused reversible bleaching of the transitions between Van Hove singularities. This bleaching was mirrored by quenching of resonance Raman spectra of the tube-related modes. The A g(2) mode of C 60 exhibits considerable intensity increase upon anodic doping of peapods, but this mode is not enhanced at cathodic charging.

  12. A nanomechanical Raman spectroscopy based assessment of stress distribution in irradiated and corroded SiC

    Science.gov (United States)

    Mohanty, Debapriya Pinaki; Wang, Hao; Okuniewski, Maria; Tomar, Vikas

    2017-12-01

    Silicon carbide (SiC) composites are under consideration for cladding and structural materials in various types of reactors. The effects of ion irradiation and corrosion on stress distribution due to mechanical loading on chemical vapor deposited (CVD) SiC were investigated in this paper by using nanomechanical Raman spectroscopy (NMRS). The stress distribution was analyzed as a function of the oxide formation on a corroded specimen and as a function of ion-induced irradiation damage in an irradiated specimen. A finite element method (FEM) based model was developed based on local mechanical properties measured using nanoindentation to predict the NMRS measured stress distribution. The stress distribution was also predicted theoretically by using a stress concentration factor, which is a function of sample geometry and boundary conditions. The maximum stress obtained theoretically was in good agreement with the FEM model and NMRS based measurements. FEM results captured the stress variation trends and maximum stress value in the analyzed samples. NMRS measurements predicted that corrosion had a greater influence on increasing the maximum value of stress in comparison to ion irradiation. The increase in stress attributed to corrosion in comparison to ion irradiated samples was approximately 10%-20%.

  13. Raman scattering technique in characterization of glasses containing nanoparticles for integrated optoelectronics

    Science.gov (United States)

    Ivanda, M.; Furic, K.; Music, S.; Ristic, M.; Gotic, M.; Montagna, M.; Ferrari, M.; Righini, G. C.

    2006-04-01

    Low frequency Raman scattering on the acoustic vibrational modes of nanoparticles has been used for determining the size of dielectric, semiconductor and metal nanoparticles embedded in glass. This contribution reports on application of low-frequency Raman scattering on acoustical vibrational modes of nanoparticles. The theoretical background as well as the experimental results of free non-interacting nanoparticles as well as glass containing different nanoparticles for optoelectronics will be presented. The approach is based on a 1/ν dependence of the Raman light of the vibration coupling coefficient and on the fact that each nanocrystallite of diameter D vibrates with its eigenfrequency ν~1/D. The Raman scattering spectra are analyzed using confined acoustical vibrations model. The model-calculation considered homogeneous broadening of the confined acoustical modes due to interaction of the particles with matrix and inhomogeneous broadening due to the contribution of the Raman scattering from the particles of different sizes. The low frequency Raman spectra of different nanoparticles (nc-TiO II, nc-SnO II, nc-CdS xSe 1-x, and nc-Si) prepared by Physical Vapour Deposition, thermal quenching and thereafter annealing of glass and sol-gel techniques was used for determination of particles size distribution and results were compared to TEM. The Raman spectroscopy technique has proved to be a simple and fast method that has favorable statistical characteristics due to the macroscopic probe volume and makes in situ measurements possible.

  14. FEM-based oxygen consumption and cell viability models for avascular pancreatic islets.

    Science.gov (United States)

    Buchwald, Peter

    2009-04-16

    The function and viability of cultured, transplanted, or encapsulated pancreatic islets is often limited by hypoxia because these islets have lost their vasculature during the isolation process and have to rely on gradient-driven passive diffusion, which cannot provide adequate oxygen transport. Pancreatic islets (islets of Langerhans) are particularly susceptible due to their relatively large size, large metabolic demand, and increased sensitivity to hypoxia. Here, finite element method (FEM) based multiphysics models are explored to describe oxygen transport and cell viability in avascular islets both in static and in moving culture media. Two- and three-dimensional models were built in COMSOL Multiphysics using the convection and diffusion as well as the incompressible Navier-Stokes fluid dynamics application modes. Oxygen consumption was assumed to follow Michaelis-Menten-type kinetics and to cease when local concentrations fell below a critical threshold; in a dynamic model, it was also allowed to increase with increasing glucose concentration. Partial differential equation (PDE) based exploratory cellular-level oxygen consumption and cell viability models incorporating physiologically realistic assumptions have been implemented for fully scaled cell culture geometries with 100, 150, and 200 microm diameter islets as representative. Calculated oxygen concentrations and intra-islet regions likely to suffer from hypoxia-related necrosis obtained for traditional flask-type cultures, oxygen-permeable silicone-rubber membrane bottom cultures, and perifusion chambers with flowing media and varying incoming glucose levels are presented in detail illustrated with corresponding colour-coded figures and animations. Results of the computational models are, as a first estimate, in good quantitative agreement with existing experimental evidence, and they confirm that during culture, hypoxia is often a problem for non-vascularised islet and can lead to considerable cell

  15. FEM-based oxygen consumption and cell viability models for avascular pancreatic islets

    Directory of Open Access Journals (Sweden)

    Buchwald Peter

    2009-04-01

    Full Text Available Abstract Background The function and viability of cultured, transplanted, or encapsulated pancreatic islets is often limited by hypoxia because these islets have lost their vasculature during the isolation process and have to rely on gradient-driven passive diffusion, which cannot provide adequate oxygen transport. Pancreatic islets (islets of Langerhans are particularly susceptible due to their relatively large size, large metabolic demand, and increased sensitivity to hypoxia. Here, finite element method (FEM based multiphysics models are explored to describe oxygen transport and cell viability in avascular islets both in static and in moving culture media. Methods Two- and three-dimensional models were built in COMSOL Multiphysics using the convection and diffusion as well as the incompressible Navier-Stokes fluid dynamics application modes. Oxygen consumption was assumed to follow Michaelis-Menten-type kinetics and to cease when local concentrations fell below a critical threshold; in a dynamic model, it was also allowed to increase with increasing glucose concentration. Results Partial differential equation (PDE based exploratory cellular-level oxygen consumption and cell viability models incorporating physiologically realistic assumptions have been implemented for fully scaled cell culture geometries with 100, 150, and 200 μm diameter islets as representative. Calculated oxygen concentrations and intra-islet regions likely to suffer from hypoxia-related necrosis obtained for traditional flask-type cultures, oxygen-permeable silicone-rubber membrane bottom cultures, and perifusion chambers with flowing media and varying incoming glucose levels are presented in detail illustrated with corresponding colour-coded figures and animations. Conclusion Results of the computational models are, as a first estimate, in good quantitative agreement with existing experimental evidence, and they confirm that during culture, hypoxia is often a problem for

  16. S-band multi-wavelength Brillouin-Raman fiber laser utilizing fiber Bragg grating and Raman amplifier in the ring cavity

    Science.gov (United States)

    Anwar, Nur Elina; Ahmad Hambali, N. A. M.; Sohaimi, M. Syazwan; M. Shahimin, M.; A. Wahid, M. H.; Yusof, N. Roshidah; Malek, A. Zakiah

    2015-08-01

    This paper is focusing on simulation and analyzed of S-band multi-wavelength Brillouin-Raman fiber laser performance utilizing fiber Bragg grating and Raman amplifier in ring cavity by using Optisystem software. Raman amplifieraverage power model is employed for signal amplification. This laser system is operates in S-band wavelength region due to vast demanding on transmitting the information. Multi-wavelength fiber lasers based on hybrid Brillouin-Raman gain configuration supported by Rayleigh scattering effect have attracted significant research interest due to its ability to produced multi-wavelength signals from a single light source. In multi-wavelength Brillouin-Raman fiber, single mode fiber is utilized as the nonlinear gain medium. From output results, 90 % output coupling ratio has ability to provide the maximum average output power of 43 dBm at Brillouin pump power of 20 dBm and Raman pump power of 14 dBm. Furthermore, multi-wavelength Brillouin-Raman fiber laser utilizing fiber Bragg grating and Raman amplifier is capable of generated 7 Brillouin Stokes signals at 1480 nm, 1510 nm and 1530 nm.

  17. 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.

  18. Raman spectroscopic study of a genetically altered kidney cell

    Science.gov (United States)

    Joshi, Joel; Garcia, Francisco; Centeno, Silvia P.; Joshi, N. V.

    2008-02-01

    A Raman spectroscopic investigation of a genetically altered Human Embryonic Kidney Cell (HEK293) along with a pathologically normal cell has been carried out by a conventional method. The genetic alteration was carried out with a standard protocol by using a Green Fluorescence Protein (GFP). Raman spectra show that there are dramatic differences between the spectrum obtained from a genetically altered cell and that obtained from a pathologically normal cell. The former shows three broad bands; meanwhile the latter shows several sharp peaks corresponding to the ring vibrational modes of Phen, GFP and DNA. The present analysis provides an indication that the force field near Phen located at 64, 65 and 66 was altered during the genetic transformation. The Raman spectrum could be a direct experimental evidence for substantial modifications triggered due to the expression of specific genes.

  19. Narrow-linewidth passband filter for ultraviolet rotational Raman imaging.

    Science.gov (United States)

    Finkelstein, N D; Lempert, W R; Miles, R B

    1997-04-15

    We present a narrow-passband spectral filter capable of frequency-resolved imaging of rotational Raman light scattering with strong spectral rejection of out-of-band Raman, Rayleigh, and Mie scattering. The filter is based on mercury-vapor absorption, and subsequent resonant fluorescence and has a passband of less than 1 cm(-1). It is paired with an injection-seeded, cavity-locked, frequency-tripled Ti:sapphire laser that produces >30 mJ/pulse of single-mode, tunable light in the vicinity of 253.7 nm. The laser and filter are combined to spectrally resolve scattering from individual rotational Raman lines of nitrogen and oxygen.

  20. 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.

  1. 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

  2. FEM Simulation Of Stress-Strain Fields in the Blooms with Casting Defect During Soaking

    Directory of Open Access Journals (Sweden)

    Miroslav KVÍČALA

    2013-06-01

    Full Text Available Round continuously cast blooms heating strategy is crucial in prevention of internal cracks initiation and propagation. Especially vanadium microalloyed Cr-Mo based steels are very sensitive to internal crack occurrence. This paper deals with two heating strategies that were realized in soaking pit. Using FEM simulation it was proved that proper heating strategy is essential to reduce internal crack propagation.

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

    DEFF Research Database (Denmark)

    Turkyilmaz, Yilmaz; Jouffroy, Jerome; Egeland, Olav

    Contraction theory is a recently developed nonlinear analysis tool which may be useful for solving a variety of nonlinear control problems. In this paper, using Contraction theory, a nonlinear observer is designed for a general nonlinear cable/string FEM (Finite Element Method) model. The cable...

  5. 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...

  6. Comprehensive material characterization and method of its validation by means of FEM simulation

    NARCIS (Netherlands)

    Gromala, P.; Duerr, J.; Dressler, M.; Jansen, K.M.B.; Hawryluk, M.; Vreugd, J. de

    2011-01-01

    Numerical simulation plays an important role in product design. Its accuracy relays on a detailed description of geometry, material models, load and boundary conditions. This paper focuses on a new approach of FEM material modeling of three commercially available molding compounds. Curing shrinkage,

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

    Science.gov (United States)

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

    2010-06-01

    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.

  8. Bending of I-beam with the transvers shear effect included – FEM calculated

    Energy Technology Data Exchange (ETDEWEB)

    Grygorowicz, Magdalena; Lewiński, Jerzy [Poznan University of Technology, Institute of Applied Mechanics ul. Jana Pawła II No. 24, 60-138 Poznań POLAND (Poland)

    2016-06-08

    The paper is devoted to three-point bending of an I-beam with include of transvers shear effect. Numerical calculations were conducted independently with the use of the SolidWorks system and the multi-purpose software package ANSYS The results of FEM study conducted with the use of two systems were compared and presented in tables and figures.

  9. Adaptive hp-FEM with Arbitrary-Level Hanging Nodes for Maxwell’s Equations

    Czech Academy of Sciences Publication Activity Database

    Šolín, Pavel; Dubcová, Lenka; Doležel, Ivo

    2010-01-01

    Roč. 2, č. 4 (2010), s. 518-532 ISSN 2070-0733 Institutional research plan: CEZ:AV0Z20570509 Keywords : hp-FEM * arbitrary-level hanging nodes * irregular meshes Subject RIV: JA - Electronics ; Optoelectronics, Electrical Engineering Impact factor: 0.510, year: 2010 http://www.global-sci.org/aamm/

  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. 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...

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

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Kang Soo; Lee, Ho Jin; Woo, Wan Chuck; Seong, Baek Seok [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of); Byeon, Jin Gwi; Park, Kwang Soo; Jung, In Chul [Doosan Heavy Industries and Construction Co., Changwon (Korea, Republic of)

    2010-10-15

    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

  13. Meso-scale coupling of FEM/DEM for fluid-particle interactions,

    NARCIS (Netherlands)

    Srivastava, S.; Yazdchi, K.; Luding, Stefan

    2014-01-01

    A new method for two-way fluid–particle coupling on an unstructured mesoscopically coarse mesh is presented. In this approach, we combine a (higher order) finite-element method (FEM) on the moving mesh for the fluid with a soft sphere discrete-element method for the particles. The novel feature of

  14. Doping of C70 fullerene peapods with lithium vapor: Raman spectroscopic and Raman spectroelectrochemical studies

    Science.gov (United States)

    Kalbáč, Martin; Vales, Vaclav; Kavan, Ladislav; Dunsch, Lothar

    2014-12-01

    Raman spectroscopy and in situ Raman spectroelectrochemistry were applied to study the lithium vapor doping of C70@SWCNTs (peapods). A strong degree of doping was proved by the vanishing of the single walled carbon nanotubes (SWCNT’s) radial breathing mode (RBM) and by the attenuation of the tangential (TG) band intensity. In contrast to potassium vapor doping, the strong downshift of the frequency of the TG band has not been observed for Li-doping. The Li vapor treated peapods remained partly doped even if they were exposed to humid air. This has been reflected by a reduced intensity of the nanotube and the fullerene modes and by the change of the shape of the RBM band as compared to that of the undoped sample. The modes of the intratubular fullerene were almost unresolved after the contact of the Li-doped sample with water. A lithium insertion into the interior of a peapod and its strong interaction with the intratubular fullerene is suggested to be responsible for the air-insensitive residual doping. This residual doping was studied by spectroelectrochemical measurements. The TG band of the Li doped peapods is partly upshifted during the anodic doping, which points to the different state of C70@SWCNTs and C60@SWCNTs studied previously.

  15. 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

  16. 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

  17. Surface-Enhanced Raman Spectroscopy

    Indian Academy of Sciences (India)

    IAS Admin

    In Raman spectroscopy, inelastic scattering of photons from an atom or molecule in chemical entities is utilized to analyze the composition of solids, liquids and gases. However, the low cross-section limits its applications. The introduction of sur- face-enhanced Raman spectroscopy in 1974 has attracted a lot of attention ...

  18. 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...

  19. Surface-Enhanced Raman Spectroscopy

    Indian Academy of Sciences (India)

    IAS Admin

    near-ultraviolet range of electromagnetic spectra. The shift in energy in Raman effect gives information about the ... Raman spectroscopy is commonly used in chemistry, since vibrational information is very specific for the ... in polarizability is compatible with preservation of the center of symmetry. Thus, in a centrosymmetric ...

  20. Industrial applications of Raman spectroscopy

    Science.gov (United States)

    Grasselli, J. G.; Walder, F.; Petty, C.; Kemeny, G.

    1993-03-01

    In the last two decades, Raman spectroscopy has matured as an important method for the study of molecules and complex molecular systems. This is evident from the number of fine texts and the many review articles which have been published describing theory and applications of Raman spectroscopy over a very broad range of subjects (1-10). Raman spectroscopy is the essential partner to infrared spectroscopy for a complete vibrational analysis of a molecule in structure determinations. From the understanding developed on small molecules, theory was extended to interpret the spectra of larger systems such as polymers, biological molecules, and ordered condensed phases. The contribution of Raman spectroscopy to these areas has been significant. It was the development of commercial lasers in the 1960s which spurred the renewed interest in the Raman technique. But applications were still limited for highly fluorescing or intensely colored systems. In 1986, a breakthrough paper by Hirschfeld and Chase (11) described the use of near-infrared laser excitation and a commercial interferometer-based FT-IR spectrometer to record FT-Raman spectra. Significant advantages included the inherent multiplex, throughput and data processing features of the FT interferometers and the use of a ND:YAG laser (1.064 μm) which dramatically decreased problems with sample fluorescence and decomposition. A deluge of papers describing applications of FT-Raman spectroscopy can be found in the Journal of Raman Spectroscopy, Spectrochimica Acta (special issues 40A ad 47A), and Applied Spectroscopy since then.

  1. All-Fiber Raman Probe

    DEFF Research Database (Denmark)

    Brunetti, Anna Chiara

    to perform real-time measurements with little or no sample preparation, Raman spectroscopy is now considered an invaluable analytical tool, finding application in several fields including medicine, defense and process control. When combined with fiber optics technology, Raman spectroscopy allows......The design and development of an all-in-fiber probe for Raman spectroscopy are presented in this Thesis. Raman spectroscopy is an optical technique able to probe a sample based on the inelastic scattering of monochromatic light. Due to its high specificity and reliability and to the possibility...... for the realization of flexible and minimally-invasive devices, able to reach remote or hardly accessible samples, and to perform in-situ analyses in hazardous environments. The work behind this Thesis focuses on the proof-of-principle demonstration of a truly in-fiber Raman probe, where all parts are realized...

  2. 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.

  3. Orthorhombic boron oxide under pressure: In situ study by X-ray diffraction and Raman scattering

    Science.gov (United States)

    Cherednichenko, Kirill A.; Le Godec, Yann; Kalinko, Aleksandr; Mezouar, Mohamed; Solozhenko, Vladimir L.

    2016-11-01

    High-pressure phase of boron oxide, orthorhombic β-B2O3, has been studied in situ by synchrotron X-ray diffraction to 22 GPa and Raman scattering to 46 GPa at room temperature. The bulk modulus of β-B2O3 has been found to be 169(3) GPa that is in good agreement with our ab initio calculations. Raman and IR spectra of β-B2O3 have been measured at ambient pressure; all experimentally observed bands have been attributed to the theoretically calculated ones, and the mode assignment has been performed. Based on the data on Raman shift as a function of pressure, combined with equation-of-state data, the Grüneisen parameters of all experimentally observed Raman bands have been calculated. β-B2O3 enriched by 10B isotope has been synthesized, and the effect of boron isotopic substitution on Raman spectra has been studied.

  4. 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.

  5. Raman Spectroscopic Methods for Classification of Normal and Malignant Hypopharyngeal Tissues: An Exploratory Study

    Directory of Open Access Journals (Sweden)

    Parul Pujary

    2011-01-01

    Full Text Available Laryngeal cancer is more common in males. The present study is aimed at exploration of potential of conventional Raman spectroscopy in classifying normal from a malignant laryngopharyngeal tissue. We have recorded Raman spectra of twenty tissues (aryepiglottic fold using an in-house built Raman setup. The spectral features of mean malignant spectrum suggests abundance proteins whereas spectral features of mean normal spectrum indicate redundancy of lipids. PCA was employed as discriminating algorithm. Both, unsupervised and supervised modes of analysis as well as match/mismatch “limit test” methodology yielded clear classification among tissue types. The findings of this study demonstrate the efficacy of conventional Raman spectroscopy in classification of normal and malignant laryngopharyngeal tissues. A rigorous evaluation of the models with development of suitable fibreoptic probe may enable real-time Raman spectroscopic diagnosis of laryngopharyngeal cancers in future.

  6. 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.

  7. [Identification of B jade by Raman spectroscopy].

    Science.gov (United States)

    Zu, En-dong; Chen, Da-peng; Zhang, Peng-xiang

    2003-02-01

    Raman spectroscopy has been found to be a useful tool for identification of bleached and polymer-impregnated jadeites (so-called B jade). The major advantage of this system over classical methods of gem testing is the non-destructive identification of inclusions in gemstones and the determination of organic fracture filling in jade. Fissures in jadeites have been filled with oils and various resins to enhance their clarity, such as paraffin wax, paraffin oil, AB glue and epoxy resins. They show different peaks depending on their chemical composition. The characteristic spectrum ranges from 1,200-1,700 cm-1 to 2,800-3,100 cm-1. The spectra of resins show that they all have four strongest peaks related with phenyl: two C-C stretching modes at 1,116 and 1,609 cm-1, respectively, one C-H stretching mode at 3,069 cm-1, and a in-plane C-H bending mode at 1,189 cm-1. In addition, other two -CH2, -CH3 stretching modes at 2,906 and 2,869 cm-1, respectively, are very similar to paraffin. Therefore, the peaks at 1,116, 1,609, 1,189 and 3,069 cm-1 are important in distinguishing resin from paraffin, and we can identify B jade depending on them.

  8. 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.

  9. 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.

  10. 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.

  11. Raman scattering in hydrocarbon and fluorocarbon zigzag structures

    Science.gov (United States)

    Gorelik, Vladimir S.; Zlobina, Ludmila I.; Sharts, Olga N.

    2000-12-01

    Raman spectra of hydrocarbon and fluorocarbin zigzag structure molecules are studied. The investigations have been fulfilled for following substances: CnH2n+2 (n equals 6, 7, 10), CnH2nO2 (n equals 4, 5, 8, 10, 11, 13, 15, 18), CnF2n+1Br(n equals 6, 7, 8, 10, 14), for similar structures: H(CF2)10H, H(CF2)10CONH2, F(CF2)5CO2K and commercial products. The frequency shifts of some modes, corresponding to acoustical and optical vibrations, have been observed. The theory, explaining Raman modes frequency dependence on the length of zigzag molecule, is developed. The presence of characteristic isooctane line in Raman spectra of benzines is established. Molecular structure modification of sun- flower-seed oil as a result of technological preparation process has been observed. The obtained results allow detecting zigzag fluorocarbon and hydrocarbon molecules in media and estimating its length with the help of Raman scattering spectroscopy.

  12. Raman scattering with strongly coupled vibron-polaritons

    Science.gov (United States)

    Strashko, Artem; Keeling, Jonathan

    2016-08-01

    Strong coupling between cavity photons and molecular vibrations can lead to the formation of vibron-polaritons. In a recent experiment with PVAc molecules in a metal-metal microcavity [Shalabney et al., Angew. Chem., Int. Ed. 54, 7971 (2015), 10.1002/anie.201502979], such a coupling was observed to enhance the Raman scattering probability by several orders of magnitude. Inspired by this, we theoretically analyze the effect of strong photon-vibron coupling on the Raman scattering amplitude of organic molecules. This problem has recently been addressed by del Pino, Feist, and Garcia-Vidal [J. Phys. Chem. C 119, 29132 (2015), 10.1021/acs.jpcc.5b11654] using exact numerics for a small number of molecules. In this paper we derive compact analytic results for any number of molecules, also including the ultrastrong-coupling regime. Our calculations predict a division of the Raman signal into upper and lower polariton modes, with some enhancement to the lower polariton Raman amplitude due to the mode softening under strong coupling.

  13. Gas Raman sensing with multi-opened-up suspended core fiber.

    Science.gov (United States)

    Wang, Guanjun; Liu, Jiansheng; Yang, Yi; Zheng, Zheng; Xiao, Jing; Li, Ruichao

    2011-11-01

    Gas sensing and fluid-guiding response properties of a suspended core fiber Raman analyzer with side-opened and strut microfluid-guiding array are explored. A Raman sensing model is introduced for effective mode area optimization and normalized intensity overlap enhancement between Raman sensing light and analyte. Calculations predict that there is a trade-off between the overlap and the effective mode area, while the optimal trade-off depends on the refractive index of the background material, core diameter, and strut's thickness. Furthermore, the multi-opened-up structure ensures a fast gases diffusing into/out of each hole for real-time Raman sensing. Simulation results confirm a limited gas sensing response time of less than 6 s could be feasible and, thus, a new approach to real-time gas sensing applications is identified. © 2011 Optical Society of America

  14. 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.

  15. Engineering Plasmonic Nanopillar Arrays for Surface-enhanced Raman Spectroscopy

    DEFF Research Database (Denmark)

    Wu, Kaiyu

    This Ph.D. thesis presents (i) an in-depth understanding of the localized surface plasmon resonances (LSPRs) in the nanopillar arrays (NPs) for surface-enhanced Raman spectroscopy (SERS), and (ii) systematic ways of optimizing the fabrication process of NPs to improve their SERS efficiencies.......e., the particle mode and the cavity mode. The particle mode can be hybridized via leaning of pillars. The LSPR wavelength of the cavity mode is dominant only by the diameter of the Si pillar. The presence of a substrate dramatically changes the intensities of these two LSPR modes, by introducing constructive...... displaying a very large average SERS EF of >108. From a practical point of view, the developed SERS substrates are particularity interesting, since they are easy to handle and store and the fabrication is scalable, facilitating a wide and simple use of SERS in sensing applications....

  16. Implementation of spectral basis functions in BEM/FEM/GSM Domain Decomposition Methods devoted to scattering and radiation applications

    Science.gov (United States)

    Barka, André; Picard, Clément

    2008-03-01

    In this paper, we discuss several improvements of a substructuring Domain Decomposition Method (DDM) devoted to Electromagnetic computations, based on the Boundary Element Method (BEM) and the Finite Element Method (FEM). This computation procedure is applied to the analysis of antenna performance on board vehicles as well as Radar Cross Section (RCS). The benefits of the subdomain Computational Electromagnetic Method are mainly the ability to deal with collaborative studies involving several companies, and the reduction of the computation costs by one or more orders of magnitude, especially in the context of parametric studies. Furthermore, this paper proposes a Spectral Basis Function (SBF) defined on fictitious surfaces surrounding equipment, to deal with both the computation of antenna far field patterns and RCS in a multi-domain mode. By masking the complexity of the equipment (wires, thin surfaces, materials, supply network, weapons) the external domain of the vehicle can be closed so that the Combined Field Integral Equation (CFIE) can be used, which is better conditioned than the Electric Field Integral Equation (EFIE). This calculation procedure leads to a faster convergence when using iterative Multi Level Fast Multiple Algorithms (MLFMA). The accuracy and efficiency of this technique is assessed by performing the computation of the diffraction and radiation of several test-objects in a multi-domain way cross compared with reference integral equation results.

  17. Monosodium glutamate in its anhydrous and monohydrate form: Differentiation by Raman spectroscopies and density functional calculations

    Science.gov (United States)

    Peica, N.; Lehene, C.; Leopold, N.; Schlücker, S.; Kiefer, W.

    2007-03-01

    Monosodium glutamate (MSG), a common flavor enhancer, is detected in aqueous solutions by Raman and surface-enhanced Raman (SERS) spectroscopies at the micromolar level. The presence of different species, such as protonated and unprotonated MSG, is demonstrated by concentration and pH dependent Raman and SERS experiments. In particular, the symmetric bending modes of the amino group and the stretching modes of the carboxy moiety are employed as marker bands. The protonation of the NH 2 group at acidic pH values, for example, is detected in the Raman spectra. From the measured SERS spectra, a strong chemical interaction of MSG with the colloidal particles is deduced and a geometry of MSG adsorbed on the silver surface is proposed. In order to assign the observed Raman bands, calculations employing density functional theory (DFT) were performed. The calculated geometries, harmonic vibrational wavenumbers and Raman scattering activities for both MSG forms are in good agreement with experimental data. The set of theoretical data enables a complete vibrational assignment of the experimentally detected Raman spectra and the differentiation between the anhydrous and monohydrate forms of MSG.

  18. Light depolarization effects in tip enhanced Raman spectroscopy of silicon (001 and gallium arsenide (001

    Directory of Open Access Journals (Sweden)

    P. G. Gucciardi

    2011-09-01

    Full Text Available We report on the effects of light depolarization induced by sharp metallic tips in Tip-Enhanced Raman Spectroscopy (TERS. Experiments on Si(001 and GaAs(001 crystals show that the excitation field depolarization induces a selective enhancement of specific Raman modes, depending on their Raman tensor symmetry. A complete polarization analysis of the light backscattered from the tip confirms the TERS findings. The spatial confinement of the depolarization field is studied and its dependence on the excitation wavelength and power are explored.

  19. Raman imaging of millimeter-long carbon nanotubes grown by a gas flow method

    Science.gov (United States)

    Kihara, Katsuya; Ishitani, Akihiro; Koyama, Tomohiro; Fukasawa, Mamoru; Inaba, Takumi; Shimizu, Maki; Homma, Yoshikazu

    2017-02-01

    Growing long carbon nanotubes (CNTs) is an important prerequisite for practical applications of CNTs. Although gas-flow-guided chemical vapor deposition can be used to produce millimeter-long CNTs, little is known regarding the associated growth mechanism. In the present work, Raman imaging was employed to characterize individual CNTs grown by the gas flow method, and Raman images of a CNT over 1.6 mm long were obtained. Two radial breathing modes were observed and the associated Raman images exhibited exactly identical distributions, indicating that the long CNT most likely had a double-walled structure, in which the CNT diameter was uniform along the whole length.

  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. 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.

  2. 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.)

  3. Raman and infrared study of hydroxyl sites in natural uvite, fluor-uvite, magnesio-foitite, dravite and elbaite tourmalines

    Science.gov (United States)

    Fantini, C.; Tavares, M. C.; Krambrock, K.; Moreira, R. L.; Righi, A.

    2014-04-01

    We present the Raman and infrared spectra of different tourmaline species in the spectral range associated with the hydroxyl stretching modes, investigated through polarized Raman spectroscopy. Different lineshapes are observed for the OH spectra in uvite, fluor-uvite, magnesio-foitite, dravite and elbaite samples, and can be related to the coordination of OH in the two different structural V[O(3)]- and W[O(1)]-occupied sites. Local arrangements around the two different OH sites were assigned, and different ion substitutions for these five tourmaline species were identified. Our work with polarized Raman spectroscopy revealed that OH-stretching modes are described by totally symmetric, irreducible representations.

  4. 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%, (pspectroscopy 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.

  5. Characterization of acetaminophen: molecular microanalysis with Raman microprobe spectroscopy.

    Science.gov (United States)

    Pestaner, J P; Mullick, F G; Centeno, J A

    1996-11-01

    The in situ spectroscopic identification of acetaminophen in a fatal overdose case is described. Numerous techniques have been used to analyze acetaminophen in biological fluids, however, the use of nondestructive spectroscopic techniques has not been documented. In this investigation, the demonstration of the drug material was established by using the laser Raman microprobe technique, providing an accurate identification by virtue of the drug's molecular fingerprint characteristics. Material found on the deceased was collected and placed on metal (aluminum-coated) plated slides and excited with the 514.5 nm line of an argon ion laser, which was focused to a 1 micron spot size using a high-resolution optical microscope. Spectra of acetaminophen particles with an average size of 5 to 8 microns were obtained. The Raman spectrum of this drug contains characteristic group frequencies assigned to the C = O at 1649 cm-1, the N-H deformation mode at 1620 to 1612 cm-1, the bendstretch mode of the H-N-C = O at 1562 cm-1, the C-H bending mode at 1325 cm-1, and the phenyl ring stretch at 799 cm-1, respectively. The results reported here demonstrate the capability of laser Raman microprobe as a useful adjunct tool for the identification of foreign materials in forensic pathology.

  6. The Stability Analysis of the Lusi Mud Volcano Embankment Dams using FEM with a Special Reference to the Dam Point P10.D

    Directory of Open Access Journals (Sweden)

    Sukandi .

    2012-01-01

    Full Text Available Since the eruption of the Lusi Mud volcano in Sidoarjo, East Java, on May 2006, soil embankment dams have been built to keep hot mud within the ponds. Unfortunately, since the dams were sitting on poor weak ground, land subsidence intensively occurred around the dams. A finite element method (FEM was, then, applied to evaluate the stability of the dams particularly of the dam point P10.D, being considered as the most unstable point over 29 other dam points. Results show that the dam displacements in vertical and horizontal directions were high. The total displacements of the final design were about 1.5 m in both static- and dynamic-state conditions. These modelled data show a similar trend with field measurement data. The dam had only a factor of safety of about 1.1, and the dam might fail through a deep slide mode.

  7. 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.

  8. Kinetic theory of stimulated Raman sidescattering from magnetized plasmas

    Energy Technology Data Exchange (ETDEWEB)

    Rankin, R.; Boyd, T.J.M.

    1985-11-01

    A theory of stimulated Raman sidescattering in magnetized plasmas is presented based on a solution of the Vlasov--Maxwell equations. The incident laser light, in the form of extraordinary mode radiation, decays into light waves which propagate along the uniform magnetic field as right or left circularly polarized waves. The scattered plasma mode is an obliquely propagating electron-Bernstein wave. The possible relevance of the theory to experiments in which structure is observed in radiation at one-half of the laser frequency is discussed.

  9. 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

  10. Validation of normal and frictional contact models of spherical bodies by FEM analysis

    Directory of Open Access Journals (Sweden)

    H Khawaja

    2016-09-01

    Full Text Available Contact forces between two spheres are computed, including the contact pressure (normal and the frictional stress (tangential using a finite element method (FEM. A CAD model of a part of a sphere was developed. A mesh was created using ANSYS® Solid 186, 20-Noded hexahedral element and analyzed for its sensitivity. ANSYS® Contact 174 and Target 170, 8-Noded surface elements were used. Contact pressure and frictional stress contours were calculated by varying the displacements. Normal and Tangential contact forces were computed by integrating contact pressure and frictional stress over the contact surface. The values obtained for the normal force were compared with the non-linear spring model as given by Hertz [1]. Similarly values of the tangential force were compared with the model of Mindlin and Deresiewicz (MD [2]. The FEM results were found to be in agreement with the models.

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

    Science.gov (United States)

    Nguyen, Trung Kien; Claramunt, Albert Argilaga; Caillerie, Denis; Combe, Gaël; Dal Pont, Stefano; Desrues, Jacques; Richefeu, Vincent

    2017-06-01

    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.

  12. A hybrid FEM-DEM approach to the simulation of fluid flow laden with many particles

    Science.gov (United States)

    Casagrande, Marcus V. S.; Alves, José L. D.; Silva, Carlos E.; Alves, Fábio T.; Elias, Renato N.; Coutinho, Alvaro L. G. A.

    2017-04-01

    In this work we address a contribution to the study of particle laden fluid flows in scales smaller than TFM (two-fluid models). The hybrid model is based on a Lagrangian-Eulerian approach. A Lagrangian description is used for the particle system employing the discrete element method (DEM), while a fixed Eulerian mesh is used for the fluid phase modeled by the finite element method (FEM). The resulting coupled DEM-FEM model is integrated in time with a subcycling scheme. The aforementioned scheme is applied in the simulation of a seabed current to analyze which mechanisms lead to the emergence of bedload transport and sediment suspension, and also quantify the effective viscosity of the seabed in comparison with the ideal no-slip wall condition. A simulation of a salt plume falling in a fluid column is performed, comparing the main characteristics of the system with an experiment.

  13. 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.

  14. A two-phase coupled Eulerian-Lagrangian FEM for offshore spudcan analysis

    Science.gov (United States)

    Yi, Jiang Tao; Lee, Fook Hou; Li, Yu Ping; Zhang, Xi Ying; Goh, Siang Huat

    2013-10-01

    This paper reports a development of a two-phase coupled Eulerian-Lagrangian FEM for analyzing the short-and long-term response of offshore spudcan footing. The proposed method is composed of three integral components which are effective stress Eulerian analysis for the shrot-term installation behavior of spudcan, mesh-to-mesh solution variable mapping and coupled-flow Lagrangian analysis for the post-installation, long-term working behaviour of spudcan. By combining the advantages of Eulerian and Lagrangian finite element methods, this coupled Eulerian-Lagrangian FEM is tailored to solve offshore foundation problems which often see rapid and large-scale undrained soil flow during installation followed by much longer periods of embedment in the ground during operation.

  15. A stable and optimally convergent LaTIn-CutFEM algorithm for multiple unilateral contact problems

    Science.gov (United States)

    Claus, Susanne; Kerfriden, Pierre

    2018-02-01

    In this paper, we propose a novel unfitted finite element method for the simulation of multiple body contact. The computational mesh is generated independently of the geometry of the interacting solids, which can be arbitrarily complex. The key novelty of the approach is the combination of elements of the CutFEM technology, namely the enrichment of the solution field via the definition of overlapping fictitious domains with a dedicated penalty-type regularisation of discrete operators, and the LaTIn hybrid-mixed formulation of complex interface conditions. Furthermore, the novel P1-P1 discretisation scheme that we propose for the unfitted LaTIn solver is shown to be stable, robust and optimally convergent with mesh refinement. Finally, the paper introduces a high-performance 3D level-set/CutFEM framework for the versatile and robust solution of contact problems involving multiple bodies of complex geometries, with more than two bodies interacting at a single point.

  16. 3-D FEM Analysis, Prototyping and Tests of an Axial Flux Permanent-Magnet Wind Generator

    Directory of Open Access Journals (Sweden)

    Joya C. Kappatou

    2017-08-01

    Full Text Available This paper contributes to the research and development of Axial Flux Permanent Magnet Synchronous Machines (AFPMSM; and in particular the design, the construction stages and measurements of a double rotor single internal non-ferromagnetic stator with a trapezoidal-concentrated winding machine for wind power generation applications. The initial dimensions of the machine were calculated using analytical formulas and a model was created and analyzed using the 3D Finite Element Method (FEM. The shape of the magnets of the machine was optimized and presented in a previous paper and a prototype was constructed and tested in the laboratory. In addition, a temperature test of the stator was performed experimentally. Finally, the effect of the different axial widths of the two air gaps on the electrical magnitudes and the field of the machine were investigated using both FEM analysis and experiments.

  17. Thermal Analysis of Reinforced Concrete Tank for Conditioning Wood by FEM Method

    Science.gov (United States)

    Błaszczyński, Tomasz; Babiak, Michał; Wielentejczyk, Przemysław

    2017-10-01

    The article introduces the analysis of a RC tank for conditioning wood carried out using the FEM (Finite Element Method). A temperature gradient distribution increase resulting from the influence of hot liquid filling the tank was defined. Values of gradients in border sections of the tank walls and the bottom were defined on the basis of the isotherm method. The obtained results were compared with empirical formulas from literature. Strength analyses were also carried out. Additionally, the problematic aspects of elongated monolithic tanks for liquids were introduced, especially regarding large temperature gradients and the means of necessary technical solutions. The use of the FEM method for designing engineering objects is, nowadays, an irreplaceable solution. In the case of the discussed tank, a spatial model of the construction mapping its actual performance was constructed in order to correctly estimate the necessary dimensions of wall and bottom sections, as well as reinforcement.

  18. Effects of Forging Stream Line on Tensile Strength Using FEM Simulation

    Directory of Open Access Journals (Sweden)

    Ching-Wei Shih

    2014-03-01

    Full Text Available Because bolt usages always have the requirement of tensile strength, with a view to reach the requirement of tensile strength, the material property or forming method and dies design can be used to obtain it. The study aims at the forming method and dies design to perform the multistage analysis of bolt to realize the effect of forging stream line continuity on tensile strength. The study uses Simufact-FEM software to do the multistage forming simulation to modify the dies design and forming method. The amount of broken forging stream line can be used to identify whether the bolt is good or not. From the comparison of realistic forging product, the results can verify the acceptance of FEM simulation.

  19. 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.

  20. Using the Finite Elements Method (FEM) for Nanotechnology Education. A rectangular cantilever as a mass sensor

    Science.gov (United States)

    Aya Baquero, H.

    2015-01-01

    The Finite Element Method FEM can be used in the context of physics engineering education, particularly in nanotechnology training. Cantilevers and cantilevers arrays have been implemented as sensors within lots of applications. In the present paper, FEM was used to assess validity of basic models where cantilevers are used as mass sensors. Resonance frequency of a cantilever transversal vibration was found; this was a silicon one-side clamped cantilever. A number of minor mass elements Am was added on the cantilever's free side. Then in each case, a new resonance frequency was found; this led to obtain the Am values from shifts of resonance frequencies. Finally, those values were compared with CAD model values.

  1. Raman Scattering Studies in Dilute Magnetic Semiconductor Zn(1-x)Co(x)O

    Science.gov (United States)

    Samanta, K.; Bhattacharya, P.; Katiyar, R. S.; Iwamoto, W.; Pagiluso, P. G.; Rettori, C.

    2006-01-01

    Raman spectra of ZnO and Co substituted Zn1-xCoxO (ZCO) were carried out using the Raman microprobe system with an p.,+ ion laser source of 514.5 nm wavelength. The shift towards the lower frequency side of the nonpolar E210w mode and the broadening due to Co substitution in ZnO were analyzed using the phonon confinement model. The magnetic measurements showed ferromagnetic behavior with the maximum saturation magnetization (1.2micron Beta/ErCo) for 10% Co substitution, which decreased wi th at further increase in Co concentrations. The intensities of E1(LO) at 584 cm-1 and multiphonon modes at 540 cm-1 were increased with an increase in Co substitution. The additional Raman modes in ceramic targets of ZCO spectra for higher concentration of Co substitution (x=15%-20%) were identified to be due to the spinel ZnCo2O4 secondary phase.

  2. 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.

  3. Analysis of Excitation and Dead Vibration Modes of Quartz Resonators

    Directory of Open Access Journals (Sweden)

    Zi-Gui Huang

    2014-01-01

    Full Text Available This study uses the finite element method (FEM to analyze the excitation and dead vibration modes of two-dimensional quartz plates. We first simplify three-dimensional quartz plates with plane strain simplification and then compare the modes of the simplified three-dimensional plates to those of two-dimensional plates. We then analyze quartz vibrating elements of AT-cut plates and SC-cut plates. To understand the regularity of the resonance frequency of plates that are excitable by voltage loading, we compare the natural vibrations of quartz plates with the excitation frequency generated after the plates are excited by voltage loading.

  4. Influence of the Mesh Parameters on Stresses and Strains in FEM Analysis of a Gear Housing

    Directory of Open Access Journals (Sweden)

    Vasile Cojocaru

    2013-09-01

    Full Text Available The influence of the mesh parameters on the results of FEM simulations depends on the type of the study and the geometry of the system submitted to analyze. In this paper a gear housing was submitted to static analysis. Six studies with distinct values for the maximum dimensions of mesh elements were applied. The results show significant differences for the values of maximum stresses and relatively small differences for the maximum displacements and strains.

  5. 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

  6. 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

  7. 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

  8. 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

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

    International Nuclear Information System (INIS)

    Cho, Taewon; Jeong, Gwan Yoon; Lee, Cheol Min; Sohn Dongseong

    2014-01-01

    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

  10. 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 compression * image compression * adaptive hp-FEM Subject RIV: JA - Electronics ; Optoelectronics, Electrical Engineering http://www.global-sci.org/aamm

  11. 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...

  12. 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

  13. Raman peak frequencies of fluoromethane molecules measured in clathrate hydrate crystals: experimental investigations and density functional theory calculations.

    Science.gov (United States)

    Uchida, Tsutomu; Ohmura, Ryo; Hori, Akira

    2010-01-14

    Systematic observations of fluoromethane clathrate hydrates were carried out by Raman spectroscopy. The series of fluoromethanes, i.e., methane (CH(4)), fluoromethane (CH(3)F), difluoromethane (CH(2)F(2)), trifluoromethane (CHF(3)), and tetrafluoromethane (CF(4)), were used as standard guest molecules to investigate the vibration modes of the guest molecules in the hydrate phase, since all of these fluoromethanes are included in the same crystal structure and share similar functional groups. In this study, both the C-H and C-F vibration modes of the guest molecules were systematically collected and assigned each peak based on the density functional theory (DFT) calculations. The Raman peak table obtained by the DFT calculations was useful for assigning the Raman peaks measured by the experiments. The assignment of the Raman peaks of the C-H stretching mode of each fluoromethane hydrate coincided well with those estimated both experimentally and theoretically in previous studies. The empirical "loose cage-tight cage" model of the Raman peak shifts allowed us to estimate the unperturbed frequencies of the C-H symmetric stretching mode on CH(3)F molecules in the clathrate structure. Clathrate hydrates formed with deuterated water molecules indicated that the deuterium had little effect on the Raman spectra of the intramolecular vibration modes of the guest molecules within the experimental uncertainties.

  14. Optimization of Vibration Reduction Ability of Ladder Tracks by FEM Coupled with ACO

    Directory of Open Access Journals (Sweden)

    Hao Jin

    2015-01-01

    Full Text Available Ladder track, which has drawn increased attention in scientific communities, is an effective method for reducing vibrations from underground railways. In order to optimize the vibration reduction ability of ladder track, a new method, that is, the finite element method (FEM coupled with ant colony optimization (ACO, has been proposed in this paper. We describe how to build the FEM model verified by the vibration tests in the Track Vibration Abatement and Control Laboratory and how to couple the FEM with ACO. The density and elasticity modulus of the sleeper pad are optimized using this method. After optimization, the vibration acceleration level of the supporting platform in the 1–200 Hz range was reduced from 102.8 dB to 94.4 dB. The optimized density of the sleeper pad is 620 kg/m3, and the optimized elasticity modulus of the sleeper pad is 6.25 × 106 N/m2.

  15. 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.

  16. 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

  17. Raman spectroscopic study of synthetic pyrope-grossular garnets: structural implications

    Science.gov (United States)

    Du, Wei; Han, Baofu; Clark, Simon Martin; Wang, Yichuan; Liu, Xi

    2017-06-01

    A study of the effect of substitution of Mg and Ca in garnet solid solution (Grtss) was carried out using Raman spectroscopy to probe changes to the crystal lattice. The garnet solid solutions with composition changing along pyrope (Py; Mg3Al2Si3O12) and grossular (Gr; Ca3Al2Si3O12) binary were synthesized from glass at 6 GPa and 1400 °C and a second series of Grtss with composition Py40Gr60 were synthesized at 6 GPa but different temperatures from 1000 to 1400 °C. Raman mode assignments were made based on a comparison with the two end members pyrope and grossular, which show consistent result with literature study on single crystals data. The correlation between the Raman mode frequencies and compositional changes along the pyrope-grossular binary suggests a two-mode behavior for Mg and Ca cations in the garnet structure. The full widths at half-maximum of selected Raman modes increase on moving away from the end members and are about double the end-member values in the mid-position, where the frequencies closely linearly change with composition. The frequencies of the translational modes of the SiO4 tetrahedron (T(SiO4)) show large deviations from linearity indicating a strong kinematic coupling with the translational modes of the Ca and Mg cations. The anomalies in T(SiO4) are linked to mixing unit cell volume, suggesting that the nonlinear mixing volume behavior along the pyrope-grossular binary is related to the resistance of the Si-O bond to expansion and compression, which is caused by substitution of Mg and Ca cations in the dodecahedral sites. Annealing temperature also shows effect on Raman mode frequencies, but the main factor controlling the changes in mode frequencies along pyrope-grossular binary is composition.

  18. Raman spectroscopic study of synthetic pyrope-grossular garnets: structural implications

    Science.gov (United States)

    Du, Wei; Han, Baofu; Clark, Simon Martin; Wang, Yichuan; Liu, Xi

    2018-02-01

    A study of the effect of substitution of Mg and Ca in garnet solid solution (Grtss) was carried out using Raman spectroscopy to probe changes to the crystal lattice. The garnet solid solutions with composition changing along pyrope (Py; Mg3Al2Si3O12) and grossular (Gr; Ca3Al2Si3O12) binary were synthesized from glass at 6 GPa and 1400 °C and a second series of Grtss with composition Py40Gr60 were synthesized at 6 GPa but different temperatures from 1000 to 1400 °C. Raman mode assignments were made based on a comparison with the two end members pyrope and grossular, which show consistent result with literature study on single crystals data. The correlation between the Raman mode frequencies and compositional changes along the pyrope-grossular binary suggests a two-mode behavior for Mg and Ca cations in the garnet structure. The full widths at half-maximum of selected Raman modes increase on moving away from the end members and are about double the end-member values in the mid-position, where the frequencies closely linearly change with composition. The frequencies of the translational modes of the SiO4 tetrahedron (T(SiO4)) show large deviations from linearity indicating a strong kinematic coupling with the translational modes of the Ca and Mg cations. The anomalies in T(SiO4) are linked to mixing unit cell volume, suggesting that the nonlinear mixing volume behavior along the pyrope-grossular binary is related to the resistance of the Si-O bond to expansion and compression, which is caused by substitution of Mg and Ca cations in the dodecahedral sites. Annealing temperature also shows effect on Raman mode frequencies, but the main factor controlling the changes in mode frequencies along pyrope-grossular binary is composition.

  19. State-by-State Investigation of Destructive Interference in Resonance Raman Spectra of Neutral Tyrosine and the Tyrosinate Anion with the Simplified Sum-over-States Approach

    OpenAIRE

    Cabalo, Jerry B.; Saikin, Semion K.; Emmons, Erik D.; Rappoport, Dmitrij; Aspuru-Guzik, Alan

    2014-01-01

    UV resonance Raman scattering is uniquely sensitive to the molecular electronic structure as well as intermolecular interactions. To better understand the relationship between electronic structure and resonance Raman cross section, we carried out combined experimental and theoretical studies of neutral tyrosine and the tyrosinate anion. We studied the Raman cross sections of four vibrational modes as a function of excitation wavelength, and we analyzed them in terms of the contributions of th...

  20. Pressure dependence of the lattice dynamics of diaspore, α-AlO(OH), from Raman spectroscopy and density functional perturbation theory

    Science.gov (United States)

    San Juan-Farfán, Roberto E.; Bayarjargal, Lkhamsuren; Winkler, Björn; Haussühl, Eiken; Avalos-Borja, Miguel; Refson, Keith; Milman, Victor

    2011-10-01

    We have measured the pressure-induced change in the lattice dynamics of diaspore, α-AlO(OH), by in situ Raman spectroscopy up to 25 GPa. The spectra are evaluated by density functional perturbation theory-based atomistic model calculations. The assignment of calculated to experimentally observed Raman bands is based on the calculation of Raman intensities. We discuss the accuracy of the approach employed for these calculations and explain the relative magnitudes of mode Grüneisen parameters.

  1. 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.

  2. Application of Finite Element Method (FEM for definition of the relationship between properties of laser alloyed steel surface layer

    Directory of Open Access Journals (Sweden)

    A. Śliwa

    2017-01-01

    Full Text Available Investigations include FEM simulation model of alloying the PMHSS6-5-3 steel surface layer with the carbides and ceramic powders, especially WC, VC, TiC, SiC, Si3N4 and Al2O3 particles using the high power diode laser (HPDL. The FEM computations were performed using ANSYS software. The scope of FEM simulation was determination of temperature distribution during laser alloying process at various process configurations regarding laser beam power and method of powder deposition, as pre coated past or surface with machined grooves. The FEM simulation allows specifying the heat affected zone and the temperature distribution in the sample as a function of time and thus allows the estimation of the structural changes taking place during laser alloying process.

  3. 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.

  4. UV Excited Photoacoustic Raman

    Energy Technology Data Exchange (ETDEWEB)

    Carter, J. Chance [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Chambers, David H. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Steele, Paul T. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Haugen, Peter [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Heller, Don [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)

    2013-11-15

    To summarize, our efforts and findings are as follows: we analyzed the theoretical system performance using known PARS theory coupled with an acoustic detector model to estimate the expected signal-­to-noise ratio (SNR). The system model comprised a mathematical model of the Raman process leading to a prediction of the temperature change in the active region; a thermoacoustic gas prediction of the radiated pressure field (amplitude and pulse shape); and the receiver response for an acoustic microphone, including a simple model of the receiver circuitry (filters, integrators, etc.). Based on the PARS experimental parameters in Appendix B, the model predicted a PARS signal with pressure peak of 7 Pa and duration slightly longer than 2 ms at a distance of 7 mm from the focal spot when acoustic dissipation is not included. An analytical model of a PARS signal with acoustic dissipation was constructed but the numerical calculation is limited to gains of <1% of the experimental value. For these lower gains, the model predicts spreading of the signal.

  5. Enhanced Raman Monitor Project

    Science.gov (United States)

    Westenskow, Dwayne

    1996-01-01

    Monitoring of gaseous contaminants stems from the need to ensure a healthy and safe environment. NASA/Ames needs sensors that are able to monitor common atmospheric gas concentrations as well as trace amounts of contaminant gases. To provide an accurate assessment of air quality, a monitoring system would need to be continuous and on-line with full spectrum capabilities, allowing simultaneous detection of all gas components in a sample, including both combustible and non-combustible gases. The system demands a high degree of sensitivity to detect low gas concentrations in the low-ppm and sub-ppm regions. For clean and healthy air ('good' category), criteria established by the EPA requires that contaminant concentrations not exceed 4 ppm of carbon monoxide (CO) in an 8 hour period, 60 ppb of ozone(O3) in a one hour period and 30 ppb of sulfur dioxide (SO2) in a 24 hour period. One step below this is the National Ambient Air Quality Standard ('moderate' category) which requires that contaminant concentrations not exceed 9 ppm of carbon monoxide (CO), 120 ppb of ozone (O3) and 140 ppb of sulfur dioxide (SO2) for their respective time periods. Ideally a monitor should be able to detect the concentrations specified in the 'good' category. To benchmark current abilities of Raman technology in gas phase analysis, laboratory experiments were performed to evaluate the RASCAL II anesthetic gas monitor.

  6. 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.

  7. Probing inhomogeneous composition in core/shell nanowires by Raman spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Amaduzzi, F.; Alarcón-Lladó, E.; Russo-Averchi, E.; Matteini, F.; Heiß, M.; Tütüncüoglu, G.; Conesa-Boj, S.; Fontcuberta i Morral, A. [Laboratoire des Matériaux Semiconducteurs, École Polytechnique Fédérale de Lausanne, 1015 Lausanne (Switzerland); Mata, M. de la [Institut de Ciència de Materials de Barcelona (ICMAB-CSIC), Campus de la UAB, 08193 Bellaterra, CAT (Spain); Arbiol, J. [Institut de Ciència de Materials de Barcelona (ICMAB-CSIC), Campus de la UAB, 08193 Bellaterra, CAT (Spain); Institució Catalana de Recerca i Estudis Avançats (ICREA), 08019 Barcelona, CAT (Spain)

    2014-11-14

    Due to its non-destructive and its micro-spatial resolution, Raman spectroscopy is a powerful tool for a rapid structural and compositional characterization of nanoscale materials. Here, by combining the compositional dependence of the Raman peaks with the existence of photonic modes in the nanowires, we address the composition inhomogeneities of Al{sub x}Ga{sub 1−x}As/GaAs core/shell structures. The experimental results are validated with complementary chemical composition maps of the nanowire cross-sections and finite-difference time-domain simulations of the photonic modes.

  8. Intelligent Autofeedback and Safety Early-Warning for Underground Cavern Engineering during Construction Based on BP Neural Network and FEM

    OpenAIRE

    Xu, Lei; Zhang, Taijun; Ren, Qingwen

    2015-01-01

    The low efficiency of feedback analysis is one of the main shortcomings in the construction of underground cavern engineering. With this in mind, a method of intelligent autofeedback and safety early-warning for underground cavern is proposed based on BP neural network and FEM. The training sample points are chosen by using uniform test design method, and the autogeneration of FEM calculation file for ABAQUS is realized by using the technique of file partition, information grouping, and order...

  9. Penetration of Rod Projectiles in Semi-Infinite Targets: A Validation Test for Eulerian X-FEM in Alegra

    Science.gov (United States)

    2013-03-12

    ADDRESS(ES) Sandia National Laboratories, Geomechanics Department,P.O. Box 5800,Albuquerque,NM,87185 8. PERFORMING ORGANIZATION REPORT NUMBER 9...X-FEM is found to produce good results for this classical impact and penetration problem. 15. SUBJECT TERMS 16. SECURITY CLASSIFICATION OF: 17...a validation test for Eulerian X-FEM in ALEGRA Byoung Yoon Park1, R. Brian Leavy 2, and John H. J. Niederhaus3 1- Geomechanics Department Sandia

  10. In situ Raman spectroelectrochemical study of 13C-labeled fullerene peapods and carbon nanotubes.

    Science.gov (United States)

    Kalbác, Martin; Kavan, Ladislav; Zukalová, Markéta; Dunsch, Lothar

    2007-10-01

    C60 fullerene peapods and double-walled carbon nanotubes (DWCNTs) containing highly 13C enriched C60 and inner tubes, respectively, are studied using Raman spectroscopy and in situ Raman spectroelectrochemistry in order to follow the influence of 13C enrichment on the vibrational pattern of these carbon nanostructures. The Raman response of 13C60 after encapsulation in fullerene peapods differs from that of isotope-natural species, (Nat)C60. The Raman A(g)(2) mode of encapsulated 13C60 is upshifted in frequency compared to that of the (Nat)C60 peapods with the same filling factor. The chemical doping of 13C60 peapods (peapod = C(60)@SWCNT) with K-vapor leads to the downshift of the A(g)(2) mode, similar to the case of (Nat)C60 peapods. The 13C60 peapods were successfully transformed into DWCNTs, which confirms high filling of single-walled (SW) CNTs with 13C60. The DWCNTs exhibited distinctly downshifted G and D Raman modes for inner tubes, which proves that only inner tubes were enriched by 13C. The in situ Raman spectroelectrochemistry of (Nat)C60 exhibits strong anodic enhancement, while for 13C60 peapods the enhancement is only weak. On the other hand, the electrochemical charging of the inner-tube-labeled DWCNTs (13C(i)-DWCNTs) followed the behavior of ordinary (Nat)C(i)-DWCNTs as indicated by in situ Raman spectroelectrochemistry. In addition, the spectroelectrochemical behavior of the G mode of inner tubes in 13C(i)-DWCNTs is followed from the start of the electrochemical doping, which was not feasible for (Nat)C(i)-DWCNTs.

  11. 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

  12. 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.

  13. Matrix Effects in Quantitative Assessment of Pharmaceutical Tablets Using Transmission Raman and Near-Infrared (NIR) Spectroscopy.

    Science.gov (United States)

    Sparén, Anders; Hartman, Madeleine; Fransson, Magnus; Johansson, Jonas; Svensson, Olof

    2015-05-01

    Raman spectroscopy can be an alternative to near-infrared spectroscopy (NIR) for nondestructive quantitative analysis of solid pharmaceutical formulations. Compared with NIR spectra, Raman spectra have much better selectivity, but subsampling was always an issue for quantitative assessment. Raman spectroscopy in transmission mode has reduced this issue, since a large volume of the sample is measured in transmission mode. The sample matrix, such as particle size of the drug substance in a tablet, may affect the Raman signal. In this work, matrix effects in transmission NIR and Raman spectroscopy were systematically investigated for a solid pharmaceutical formulation. Tablets were manufactured according to an experimental design, varying the factors particle size of the drug substance (DS), particle size of the filler, compression force, and content of drug substance. All factors were varied at two levels plus a center point, except the drug substance content, which was varied at five levels. Six tablets from each experimental point were measured with transmission NIR and Raman spectroscopy, and their concentration of DS was determined for a third of those tablets. Principal component analysis of NIR and Raman spectra showed that the drug substance content and particle size, the particle size of the filler, and the compression force affected both NIR and Raman spectra. For quantitative assessment, orthogonal partial least squares regression was applied. All factors varied in the experimental design influenced the prediction of the DS content to some extent, both for NIR and Raman spectroscopy, the particle size of the filler having the largest effect. When all matrix variations were included in the multivariate calibrations, however, good predictions of all types of tablets were obtained, both for NIR and Raman spectroscopy. The prediction error using transmission Raman spectroscopy was about 30% lower than that obtained with transmission NIR spectroscopy.

  14. 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.

  15. 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.)

  16. 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...

  17. Precise determination of graphene functionalization by in situ Raman spectroscopy

    Science.gov (United States)

    Vecera, Philipp; Chacón-Torres, Julio C.; Pichler, Thomas; Reich, Stephanie; Soni, Himadri R.; Görling, Andreas; Edelthalhammer, Konstantin; Peterlik, Herwig; Hauke, Frank; Hirsch, Andreas

    2017-01-01

    The verification of a successful covalent functionalization of graphene and related carbon allotropes can easily be carried out by Raman spectroscopy. Nevertheless, the unequivocal assignment and resolution of individual lattice modes associated with the covalent binding of addends was elusive up to now. Here we present an in situ Raman study of a controlled functionalization of potassium intercalated graphite, revealing several new bands appearing in the D-region of the spectrum. The evolution of these bands with increasing degree of functionalization from low to moderate levels provides a basis for the deconvolution of the different components towards quantifying the extent of functionalization. By complementary DFT calculations we were able to identify the vibrational changes in the close proximity of the addend bearing lattice carbon atoms and to assign them to specific Raman modes. The experimental in situ observation of the developing functionalization along with the reoxidation of the intercalated graphite represents an important step towards an improved understanding of the chemistry of graphene. PMID:28480893

  18. Infrared and Raman Study of the Recluse Spider Silk

    Science.gov (United States)

    Wang, S. L.; Wang, Qijue; Xing, Zhen; Schniepp, H. C.; Qazilbash, M. M.

    Spider silk exhibits remarkable mechanical properties, such as high tensile strength and toughness. We want to gain insight into the composition and structure of spider silk to discover the origin of these properties. We are especially interested in the organization of the crystalline beta sheets that are expected to contribute to the high strength of the silk from the recluse spider, Loxosceles laeta. The recluse spider produces a silk that has a unique geometry amongst arachnids. We measure the silk's optical properties, particularly the infrared-active and Raman-active vibrations. Broadband infrared transmission spectra were collected in the spectral range between 600 cm-1 and 4000 cm-1, with light polarized parallel and perpendicular to the long axis of the silk. Raman micro-spectroscopy was performed in the spectral range 500 cm-1 and 4000 cm- 1 with a 514 nm laser. The infrared and Raman vibrational modes are fit with Lorentzian and pseudo-Voigt functions. The vibrational modes are assigned to specific structures and electronic bonds in the silk. This work was supported by NASA/ Virginia Space Grant Consortium.

  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. 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.

  1. 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.

  2. 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)

  3. 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.

  4. 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.

  5. 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.

  6. First- and second-order Raman scattering from MoTe2 single crystal

    Science.gov (United States)

    Caramazza, Simone; Collina, Arianna; Stellino, Elena; Ripanti, Francesca; Dore, Paolo; Postorino, Paolo

    2018-02-01

    We report on Raman experiments performed on a MoTe2 single crystal. The system belongs to the wide family of transition metal dichalcogenides which includes several of the most interesting two-dimensional materials for both basic and applied physics. Measurements were performed in the standard basal plane configuration, by placing the ab plane of the crystal perpendicular to the wave vector k i of the incident beam to explore the in-plane vibrational modes, and in the edge plane configuration with k i perpendicular to the crystal c axis, thus mainly exciting out-of-plane modes. For both configurations we performed a polarization-dependent study of the first-order Raman components and detailed computation of the corresponding selection rules. We were thus able to provide a complete assignment of the observed first-order Raman peaks, in agreement with previous literature results. A thorough analysis of the second-order Raman bands, as observed in both basal and edge plane configurations, provides new information and allows a precise assignment of these spectral structures. In particular, we have observed and assigned Raman active modes of the M point of the Brillouin zone previously predicted by ab initio calculations but never previously measured.

  7. 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

  8. 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.

  9. Field Raman spectrograph for environmental analysis

    Energy Technology Data Exchange (ETDEWEB)

    Carrabba, M.M.

    1995-03-01

    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.

  10. 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.

  11. Participants' Explanations for Nonadherence in the FEM-PrEP Clinical Trial.

    Science.gov (United States)

    Corneli, Amy; Perry, Brian; McKenna, Kevin; Agot, Kawango; Ahmed, Khatija; Taylor, Jamilah; Malamatsho, Fulufhelo; Odhiambo, Jacob; Skhosana, Joseph; Van Damme, Lut

    2016-04-01

    FEM-PrEP-a clinical trial of daily, oral emtricitabine/tenofovir disoproxil fumarate for HIV prevention among women in sub-Saharan Africa-did not show a reduction in HIV acquisition because of low adherence to the study pill. We conducted a follow-up study to identify reasons for nonadherence. Qualitative, semistructured interviews (n = 88) and quantitative, audio computer-assisted self-interviews (n = 224) were conducted with former FEM-PrEP participants in Bondo, Kenya, and Pretoria, South Africa. Thematic analysis was used to analyze the qualitative data, and descriptive statistics were used to describe audio computer-assisted self-interviews responses. Data are presented within the 5 categories of Ickovics' and Meisler's conceptual framework on adherence: (1) the individual, (2) trial characteristics and study pill regimen, (3) patient-provider relationship, (4) clinical setting, and (5) the disease. Participants' explanations for nonadherence were primarily situated within 3 of the framework's 5 categories: (1) the individual, (2) trial characteristics and study pill regimen, and (3) the disease. Concerns about the investigational nature of the drug being tested and side effects were the prominent reasons reported for nonadherence. Participants also described being discouraged from taking the study pill by members of the community, their sexual partners, and other participants, primarily because of these same concerns. Limited acceptability of the pill's attributes influenced nonadherence for some participants as did concerns about HIV-related stigma. In addition, many participants reported that others continued in FEM-PrEP while not taking the study pill because of the trial's ancillary benefits and visit reimbursement-factors related to the clinical setting. Negative patient-provider relationships were infrequently reported as a factor that influenced nonadherence. Despite substantial study staff engagement with participants and communities, concerns about

  12. 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.

  13. Single Molecule Raman Detection of Enkephalin on Silver Colloidal Particles

    DEFF Research Database (Denmark)

    Kneipp, Katrin; Kneipp, Holger; Abdali, Salim

    2004-01-01

    Enkephalin, an endogeneous substance in the human brain showing morphine-like biological functions, has been detected at the single molecule level based on the surface-enhanced Raman signal of the ring breathing mode of phenylalanine, which is one building block of the molecule. For enhancing...... the Raman signal the enkephalin molecules have been attached to silver colloidal cluster structures. The experiments demonstrate that the SERS signal of the strongly enhanced ring breathing vibration of phenylalanine at 1000 cm-1 can be used as “intrinsic marker” for detecting a single enkephalin molecule...... and for monitoring its diffusion on the surface of the silver colloidal cluster without using a specific label molecule....

  14. 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.

  15. [Raman spectroscopic study on silicone fluid as pressure gauge].

    Science.gov (United States)

    Liu, Jin; Sun, Qiang

    2010-09-01

    Within a diamond-anvil cell, the in-situ Raman spectroscopic study of silicone fluid was operated at room temperature 298. 1 K and under pressures from 0.1 to 5140.2 MPa. The present study analyzed the correlation of the modes 2906 and 2967 cm(-1) with different pressures, indicating that their wavenumbers linearly increased with increasing pressure. Therefore, this provided the potential to consider the pressure medium silicone fluid as a pressure gauge. The result suggested that silicone fluid could be used as a reliable pressure gauge in high-pressure experiments using diamond-anvil cells with Raman spectrometer, and the correlations between pressure and (delta nu p)2906, (delta nu p)2967 are, p = -0.05[(delta nu p)2967]2 + 73.07 (delta nu p)2967 + 91.54 and p = 0.14 [(delta nu p)2906]2 + 81.9 (delta nu p)2906 + 92.01, respectively.

  16. 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.

  17. 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...

  18. 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)

  19. 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...... and capacitors are given based on the proposed thermal modelling process, and the datasheet thermal impedance models and the global ambient temperature....

  20. 3D Analysis of Montesinho CFRD using Code-Aster FEM program

    OpenAIRE

    Marcelino, J.; Manso, J.; Caldeira, L.

    2015-01-01

    This paper describes the setup of a finite element method (FEM) model for the three dimensional simulation of the construction of a concrete face rockfill dam and filling of the its reservoir using the Code-Aster code. The prototype of the study is the 36.5 m high Montesinho dam, located in the north of Portugal near the Spain border, witch is finishing its construction, at the time of the paper writing. The dam is located in the Sabor river in the Montesinho Natural Reserve an...

  1. An X-FEM model of crack propagation in the matrix of randomly reinforced heterogeneous media

    Science.gov (United States)

    Shalimov, A. S.; Tashkinov, M. A.

    2017-12-01

    The paper deals with the development of fracture models for polydisperse inhomogeneous media with random arrangement of inclusions. An extended finite element method (X-FEM) is used, according to which crack growth is described by special enriched functions in combination with additional degrees of freedom. Modeling of crack development is performed in the Abaqus software. The influence of stress concentrators in the form of peculiarities of a heterogeneous structure on the process of crack propagation is investigated, particular cases of representative volume elements are considered.

  2. Study of colloidal particles FemOn-SiO2 synthesized by two different techniques

    Science.gov (United States)

    Gareev, K. G.; Ionin, S. A.; Korolev, D. V.; Luchinin, V. V.; Moshnikov, V. A.; Panov, M. F.; Permyakov, N. V.

    2015-11-01

    Colloidal solutions FemOn-SiO2 were obtained by two different techniques based on sol-gel process: silica cores partially coated by iron oxide particles and iron oxide cores coated by silica. Dried layers were investigated by atomic force microscopy and size distribution was plotted. Chemical contain of dried specimen was analysed by FTIR-spectroscopy. Magnetic properties of colloidal particles obtained by both the techniques were measured by VSM. Resistivity's change under the influence of magnetic field was measured using LCR-meter.

  3. 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)

  4. 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).

  5. 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.

  6. Orbital wave in the Raman scattering cross section of LaMn O3

    Science.gov (United States)

    Purevdorj, Munkhbaatar; Kim, Myung-Whun

    2018-02-01

    We calculated the polarization-dependent Raman scattering cross-section spectra of LaMn O3 below the A -type magnetic ordering temperature. Two strong peaks appear around the Mn O6 octahedra stretching phonon frequency. One mode shows Ag symmetry, while the other mode shows Bg symmetry. We found that the Ag symmetry peak is a Jahn-Teller phonon coupled to the orbital wave and the Bg symmetry peak is an orbital wave mode coupled to a Q2 phonon mode via the Jahn-Teller electron-phonon coupling.

  7. Raman and IR Spectroscopy Studies on Propane at Pressures of Up to 40 GPa.

    Science.gov (United States)

    Kudryavtsev, Daniil; Serovaiskii, Alexander; Mukhina, Elena; Kolesnikov, Anton; Gasharova, Biliana; Kutcherov, Vladimir; Dubrovinsky, Leonid

    2017-08-17

    Raman and IR spectroscopy studies on propane were performed at pressures of up to 40 GPa at ambient temperatures using the diamond anvil cell technique. Propane undergoes three phase transitions at 6.4(5), 14.5(5), and 26.5(5) GPa in Raman spectroscopy and at 7.0(5), 14.0(5), and 27.0(5) GPa in IR spectroscopy. The phase transitions were identified using the Raman and IR splitting modes and the appearance or disappearance of peaks, which clearly corresponded to the changes in the frequencies of the modes as the pressure changed. Our results demonstrate the complex high-pressure behavior of solid propane.

  8. Raman study of oxygen deficient YVO{sub 4} single crystals

    Energy Technology Data Exchange (ETDEWEB)

    Jin, B.M.; Erdei, S.; Bhalla, A.S.; Ainger, F.W. [Pennsylvania State Univ., University Park, PA (United States). Materials Research Lab.

    1995-10-01

    Oxygen deficiency which is an inherent problem in melt grown YVO{sub 4} single crystals was investigated by Micro-Probe Raman Spectroscopy (MPRS). External vibrational modes at 157 cm{sup {minus}1}, 162 cm{sup {minus}1} and selected internal vibrational modes at 379 cm{sup {minus}1}, 840 cm{sup {minus}1} of full Raman spectra were compared with different YVO{sub 4} crystals grown by the Czochralski (CZ) technique both with and without annealing in an O{sub 2} atmosphere as well as by top seeded solution growth technique (TSSG) in directly produced oxygen deficiency-free form. Special differences of above mentioned frequencies and over 1,000 cm{sup {minus}1} were observed in the Raman spectra, which could prove that the growth technologies generated different rates of oxygen deficiency in addition to critical intrinsic segregation effects in YVO{sub 4} which significantly determine the crystal quality.

  9. 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.

  10. High-pressure Raman study and lattice dynamical calculations for SrWO4

    International Nuclear Information System (INIS)

    Christofilos, D; Papagelis, K; Ves, S; Kourouklis, G A; Raptis, C

    2002-01-01

    A high-pressure Raman study of SrWO 4 reveals a pressure induced phase transition starting at 11.5 GPa. Several Raman lines exhibit a nonlinear behaviour in the pressure range of 11.5-15 GPa, which can be attributed to either stabilization of the high-pressure phase or an intermediate phase. Using a theoretical lattice dynamical calculation, based on an empirical potential model, we have obtained the Raman active mode eigenvectors giving us an insight into the phase transition mechanism. The lowest-frequency mode exhibits a negative pressure slope in the scheelite phase and involves a motion of the WO 4 tetrahedron as a whole according to the theoretical results. The experimental evidence suggests that the structure of the high-pressure phase is closely related to the scheelite structure, being formed by closely lying distorted WO 4 tetrahedra rather than involving an octahedrally coordinated W ion

  11. 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 .

  12. 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

  13. 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.

  14. Penetration of rod projectiles in semi-infinite targets : a validation test for Eulerian X-FEM in ALEGRA.

    Energy Technology Data Exchange (ETDEWEB)

    Park, Byoung Yoon; Leavy, Richard Brian [U.S. Army Research Laboratory, Aberdeen Proving Grounds, MD; Niederhaus, John Henry J.

    2013-03-01

    The finite-element shock hydrodynamics code ALEGRA has recently been upgraded to include an X-FEM implementation in 2D for simulating impact, sliding, and release between materials in the Eulerian frame. For validation testing purposes, the problem of long-rod penetration in semi-infinite targets is considered in this report, at velocities of 500 to 3000 m/s. We describe testing simulations done using ALEGRA with and without the X-FEM capability, in order to verify its adequacy by showing X-FEM recovers the good results found with the standard ALEGRA formulation. The X-FEM results for depth of penetration differ from previously measured experimental data by less than 2%, and from the standard formulation results by less than 1%. They converge monotonically under mesh refinement at first order. Sensitivities to domain size and rear boundary condition are investigated and shown to be small. Aside from some simulation stability issues, X-FEM is found to produce good results for this classical impact and penetration problem.

  15. 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

  16. Raman spectroelectrochemistry of index-identified metallic carbon nanotubes: the resonance rule revisited

    Czech Academy of Sciences Publication Activity Database

    Kavan, Ladislav; Kalbáč, Martin; Zukalová, Markéta; Dunsch, L.

    2006-01-01

    Roč. 243, č. 13 (2006), s. 3130-3133 ISSN 0370-1972 R&D Projects: GA MŠk LC510; GA AV ČR IAA4040306 Institutional research plan: CEZ:AV0Z40400503 Keywords : electrochemistry * Raman spectroelectrochemistry * radial breathing mode Subject RIV: CG - Electrochemistry Impact factor: 0.967, year: 2006

  17. Raman spectrometer with microprobe capability

    Science.gov (United States)

    Boyd, J. T.; Jackson, H. E.

    1986-01-01

    This report describes the results of this equipment grant funded as a part of the Department of Defense (DOD) University Research Instrumentation Program. This grant funded the purchase of a Raman spectrometer with microprobe capability having resolution of 1.0 micron. This report describes the equipment selecting decision, the configuration of the instrument selected, and some experimental results. The experimental results include Raman spectra used in characterization of laser recrystallized silicon and ion implanted regions in semi-insulating GaAs. The Raman microprobe can be used to characterize the effects of substrate temperature, beam power density and shape, beam scan speed and direction, deposition rate, substrate seeding, and polysilicon encapsulation schemes both near and away from grain boundaries. The frequency shift and the peak width of the Raman scattering from the triply degenerate zone center phonon in Si allow determination of the strain in the grains of laser recrystallized polysilicon. Reducing these strains will allow us to achieve large single grains of device quality.

  18. A coupled BEM-FEM method for finite strain magneto-elastic boundary-value problems

    Science.gov (United States)

    Nedjar, B.

    2017-05-01

    The first objective of this contribution is the formulation of nonlinear problems in magneto-elasticity involving finite geometry of the surrounding free space. More specifically for the magnetic part of the problem, the surrounding free space is described by means of a boundary integral equation for which boundary elements are used that are appropriately coupled with the finite element discretization used inside the material. The second objective is to develop a numerical strategy to solve the strongly coupled magneto-mechanics problem at hand. Herein we provide a staggered scheme consisting of a magnetostatic resolution employing the above coupled BEM-FEM procedure at fixed deformation, followed by a mechanical resolution at fixed magnetic fields. This decoupled method renders the whole solution strategy very appealing since, among others, the first BEM-FEM resolution is linear for some prototype models, and the remaining mechanical resolution is analogous to nowadays classical nonlinear elastostatic problems in the finite strain range. Some nonlinear boundary-value problems are simulated to demonstrate the applicability of the proposed framework.

  19. FEM simulation of the size and constraining effect in lead free solder joints

    Directory of Open Access Journals (Sweden)

    Lederer M.

    2012-06-01

    Full Text Available Due to the ongoing miniaturization in microelectronics, the influence of dimensional constraining effects on the strength of solder joints becomes increasingly important. Detailed investigations show a strong dependence of tensile strength and ductility on solder geometry. This paper focuses on FEM simulations of the thickness effect of Sn-3.5Ag solder gaps under tensile load. Solder joints and copper base material are simulated with an elasto-plastic material model in the framework of von Mises plasticity. Within the solder material a pronounced triaxiality of stress is observed. In consequence, the von Mises stress inside the solder material is considerably smaller than the longitudinal stress along the tensile axis. This leads to increased tensile strength of thin solder joints. However, the increase of strength also depends on the yield stress of the copper base material. The FEM simulations were compared with experimental results of tensile tests and satisfactory coincidence was found. The remaining deviation between experiment and simulation is explained by pressure dependency of the flow stress. In conclusion, a new pressure dependent plasticity model is suggested.

  20. FEM Analysis of Mandibular Prosthetic Overdenture Supported by Dental Implants: Evaluation of Different Retention Methods

    Directory of Open Access Journals (Sweden)

    M. Cicciù

    2015-01-01

    Full Text Available Prosthetic rehabilitation of total edentulous jaws patients is today a common technique that clinicians approach in their daily practice. The use of dental implants for replacing missing teeth is going to be a safe technique and the implant-prosthetic materials give the possibility of having long-term clinical success. Aim of this work is to evaluate the mechanical features of three different prosthetic retention systems. By applying engineering systems of investigations like FEM and von Mises analyses, how the dental implant material holds out against the masticatory strength during the chewing cycles has been investigated. Three common dental implant overdenture retention systems have been investigated. The ball attachment system, the locator system, and the common dental abutment have been processed by Ansys Workbench 15.0 and underwent FEM and von Mises investigations. The elastic features of the materials used in the study have been taken from recent literature data. Results revealed different response for both types of device, although locator system showed better results for all conditions of loading. The data of this virtual model show all the features of different prosthetic retention systems under the masticatory load. Clinicians should find the better prosthetic solution related to the patients clinical condition in order to obtain long-term results.

  1. Hydro-elastic analysis of marine propellers based on a BEM-FEM coupled FSI algorithm

    Directory of Open Access Journals (Sweden)

    Hyoungsuk Lee

    2014-09-01

    Full Text Available A reliable steady/transient hydro-elastic analysis is developed for flexible (composite marine propeller blade design which deforms according to its environmental load (ship speed, revolution speed, wake distribution, etc. Hydro-elastic analysis based on CFD and FEM has been widely used in the engineering field because of its accurate results however it takes large computation time to apply early propeller design stage. Therefore the analysis based on a boundary element method-Finite Element Method (BEM-FEM Fluid-Structure Interaction (FSI is introduced for computational efficiency and accuracy. The steady FSI analysis, and its application to reverse engineering, is designed for use regarding optimum geometry and ply stack design. A time domain two-way coupled transient FSI analysis is developed by considering the hydrodynamic damping ffects of added mass due to fluid around the propeller blade. The analysis makes possible to evaluate blade strength and also enable to do risk assessment by estimating the change in performance and the deformation depending on blade position in the ship's wake. To validate this hydro-elastic analysis methodology, published model test results of P5479 and P5475 are applied to verify the steady and the transient FSI analysis, respectively. As the results, the proposed steady and unsteady analysis methodology gives sufficient accuracy to apply flexible marine propeller design.

  2. An arbitrary boundary with ghost particles incorporated in coupled FEM-SPH model for FSI problems

    Science.gov (United States)

    Long, Ting; Hu, Dean; Wan, Detao; Zhuang, Chen; Yang, Gang

    2017-12-01

    It is important to treat the arbitrary boundary of Fluid-Structure Interaction (FSI) problems in computational mechanics. In order to ensure complete support condition and restore the first-order consistency near the boundary of Smoothed Particle Hydrodynamics (SPH) method for coupling Finite Element Method (FEM) with SPH model, a new ghost particle method is proposed by dividing the interceptive area of kernel support domain into subareas corresponding to boundary segments of structure. The ghost particles are produced automatically for every fluid particle at each time step, and the properties of ghost particles, such as density, mass and velocity, are defined by using the subareas to satisfy the boundary condition. In the coupled FEM-SPH model, the normal and shear forces from a boundary segment of structure to a fluid particle are calculated through the corresponding ghost particles, and its opposite forces are exerted on the corresponding boundary segment, then the momentum of the present method is conservation and there is no matching requirements between the size of elements and the size of particles. The performance of the present method is discussed and validated by several FSI problems with complex geometry boundary and moving boundary.

  3. 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.

  4. 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

  5. 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.

  6. 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.

  7. Raman spectroscopy of bone metastasis

    Science.gov (United States)

    Esmonde-White, Karen A.; Sottnik, Joseph; Morris, Michael; Keller, Evan

    2012-02-01

    Raman spectroscopy of bone has been used to characterize chemical changes occurring in diseases such as osteoporosis, osteoarthritis and osteomyelitis. Metastasis of cancer into bone causes changes to bone quality that are similar to those observed in osteoporosis, such as decreased bone strength, but with an accelerated timeframe. In particular, osteolytic (bone degrading) lesions in bone metastasis have a marked effect on patient quality of life because of increased risk of fractures, pain, and hypercalcemia. We use Raman spectroscopy to examine bone from two different mouse models of osteolytic bone metastasis. Raman spectroscopy measures physicochemical information which cannot be obtained through standard biochemical and histological measurements. This study was reviewed and approved by the University of Michigan University Committee on the Care and Use of Animals. Two mouse models of prostate cancer bone metastasis, RM1 (n=3) and PC3-luc (n=4) were examined. Tibiae were injected with RM1 or PC3-luc cancer cells, while the contralateral tibiae received a placebo injection for use as controls. After 2 weeks of incubation, the mice were sacrificed and the tibiae were examined by Raman microspectroscopy (λ=785 nm). Spectroscopic markers corresponding to mineral stoichiometry, bone mineralization, and mineral crystallinity were compared in spectra from the cancerous and control tibiae. X-ray imaging of the tibia confirmed extensive osteolysis in the RM1 mice, with tumor invasion into adjoining soft tissue and moderate osteolysis in the PC3-luc mice. Raman spectroscopic markers indicate that osteolytic lesions are less mineralized than normal bone tissue, with an altered mineral stoichiometry and crystallinity.

  8. 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.

  9. Raman spectroscopic features of Al- Fe3+- poor magnesiochromite and Fe2+- Fe3+- rich ferrian chromite solid solutions

    Science.gov (United States)

    Kharbish, Sherif

    2017-08-01

    Naturally occurring Al- Fe3 +- poor magnesiochromite and Fe2+- Fe3 +- rich ferrian chromite solid solutions have been analyzed by micro-Raman spectroscopy. The results reflect a strong positive correlation between the Fe3 + # [Fe3+/(Fe3 ++Cr + Al)] and the positions of all Raman bands. A positive correlation of the Raman band positions with Mg# [Mg/(Mg + Fe2 +)] is less stringent. Raman spectra of magnesiochromite and ferrian chromite show seven and six bands, respectively, in the spectral region of 800 - 100 cm- 1. The most intense band in both minerals is identified as symmetric stretching vibrational mode, ν 1(A 1g ). In the intermediate Raman-shift region (400-600 cm- 1), the significant bands are attributed to the ν 3(F 2g ) > ν 4(F 2g ) > ν 2(E g ) modes. The bands with the lowest Raman shifts (< 200 cm- 1) are assigned to F 2g (trans) translatory lattice modes. Extra bands in magnesiochromite (two bands) and in ferrian chromite (one weak band) are attributed to lowering in local symmetry and order/disorder effects.

  10. 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 contour method. The computed stress field is transferred to a DBEM environment and superimposed to the stress field produced by a remote fatigue traction load applied on a friction stir welded cracked specimen. Numerical results are compared with experimental data showing good agreement and highlighting...... 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...

  11. An FEM Analysis with Consideration of Random Void Defects for Predicting the Mechanical Properties of 3D Braided Composites

    Directory of Open Access Journals (Sweden)

    Kun Xu

    2014-01-01

    Full Text Available Random void defects have detrimental effect on the mechanical properties of 3D braided composites. A 3D FEM based on a periodic representative unit cell is developed to appraise the mechanical properties of 3D 4-directional braided composites containing the defects. Two basic types of void defects, such as the dry patches in the reinforced yarns and the voids in the resin matrix pocket, have been taken into account. A simple method for generating the random void defect elements in FEM is presented. The FE software ABAQUS is adopted to study the elastic properties. The predicted effective elastic properties are in good agreement with the available experimental data, demonstrating the applicability of the mesomechanical FEM. By considering the random distribution of void defects, the probability statistics analysis of mechanical properties was conducted. In addition, the effect of the void volume fraction on the elastic properties was discussed in detail, and some useful conclusions were drawn herein.

  12. 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.

  13. Raman and Surface-Enhanced Raman Scattering for Biofilm Characterization

    Directory of Open Access Journals (Sweden)

    Seda Keleştemur

    2018-01-01

    Full Text Available Biofilms are a communal way of living for microorganisms in which microorganism cells are surrounded by extracellular polymeric substances (EPS. Most microorganisms can live in biofilm form. Since microorganisms are everywhere, understanding biofilm structure and composition is crucial for making the world a better place to live, not only for humans but also for other living creatures. Raman spectroscopy is a nondestructive technique and provides fingerprint information about an analyte of interest. Surface-enhanced Raman spectroscopy is a form of this technique and provides enhanced scattering of the analyte that is in close vicinity of a nanostructured noble metal surface such as silver or gold. In this review, the applications of both techniques and their combination with other biofilm analysis techniques for characterization of composition and structure of biofilms are discussed.

  14. 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.

  15. 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.

  16. 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.

  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. 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.

  19. Sphingomyelin distribution in lipid rafts of artificial monolayer membranes visualized by Raman microscopy.

    Science.gov (United States)

    Ando, Jun; Kinoshita, Masanao; Cui, Jin; Yamakoshi, Hiroyuki; Dodo, Kosuke; Fujita, Katsumasa; Murata, Michio; Sodeoka, Mikiko

    2015-04-14

    Sphingomyelin (SM) and cholesterol (chol)-rich domains in cell membranes, called lipid rafts, are thought to have important biological functions related to membrane signaling and protein trafficking. To visualize the distribution of SM in lipid rafts by means of Raman microscopy, we designed and synthesized an SM analog tagged with a Raman-active diyne moiety (diyne-SM). Diyne-SM showed a strong peak in a Raman silent region that is free of interference from intrinsic vibrational modes of lipids and did not appear to alter the properties of SM-containing monolayers. Therefore, we used Raman microscopy to directly visualize the distribution of diyne-SM in raft-mimicking domains formed in SM/dioleoylphosphatidylcholine/chol ternary monolayers. Raman images visualized a heterogeneous distribution of diyne-SM, which showed marked variation, even within a single ordered domain. Specifically, diyne-SM was enriched in the central area of raft domains compared with the peripheral area. These results seem incompatible with the generally accepted raft model, in which the raft and nonraft phases show a clear biphasic separation. One of the possible reasons is that gradual changes of SM concentration occur between SM-rich and -poor regions to minimize hydrophobic mismatch. We believe that our technique of hyperspectral Raman imaging of a single lipid monolayer opens the door to quantitative analysis of lipid membranes by providing both chemical information and spatial distribution with high (diffraction-limited) spatial resolution.

  20. Spatial characterization of a 2 in GaN wafer by Raman spectroscopy and capacitance-voltage measurements

    International Nuclear Information System (INIS)

    Huang, Y; Chen, X D; Fung, S; Beling, C D; Ling, C C

    2004-01-01

    Micro-Raman spectroscopy and capacitance-voltage (C-V) measurements have been used to investigate 2 in GaN epitaxial wafers grown by hydride vapour phase epitaxy on sapphire substrates. The position and line shape of the A 1 longitudinal optical (LO) phonon mode were used to determine the carrier concentration at different locations across the wafer. The line-shape fitting of the Raman A 1 (LO) coupled modes taken from horizontal lateral-different positions on the wafer yielded a rudimentary spatial map of the carrier concentration. These data compare well with a carrier density map of the wafer obtained by C-V measurements, confirming the non-uniform distribution of carrier concentration in the GaN epitaxial film and that Raman spectroscopy of the LO phonon-plasmon mode can be used as a reliable and production friendly wafer quality test for GaN wafer manufacturing processes

  1. Raman effect in icosahedral boron-rich solids

    Directory of Open Access Journals (Sweden)

    Helmut Werheit, Volodymyr Filipov, Udo Kuhlmann, Ulrich Schwarz, Marc Armbrüster, Andreas Leithe-Jasper, Takaho Tanaka, Iwami Higashi, Torsten Lundström, Vladimir N Gurin and Maria M Korsukova

    2010-01-01

    Full Text Available We present Raman spectra of numerous icosahedral boron-rich solids having the structure of α-rhombohedral, β-rhombohedral, α-tetragonal, β-tetragonal, YB66, orthorhombic or amorphous boron. The spectra were newly measured and, in some cases, compared with reported data and discussed. We emphasize the importance of a high signal-to-noise ratio in the Raman spectra for detecting weak effects evoked by the modification of compounds, accommodation of interstitial atoms and other structural defects. Vibrations of the icosahedra, occurring in all the spectra, are interpreted using the description of modes in α-rhombohedral boron by Beckel et al. The Raman spectrum of boron carbide is largely clarified. Relative intra- and inter-icosahedral bonding forces are estimated for the different structural groups and for vanadium-doped β-rhombohedral boron. The validity of Badger's rule is demonstrated for the force constants of inter-icosahedral B–B bonds, whereas the agreement is less satisfactory for the intra-icosahedral B–B bonds.

  2. Terahertz mechanical vibrations in lysozyme: Raman spectroscopy vs modal analysis

    Science.gov (United States)

    Carpinteri, Alberto; Lacidogna, Giuseppe; Piana, Gianfranco; Bassani, Andrea

    2017-07-01

    The mechanical behaviour of proteins is receiving an increasing attention from the scientific community. Recently it has been suggested that mechanical vibrations play a crucial role in controlling structural configuration changes (folding) which govern proteins biological function. The mechanism behind protein folding is still not completely understood, and many efforts are being made to investigate this phenomenon. Complex molecular dynamics simulations and sophisticated experimental measurements are conducted to investigate protein dynamics and to perform protein structure predictions; however, these are two related, although quite distinct, approaches. Here we investigate mechanical vibrations of lysozyme by Raman spectroscopy and linear normal mode calculations (modal analysis). The input mechanical parameters to the numerical computations are taken from the literature. We first give an estimate of the order of magnitude of protein vibration frequencies by considering both classical wave mechanics and structural dynamics formulas. Afterwards, we perform modal analyses of some relevant chemical groups and of the full lysozyme protein. The numerical results are compared to experimental data, obtained from both in-house and literature Raman measurements. In particular, the attention is focused on a large peak at 0.84 THz (29.3 cm-1) in the Raman spectrum obtained analyzing a lyophilized powder sample.

  3. 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

  4. 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)

  5. 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.

  6. 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

  7. An FEM-Based State Estimation Approach to Nonlinear Hybrid Positioning Systems

    Directory of Open Access Journals (Sweden)

    Yu-Xin Zhao

    2013-01-01

    Full Text Available For hybrid positioning systems (HPSs, the estimator design is a crucial and important problem. In this paper, a finite-element-method- (FEM- based state estimation approach is proposed to HPS. As the weak solution of hybrid stochastic differential model is denoted by the Kolmogorov's forward equation, this paper constructs its interpolating point through the classical fourth-order Runge-Kutta method. Then, it approaches the solution with biquadratic interpolation function to obtain a prior probability density function of the state. A posterior probability density function is gained through Bayesian formula finally. In theory, the proposed scheme has more advantages in the performance of complexity and convergence for low-dimensional systems. By taking an illustrative example, numerical experiment results show that the new state estimator is feasible and has good performance than PF and UKF.

  8. 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...... 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....... 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...

  9. 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.

  10. Fatigue crack growth simulation in coated materials using X-FEM

    Science.gov (United States)

    Nasri, Khalid; Zenasni, Mohammed

    2017-04-01

    In the present work, the eXtended Finite Element Method (XFEM) is used to study the effect of bi-material interfaces on fatigue life in galvanised panels. X-FEM and Paris law are implemented in ABAQUS software using Python code. The XFEM method proved to be an adequate method for stress intensity factor computation, and, furthermore, no remeshing is required for crack growth simulations. A study of fatigue crack growth is conducted for several substrate materials, and the influence of the initial crack angle is ascertained. This study also compares the crack growth rate between three types of bi-materials alloys zinc/steel, zinc/aluminium, and zinc/zinc. The interaction between two cracks and fatigue life, in the presence of bi-material interface, is investigated as well.

  11. A review of fatigue crack propagation modelling techniques using FEM and XFEM

    Science.gov (United States)

    Rege, K.; Lemu, H. G.

    2017-12-01

    Fatigue is one of the main causes of failures in mechanical and structural systems. Offshore installations, in particular, are susceptible to fatigue failure due to their exposure to the combination of wind loads, wave loads and currents. In order to assess the safety of the components of these installations, the expected lifetime of the component needs to be estimated. The fatigue life is the sum of the number of loading cycles required for a fatigue crack to initiate, and the number of cycles required for the crack to propagate before sudden fracture occurs. Since analytical determination of the fatigue crack propagation life in real geometries is rarely viable, crack propagation problems are normally solved using some computational method. In this review the use of the finite element method (FEM) and the extended finite element method (XFEM) to model fatigue crack propagation is discussed. The basic techniques are presented, together with some of the recent developments.

  12. 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.

  13. Globalization strategies for Newton Krylov methods for stabilized FEM discretization of Navier Stokes equations

    Science.gov (United States)

    Bellavia, Stefania; Berrone, Stefano

    2007-10-01

    In this work we study the numerical solution of nonlinear systems arising from stabilized FEM discretizations of Navier-Stokes equations. This is a very challenging problem and often inexact Newton solvers present severe difficulties to converge. Then, they must be wrapped into a globalization strategy. We consider the classical backtracking procedure, a subspace trust-region strategy and an hybrid approach. This latter strategy is proposed with the aim of improve the robustness of backtracking and it is obtained combining the backtracking procedure and the elliptical subspace trust-region strategy. Under standard assumptions, we prove global and fast convergence of the inexact Newton methods embedded in this new strategy as well as in the subspace trust-region procedure. Computational results on classical CFD benchmarks are performed. Comparisons among the classical backtracking strategy, the elliptical subspace trust-region approach and the hybrid procedure are presented. Our numerical experiments show the effectiveness of the proposed hybrid technique.

  14. 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.

  15. 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.

  16. Structural and magnetic transitions in spinel FeM n2O4 single crystals

    Science.gov (United States)

    Nepal, Roshan; Zhang, Qiang; Dai, Samuel; Tian, Wei; Nagler, S. E.; Jin, Rongying

    2018-01-01

    Materials that form the spinel structure are known to exhibit geometric frustration, which can lead to magnetic frustration as well. Through magnetization and neutron diffraction measurements, we find that FeM n2O4 undergoes one structural and two magnetic transitions. The structural transition occurs at Ts˜595 K from cubic at high temperatures to tetragonal at low temperatures. Two magnetic transitions are ferrimagnetic at TFI -1˜373 K and TFI -2˜50 K , respectively. Further investigation of the specific heat, thermal conductivity, and Seebeck coefficient confirms both magnetic transitions. Of particular interest is that there is a significant magnetic contribution to the low-temperature specific heat and thermal conductivity, providing a unique system to study heat transport by magnetic excitations.

  17. 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

  18. 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.

  19. Modified Bean Model and FEM Method Combined for Persistent Current Calculation in Superconducting Coils

    CERN Document Server

    Völlinger, Christine; Russenschuck, Stephan

    2001-01-01

    Field variations in the LHC superconducting magnets, e. g. during the ramping of the magnets, induce magnetization currents in the superconducting material, the so-called persistent currents that do not decay but persist due to the lack of resistivity. This paper describes a semi-analytical hysteresis model for hard superconductors, which has been developed for the computation of the total field errors arising from persistent currents. Since the superconducting coil is surrounded by a ferromagnetic yoke structure, the persistent current model is combined with the finite element method (FEM), as the non-linear yoke can only be calculated numerically. The used finite element method is based on a reduced vector potential formulation that avoids the meshing of the coil while calculating the part of the field arising from the source currents by means of the Biot-Savart Law. The combination allows to determine persistent current induced field errors as function of the excitation and for arbitrarily shaped iron yoke...

  20. Mass conservation for instantaneous sources in FEM3 simulations of material dispersion

    Energy Technology Data Exchange (ETDEWEB)

    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/sup -5/ to 10/sup -1/. This suggests that the omission of the par. delta rho/par. deltat 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.

  1. Implementation of the eXtended Finite Element Method (X-FEM) in Frictional Contact Problems

    Science.gov (United States)

    Khoei, A. R.; Anahid, M.; Yadegaran, I.; Nikbakht, M.

    2007-05-01

    Numerical modeling of engineering contact problems is one of the most difficult and demanding tasks in computational mechanics. In this paper, the extended finite element method is employed to simulate the presence of discontinuities caused by frictional contact based on the penalty approach. The FEM approximation is enriched by applying additional terms to simulate the frictional behavior of contact between two bodies. The penalty method, which is one of the most commonly used techniques for contact problems, is used to model the penetration between two contacting boundaries and the normal contact force is related to the penetration by a penalty parameter. Finally, numerical examples are presented to demonstrate the applicability of the XFEM in modeling of frictional contact behavior.

  2. 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...... die surface in the forward rod extrusion using theoretical calibration diagrams representing the relationship between the punch travel, the forward rod extrusion length and mu or m without requirements of measuring the forming forces and the paw stress of the workpiece. The theoretical calibration...... 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...

  3. PVD Coatings’ Strength Properties at Various Temperatures by Nanoindentations and FEM Calculations Determined

    Directory of Open Access Journals (Sweden)

    K.-D. Bouzakis

    2012-03-01

    Full Text Available Nanoindentation is usually applied on thin films at ambient temperatures for hardness determination. Recently, instruments for conducting nanoindentation at elevated temperatures have been developed facilitating measurements up to 700 oC. Both indenter and specimen, if necessary, are heated in an inert atmosphere to avoid film oxidations. In the described investigations, nanoindentations were conducted on cemented carbides and high speed steel specimens, coated with various films, up to 400 oC. The obtained results were subjected to statistical analysis to estimate their reliability. Moreover, the results were evaluated by appropriate FEM (Finite Element Method algorithms for determining the coatings’ elasticity modulus, yield and rupture stress as well as hardness at various temperatures. The results reveal a non-linear temperature dependence of the coating properties.

  4. Monolithic discretization of linear thermoelasticity problems via adaptive multimesh hp-FEM

    Czech Academy of Sciences Publication Activity Database

    Šolín, Pavel; Červený, Jakub; Dubcová, Lenka; Andrš, David

    2010-01-01

    Roč. 234, č. 7 (2010), s. 2350-2357 ISSN 0377-0427 R&D Projects: GA ČR(CZ) GA102/07/0496; GA AV ČR IAA100760702 Institutional research plan: CEZ:AV0Z20570509 Keywords : linear elasticity * monolithic discretization * adaptive multimesh hp-FEM Subject RIV: JA - Electronics ; Optoelectronics, Electrical Engineering Impact factor: 1.029, year: 2010 http://www.sciencedirect.com/science?_ob=MImg&_imagekey=B6TYH-4X1J73B-V-11&_cdi=5619&_user=640952&_pii=S0377042709005731&_origin=search&_coverDate=08%2F01%2F2010&_sk=997659992&view=c&wchp=dGLzVzb-zSkWA&md5=3665f1549355544e9c36e84a4adfd086&ie=/sdarticle.pdf

  5. Fluid-Structure Interaction based on Lattice Boltzmann and p-FEM

    Science.gov (United States)

    Ahrenholz, Benjamin; Geller, Sebastian; Krafczyk, Manfred

    2010-03-01

    Over the last decade the Lattice Boltzmann Method (LBM) has matured as an efficient method for solving the Navier-Stokes equations. The p-version of the Finite Element Method (p-FEM) has proved to be highly efficient for a variety of problems in the field of structural mechanics. The focus of this contribution is to investigate the validity and efficiency of the coupling of two completely different numerical methods to simulate transient bidirectional Fluid-Structure Interaction (FSI) problems with very large structural deflections. In this contribution the treatment of moving boundaries in the fluid solver is presented, the computation of tractions and displacements on the boundary as well as the explicit coupling algorithm itself. In addition, efficiency aspects of the two approaches for two- and three-dimensional laminar flow examples at intermediate Reynolds numbers are discussed. Finally we give an outlook on modeling turbulent FSI problems.

  6. Development of capsule design support subprograms for 3-dimensional temperature calculation using FEM Code NISA

    Energy Technology Data Exchange (ETDEWEB)

    Tobita, Masahiro; Matsui, Yoshinori [Japan Atomic Energy Research Inst., Oarai, Ibaraki (Japan). Oarai Research Establishment

    2003-03-01

    Prediction of irradiation temperature is one of the important issues in the design of the capsule for irradiation test. Many kinds of capsules with complex structure have been designed for recent irradiation requests, and three-dimensional (3D) temperature calculation becomes inevitable for the evaluation of irradiation temperature. For such 3D calculation, however, many works are usually needed for input data preparation, and a lot of time and resources are necessary for parametric studies in the design. To improve such situation, JAERI introduced 3D-FEM (finite element method) code NISA (Numerically Integrated elements for System Analysis) and developed several subprograms, which enabled to support input preparation works in the capsule design. The 3D temperature calculation of the capsule are able to carried out in much easier way by the help of the subprograms, and specific features in the irradiation tests such as non-uniform gamma heating in the capsule, becomes to be considered. (author)

  7. 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.

  8. Nature of the hyper-Raman active vibrations of lithium borate glasses

    Energy Technology Data Exchange (ETDEWEB)

    Simon, G; Hehlen, B; Vacher, R; Courtens, E [Laboratoire des Colloides, Verres et Nanomateriaux (LCVN), UMR 5587 CNRS, University of Montpellier II, F-34095 Montpellier (France)], E-mail: bernard.hehlen@lcvn.univ-montp2.fr

    2008-04-16

    Hyper-Raman spectra of two lithium borate glasses, 4B{sub 2}O{sub 3}:Li{sub 2}O and 2B{sub 2}O{sub 3}:Li{sub 2}O, are compared to those of pure boron oxide glass, v-B{sub 2}O{sub 3}. A mode analysis is performed using a structural model based on the symmetry of the elementary structural units (ESUs) constituting the glasses. Most spectral components arise from internal vibrations of BO{sub 3} triangles, B{sub 3}O{sub 3} boroxol rings, and BO{sub 4} tetrahedra. In particular, a mode associated with stretching motions of BO{sub 4} units can be assigned to a vibration of F{sub 2} symmetry in the T{sub d} tetrahedral point group. The hyper-Raman scattering intensity of its transverse optic component appears to be proportional to the number of BO{sub 4} units in the glass. The boson peak observed in hyper-Raman scattering arises from external modes of rigid ESUs which correspond to librational motions coupled to their translations. The scattering strength of these modes strongly decreases with increasing Li concentration. In pure v-B{sub 2}O{sub 3}, external modes of boroxols presumably dominate this scattering. The decrease in the boroxol concentration in lithium borate glasses correlates with the apparent hardening of the boson peak.

  9. 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.

  10. 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.

  11. 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

  12. Detection of the mycotoxin citrinin using silver substrates and Raman spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Singh, Dheeraj K.; Ganbold, Erdene-Ochir [Department of Chemistry, Soongsil University, Seoul 156-743 (Korea, Republic of); Cho, Eun-Min [College of Environment and Applied Chemistry, Kyung Hee University, Yongin 446-701 (Korea, Republic of); Cho, Kwang-Hwi [School of Systems Biomedical Science, Soongsil University, Sangdo-dong, Dongjak-gu, Seoul (Korea, Republic of); Kim, Doseok [Department of Physics, Sogang University, Seoul 121-742 (Korea, Republic of); Choo, Jaebum [Department of Bionano Engineering, Hanyang University, Sa-1-dong 1271, Ansan 426-791 (Korea, Republic of); Kim, Sehun [Molecular-level Interface Research Center and Department of Chemistry, KAIST, Daejeon 305-701 (Korea, Republic of); Lee, Cheol Min, E-mail: spica@hanyang.ac.kr [Institute of Environmental and Industrial Medicine, Hanyang University, 17 Haengdang-dong, Seongdong-gu, Seoul 133-791 (Korea, Republic of); Yang, Sung Ik, E-mail: siyang@khu.ac.kr [College of Environment and Applied Chemistry, Kyung Hee University, Yongin 446-701 (Korea, Republic of); Joo, Sang-Woo, E-mail: sjoo@ssu.ac.kr [Department of Chemistry, Soongsil University, Seoul 156-743 (Korea, Republic of)

    2014-01-30

    Highlights: • The mycotoxin citrinin was detected using Ag substrates and Raman spectroscopy. • Prepared Ag substrates were characterized by electron microscopic tools. • Density functional theory calculation predicted the most stable geometry on Ag. -- Abstract: We detected a trace amount of the mycotoxin citrinin using surface-enhanced Raman scattering (SERS) on silver nanoparticle (Ag NP) surfaces. The SERS substrate on hydrophobic Teflon films was also introduced to observe the citrinin peaks. A broad band at ∼1382 cm{sup −1}, which was ascribed to the symmetric carboxylate stretching mode, was observed in addition to an antisymmetric carboxylate stretching mode at ∼1568 cm{sup −1} in the Raman spectra. The spectral feature indicated that citrinin would adsorb on Ag NPs via its carboxylate form. Based on density functional theory (DFT) calculations, vibrational mode analysis was performed to compare the Raman spectra of citrinin. DFT calculations also predicted that a bidentate bridge configuration through O15 and O16 atoms in citrinin would be the most stable on three Ag atoms. After treating with Ag NPs, observation of citrinin peaks was attempted in fungal cells of Penicillium citrinum. This work may provide useful insights into the direct observation of the hazardous citrinin mycotoxin using SERS by understanding its adsorption behaviors on Ag surfaces.

  13. Ionic liquid for in situ Vis/NIR and Raman spectroelectrochemistry: Doping of carbon nanostructures.

    Science.gov (United States)

    Kavan, Ladislav; Dunsch, Lothar

    2003-09-15

    1-butyl-3-methylimidazolium tetrafluoroborate (an ionic liquid) is an advantageous electrolyte for the study of charge-transfer reactions at single-walled carbon nanotubes (SWCNTs) and fullerene peapods (C60@SWCNT). Compared to traditional electrolyte solutions, this medium offers a broader window of electrochemical potentials to be applied, and favorable optical properties for in situ Vis/NIR and Raman spectroelectrochemistry of nano-carbon species. The electrochemistry of both nanotubes and peapods is dominated by their capacitive double-layer charging. Vis/NIR spectroelectrochemistry confirms the charging-induced bleaching of transitions between Van Hove singularities. At high positive potentials, new optical transitions were activated in partly filled valence band. The bleaching of optical transitions is mirrored by the quenching of resonance Raman scattering in the region of tube-related modes. The Raman frequency of the tangential displacement mode of SWCNT shifts to blue upon both anodic and cathodic charging in the ionic liquid. The Raman modes of intratubular C60 exhibit a considerable intensity increase upon anodic doping of peapods.

  14. On Sagnac frequency splitting in a solid-state ring Raman laser.

    Science.gov (United States)

    Liang, Wei; Savchenkov, Anatoliy; Ilchenko, Vladimir; Griffith, Robert; De Cuir, Edwin; Kim, Steven; Matsko, Andrey; Maleki, Lute

    2017-11-15

    We report on an accurate measurement of the frequency splitting of an optical rotating ring microcavity made out of calcium fluoride. By measuring the frequencies of the clockwise and counter-clockwise coherent Raman emissions confined in the cavity modes, we show that the frequency splitting is inversely proportional to the refractive index of the cavity host material. The measurement has an accuracy of 1% and unambiguously confirms the classical theoretical prediction based on special theory of relativity. This Letter also demonstrates the usefulness of the ring Raman microlaser for rotation measurements.

  15. sp Carbon chain interaction with silver nanoparticles probed by Surface Enhanced Raman Scattering

    Science.gov (United States)

    Lucotti, A.; Casari, C. S.; Tommasini, M.; Li Bassi, A.; Fazzi, D.; Russo, V.; Del Zoppo, M.; Castiglioni, C.; Cataldo, F.; Bottani, C. E.; Zerbi, G.

    2009-08-01

    Surface Enhanced Raman Spectroscopy (SERS) is exploited here to investigate the interaction of isolated sp carbon chains (polyynes) in a methanol solution with silver nanoparticles. Hydrogen-terminated polyynes show a strong interaction with silver colloids used as the SERS active medium revealing a chemical SERS effect. SERS spectra after mixing polyynes with silver colloids show a noticeable time evolution. Experimental results, supported by density functional theory (DFT) calculations of the Raman modes, allow us to investigate the behavior and stability of polyynes of different lengths and the overall sp conversion towards sp 2 phase.

  16. Raman spectroscopy of optical properties in CdS thin films

    Directory of Open Access Journals (Sweden)

    Trajić J.

    2015-01-01

    Full Text Available Properties of CdS thin films were investigated applying atomic force microscopy (AFM and Raman spectroscopy. CdS thin films were prepared by using thermal evaporation technique under base pressure 2 x 10-5 torr. The quality of these films was investigated by AFM spectroscopy. We apply Raman scattering to investigate optical properties of CdS thin films, and reveal existence of surface optical phonon (SOP mode at 297 cm-1. Effective permittivity of mixture were modeled by Maxwell - Garnet approximation. [Projekat Ministarstva nauke Republike Srbije, br. 45003

  17. Electric-Field-Induced Soft-Mode Hardening in SrTiO3 Films

    Science.gov (United States)

    Akimov, I. A.; Sirenko, A. A.; Clark, A. M.; Hao, J.-H.; Xi, X. X.

    2000-05-01

    We have studied electric-field-induced Raman scattering in SrTiO3 thin films using an indium-tin-oxide/SrTiO3/SrRuO3 structure grown by pulsed laser deposition. The soft mode polarized along the field becomes Raman active. Experimental data for electric-field-induced hardening of the soft modes and the tuning of the static dielectric constant are in agreement described by the Lyddane-Sachs-Teller formalism. The markedly different behavior of the soft modes in thin films from that in the bulk is explained by the existence of local polar regions.

  18. Raman spectrum of the solid electrolytes LiI·H2O and LiI·D2O

    DEFF Research Database (Denmark)

    Poulsen, Finn Willy

    1986-01-01

    The Raman spectra of cubic LiI·H2O and LiI·D2O have been revised. The spectra reveal only internal and librational modes of H2O (D2O). The isotopic ratios νH/νD, are in the range 1.33-1.78......The Raman spectra of cubic LiI·H2O and LiI·D2O have been revised. The spectra reveal only internal and librational modes of H2O (D2O). The isotopic ratios νH/νD, are in the range 1.33-1.78...

  19. Design of an 1800 nm Raman Amplifier

    DEFF Research Database (Denmark)

    Svane, Ask Sebastian; Rottwitt, Karsten

    , also extended band amplifiers are required. As a solution to the latter challenge, Raman amplifiers are suggested as promising candidates. The main hurdle when designing a long wavelength Raman amplifier is the increased intrinsic fiber attenuation which as a consequence leads to an increase...... in the pump power requirement and deteriorated noise properties. Here we demonstrate a Raman amplifier designed for signal wavelengths around 1800 nm. The amplification fiber is an OFS PM Raman fiber, and is pumped by a Raman fiber laser emitting at 1680 nm [4]. The amplifier was pumped co......-polarized and backward, with respect to the singal. In Fig. 2 a measured Raman on/off gain exceeding 9 dB for 285 mW of injected pump power is obtained in a 4.35 km long fiber. A broadband supercontinuum source was used as a signal from 1700 nm to 1900 nm....

  20. 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...... performance of the amplifier is also investigated for both configurations. Our results show an on/off gain exceeding 20 dB at 1810 nm for which the obtained effective noise figure is below 3 dB....

  1. Proposed mixed-mode dynamic fracture toughness testing method using a new specimen

    Energy Technology Data Exchange (ETDEWEB)

    Wada, H.; Hinoshita, A. [Daido Institute of Technology, Nagoya (Japan); Calder, C.A.; Kennedy, T.C. [Oregon State Univ., Corvallis, OR (United States)

    1996-12-31

    To find a simple and highly accurate testing method for determining the mixed-mode dynamic fracture toughness in a wide range of ratio of opening and sliding modes, the authors applied a combination technique using an electrical resistance strain gage method and a dynamic finite element method (FEM) to determine the mixed-mode dynamic fracture toughness. They used measuring and recording devices associated with an impact fracture apparatus based on an air gun. The impact fracture test was conducted to assess the mixed-mode dynamic fracture toughness testing method under single-point bending for three specimens of polymethyl methacrylate (PMMA). The ratio of the opening mode deformation to the sliding mode can be changed by adjusting the hitting point. To measure a dynamic stress intensity factors (SIF) K{sub 1}(t) and a crack initiation time, a single axis strain gage was mounted in the vicinity of the crack tip.

  2. Fourier transform Raman spectroscopy of polyacrylamide gels for radiation dosimetry

    Energy Technology Data Exchange (ETDEWEB)

    Baldock, C.; Murry, P.; Pope, J. [Queensland University of Tehchnology, Brisbane, QLD (Australia). Centres for Medical and Health Physics; Rintoul, L.; George, G. [Queensland University of Tehchnology, Brisbane, QLD (Australia). Instrumental and Development Chemistry

    1998-12-31

    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{sup -1}. Vibrational bands of 1285 cm{sup -1} and 1256 cm{sup -1} were assigned to the acrylamide and bis-acrylamide single CH{sub 2} {delta}{sub 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

  3. FEM analysis of subsoil reaction on heavy wheel loads with emphasis on soil preconsolidation stress and cohesion

    NARCIS (Netherlands)

    Poodt, M.P.; Koolen, A.J.; Linden, J.P.

    2003-01-01

    Heavy sugarbeet harvesters may compact subsoil. But it is very difficult to study this by field experiments that resemble agricultural practice. Therefore, an analysis was made by a finite element method (FEM) for a relevant calcaric fluvial soil profile, the mechanical properties of which were

  4. 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

  5. Simple rules for design of exhaust mufflers and a comparison with four-pole and FEM calculations

    DEFF Research Database (Denmark)

    Jensen, Morten Skaarup; Ødegaard, John

    1999-01-01

    For good muffler design it is advisable to use an advanced computational method such as four-pole theory or FEM or BEM. To get a starting points for these methods and to suggest adjustments to the geometry and materials it is useful to have some simple rules of thumb. This paper presents a number...

  6. 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.

  7. 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,

  8. Infrared dispersion analysis and Raman scattering spectra of taurine single crystals

    Science.gov (United States)

    Moreira, Roberto L.; Lobo, Ricardo P. S. M.; Dias, Anderson

    2018-01-01

    A comprehensive set of optical vibrational modes of monoclinic taurine crystals was determined by Raman scattering, and infrared reflectivity and transmission spectroscopies. By using appropriate scattering/reflection geometries, the vibrational modes were resolved by polarization and the most relevant modes of the crystal could be assigned. In particular, we were able to review the symmetry of the gerade modes and to resolve ambiguities in the literature. Owing to the non-orthogonal character of Bu modes in monoclinic crystals (lying on the optic axial plane), we carried out a generalized Lorentz dispersion analysis consisting of simultaneous adjust of infrared-reflectivity spectra at various light polarization angles. The Au modes (parallel to the C2-axis) were treated within the classical Lorentz model. The behavior of off-diagonal and diagonal terms of the complex dielectric tensors and the presence of anomalous dispersion were discussed as consequences of the low symmetry of the crystal.

  9. Raman spectroscopy in pharmaceutical product design

    DEFF Research Database (Denmark)

    Paudel, Amrit; Raijada, Dhara; Rantanen, Jukka

    2015-01-01

    molecular-based drug discovery, design of innovative drug delivery systems and quality control of finished products. This review presents concise accounts of various conventional and emerging Raman instrumentations including associated hyphenated tools of pharmaceutical interest. Moreover, relevant...... application cases of Raman spectroscopy in early and late phase pharmaceutical development, process analysis and micro-structural analysis of drug delivery systems are introduced. Finally, potential areas of future advancement and application of Raman spectroscopic techniques are discussed....

  10. Raman spectroscopy of isotopically labeled two-layer graphene

    Energy Technology Data Exchange (ETDEWEB)

    Kalbac, Martin [J. Heyrovsky Institute of Physical Chemistry, Academy of Sciences of the Czech Republic, v.v.i., Dolejskova 3, 18223 Prague 8 (Czech Republic); Department of Physical Chemistry, Palacky University, 77146 Olomouc (Czech Republic); Kong, Jing [Department of Electrical Engineering and Computer Science, MIT, Cambridge, Massachusetts 02139 (United States); Kavan, Ladislav [J. Heyrovsky Institute of Physical Chemistry, Academy of Sciences of the Czech Republic, v.v.i., Dolejskova 3, 18223 Prague 8 (Czech Republic); Dresselhaus, Mildred S. [Department of Electrical Engineering and Computer Science, MIT, Cambridge, Massachusetts 02139 (United States); Department of Physics, MIT, Cambridge, Massachusetts 02139 (United States)

    2012-12-15

    A detailed understanding of graphene properties both in its neutral and doped states is an important prerequisite for applications of this new material in electronic devices. We used electrochemical doping to study the influence of charge on isotopically labeled two-layer graphene. No change of the G mode intensity was observed at electrode potentials between -1.5 and 1 V. At high positive electrode potentials (>1 V) we observed enhancement of the G mode intensity due to partial removal of interfering resonant transitions. Hence, we confirmed that in case of absence of the enhancement due to a specific orientation between the two layers the Raman spectroelectrochemistry of non-stacked two-layer graphene mimics that of one-layer graphene. (Copyright copyright 2012 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  11. Raman spectroscopy of isotopically labeled two-layer graphene

    International Nuclear Information System (INIS)

    Kalbac, Martin; Kong, Jing; Kavan, Ladislav; Dresselhaus, Mildred S.

    2012-01-01

    A detailed understanding of graphene properties both in its neutral and doped states is an important prerequisite for applications of this new material in electronic devices. We used electrochemical doping to study the influence of charge on isotopically labeled two-layer graphene. No change of the G mode intensity was observed at electrode potentials between -1.5 and 1 V. At high positive electrode potentials (>1 V) we observed enhancement of the G mode intensity due to partial removal of interfering resonant transitions. Hence, we confirmed that in case of absence of the enhancement due to a specific orientation between the two layers the Raman spectroelectrochemistry of non-stacked two-layer graphene mimics that of one-layer graphene. (Copyright copyright 2012 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  12. What Good is Raman Water Vapor Lidar?

    Science.gov (United States)

    Whitman, David

    2011-01-01

    Raman lidar has been used to quantify water vapor in the atmosphere for various scientific studies including mesoscale meteorology and satellite validation. Now the international networks of NDACC and GRUAN have interest in using Raman water vapor lidar for detecting trends in atmospheric water vapor concentrations. What are the data needs for addressing these very different measurement challenges. We will review briefly the scientific needs for water vapor accuracy for each of these three applications and attempt to translate that into performance specifications for Raman lidar in an effort to address the question in the title of "What good is Raman water vapor Iidar."

  13. Raman Spectroscopy and its Application in Nanostructures

    CERN Document Server

    Zhang, Shu-Lin

    2012-01-01

    Raman Spectroscopy and its Application in Nanostructures is an original and timely contribution to a very active area of physics and materials science research. This book presents the theoretical and experimental phenomena of Raman spectroscopy, with specialized discussions on the physical fundamentals, new developments and main features in low-dimensional systems of Raman spectroscopy. In recent years physicists, materials scientists and chemists have devoted increasing attention to low-dimensional systems and as Raman spectroscopy can be used to study and analyse such materials as carbon nan

  14. Quantum-Chemical Calculation and Visualization of the Vibrational Modes of Graphene in Different Points of the Brillouin Zone.

    Science.gov (United States)

    Lebedieva, Tetiana; Gubanov, Victor; Dovbeshko, Galyna; Pidhirnyi, Denys

    2015-12-01

    Different notations of graphene irreducible representations and optical modes could be found in the literature. The goals of this paper are to identify the correspondence between available notations, to calculate the optical modes of graphene in different points of the Brillouin zone, and to compare them with experimental data obtained by Raman and coherent anti-Stokes Raman scattering (CARS) spectroscopy. The mechanism of the resonance enhancement of vibration modes of the molecules adsorbed on graphene in CARS experiments is proposed. The possibility of appearance of the discrete breathing modes is discussed.

  15. Polarized Raman study on the lattice structure of BiFeO3 films prepared by pulsed laser deposition

    KAUST Repository

    Yang, Yang

    2014-11-01

    Polarized Raman spectroscopy was used to study the lattice structure of BiFeO3 films on different substrates prepared by pulsed laser deposition. Interestingly, the Raman spectra of BiFeO3 films exhibit distinct polarization dependences. The symmetries of the fundamental Raman modes in 50-700 cm-1 were identified based on group theory. The symmetries of the high order Raman modes in 900-1500 cm-1 of BiFeO3 are determined for the first time, which can provide strong clarifications to the symmetry of the fundamental peaks in 400-700 cm-1 in return. Moreover, the lattice structures of BiFeO3 films are identified consequently on the basis of Raman spectroscopy. BiFeO3 films on SrRuO3 coated SrTiO3 (0 0 1) substrate, CaRuO3 coated SrTiO3 (0 0 1) substrate and tin-doped indium oxide substrate are found to be in the rhombohedral structure, while BiFeO3 film on SrRuO3 coated Nb: SrTiO3 (0 0 1) substrate is in the monoclinic structure. Our results suggest that polarized Raman spectroscopy would be a feasible tool to study the lattice structure of BiFeO3 films.

  16. Structural analysis of the antimalarial drug halofantrine by means of Raman spectroscopy and density functional theory calculations.

    Science.gov (United States)

    Frosch, Torsten; Popp, Jürgen

    2010-01-01

    The structure of the antimalarial drug halofantrine is analyzed by means of density functional theory (DFT) calculations, IR, and Raman spectroscopy. Strong, selective enhancements of the Raman bands of halofantrine at 1621 and 1590 cm(-1) are discovered by means of UV resonance Raman spectroscopy with excitation wavelength lambda(exc)=244 nm. These signal enhancements can be exploited for a localization of small concentrations of halofantrine in a biological environment. The Raman spectrum of halofantrine is calculated by means of DFT calculations [B3LYP/6-311+G(d,p)]. The calculation is very useful for a thorough mode assignment of the Raman bands of halofantrine. The strong bands at 1621 and 1590 cm(-1) in the UV Raman spectrum are assigned to combined C[Double Bond]C stretching vibrations in the phenanthrene ring of halofantrine. These bands are considered as putative marker bands for pipi interactions with the biological target molecules. The calculation of the electron density demonstrates a strong distribution across the phenanthrene ring of halofantrine, besides the electron withdrawing effect of the Cl and CF(3) substituents. This strong and even electron density distribution supports the hypothesis of pipi stacking as a possible mode of action of halofantrine. Complementary IR spectroscopy is performed for an investigation of vibrations of polar functional groups of the halofantrine molecule.

  17. Enhancement of the excitation efficiency of a torsional wave PPM EMAT array for pipe inspection by optimizing the element number of the array based on 3-D FEM.

    Science.gov (United States)

    Wang, Yugang; Wu, Xinjun; Sun, Pengfei; Li, Jian

    2015-02-03

    Electromagnetic acoustic transducers (EMATs) can generate non-dispersive T(0,1) mode guided waves in a metallic pipe for nondestructive testing (NDT) by using a periodic permanent magnet (PPM) EMAT circular array. In order to enhance the excitation efficiency of the sensor, the effects of varying the number of elements of the array on the excitation efficiency is studied in this paper. The transduction process of the PPM EMAT array is studied based on 3-D finite element method (FEM). The passing signal amplitude of the torsional wave is obtained to represent the excitation efficiency of the sensor. Models with different numbers of elements are established and the results are compared to obtain an optimal element number. The simulation result is verified by experiments. It is shown that after optimization, the amplitudes of both the passing signal and defect signal with the optimal element number are increased by 29%, which verifies the feasibility of this optimal method. The essence of the optimization is to find the best match between the static magnetic field and the eddy current field in a limited circumferential space to obtain the maximum circumferential Lorentz force.

  18. Characterization of topical film-forming systems using atomic force microscopy and Raman microspectroscopy.

    Science.gov (United States)

    Garvie-Cook, Hazel; Frederiksen, Kit; Petersson, Karsten; Guy, Richard H; Gordeev, Sergey

    2015-03-02

    Polymeric film-forming systems for dermal drug delivery represent an advantageous alternative to more conventional topically applied formulations. Their mechanical properties and homogeneity can be characterized with atomic force microscopy (AFM), using both imaging and nanoindentation modes, and Raman microspectroscopy mapping. Film-forming polymers, with and without a plasticizer and/or betamethasone 17-valerate (a representative topical drug), were dissolved in absolute ethanol. Polymeric films were then cast on glass slides and examined in ambient air using AFM imaging and Raman microspectroscopy. Using nanoindentation, the elastic moduli of various films were determined and found to decrease with increasing plasticizer content. Films with 20% w/w plasticizer had elastic moduli close to that of skin. AFM images showed little difference in the topography of the films on incorporation of plasticizer. Raman microspectroscopy maps of the surface of the polymeric films, with a spatial resolution of approximately 1 μm, revealed homogeneous distributions of plasticizer and drug within the films.

  19. Continuous temperature-dependent Raman spectroscopy of melamine and structural analog detection in milk powder.

    Science.gov (United States)

    Schmidt, Walter F; Broadhurst, C Leigh; Qin, Jianwei; Lee, Hoyoung; Nguyen, Julie K; Chao, Kuanglin; Hapeman, Cathleen J; Shelton, Daniel R; Kim, Moon S

    2015-03-01

    Hyperspectral Raman imaging has the potential for rapid screening of solid-phase samples for potential adulterants. We can improve mixture analysis algorithms by defining a temperature range in which the contaminant spectrum changes dramatically and uniquely compared with unadulterated material. Raman spectra were acquired for urea, biuret, cyanuric acid, and melamine (pure and at 1% in dried milk powder) from 50 to 310 °C with a gradient of 1 °C min(-1). Adulterants were clearly indentified in the milk powder. Specific frequencies that were mainly associated with ring breathing, stretching, and in-plane deformation shifted with respect to temperature up to 12 cm(-1) in all four molecules. Specific frequencies significantly increased/decreased in intensity within narrow temperature ranges independent of whether the amine was mixed in milk. Correlation of Raman and differential scanning calorimetry data identified structural components and vibrational modes, which concur with or trigger phase transitions.

  20. Micro-Raman scattering studies of Ge-Sb-Te bulk crystals and nanoparticles

    International Nuclear Information System (INIS)

    Cho, E.; Yoon, S.; Yoon, H. R.; Jo, W.

    2006-01-01

    We measured micro-Raman scattering spectra of commercially available Ge-Sb-Te (GST) bulk crystals and GST nanoparticles which were synthesized using a pulsed laser ablation method. The lack of the amorphous Te-Te stretching mode near 150 cm -1 from the Raman spectrum of the bulk sample indicated that the sample was well-crystallized. We also measured GST nanoparticles with different growth conditions, from which we could get information towards the optimal growth conditions for better crystallinity of the GST nanoparticles. Our results suggest that through local structural information, micro-Raman scattering spectroscopy can be used to study the phases and the phase changes in the GST bulk crystals and nanoparticles which is being developed for low-power non-volatile memory applications.

  1. Dental pulp stem cells (DPSCs) differentiation study by confocal Raman microscopy

    Science.gov (United States)

    Salehi, H.; Collart-Dutilleul, P.-Y.; Gergely, C.; Cuisinier, F. J. G.

    2014-03-01

    Regenerative medicine brings a huge application for Mesenchymal stem cells such as Dental Pulp Stem Cells (DPSCs). Confocal Raman microscopy, a non-invasive, label free , real time and high spatial resolution imaging technique is used to study osteogenic differentiation of DPSCs. Integrated Raman intensities in the 2800-3000 cm-1 region (C-H stretching) and 960 cm-1 peak (phosphate PO4 3-) were collected. In Dental Pulp Stem Cells 21st day differentiated in buffer solution, phosphate peaks ν1 PO4 3- (first vibrational mode) at 960cm-1 and ν2 PO4 3- at 430cm-1 and ν4 PO4 3- at 585cm-1 are obviously present. Confocal Raman microscopy enables the detection of cell differentiation and it can be used to investigate clinical stem cell research.

  2. Raman studies of pressure and temperature induced phase transformations in calcite

    International Nuclear Information System (INIS)

    Exarhos, G.J.; Hess, N.J.

    1992-01-01

    This patent describes phase stability in the calcium carbonate system investigated as a simultaneous function of pressure and temperature up to 40 kbar and several hundred degrees Kelvin. Micro-Raman techniques were used to interrogate samples constrained within a resistively heated diamond anvil cell. Measured spectra allow unequivocal identification of crystalline phases and are used to refine the P,T phase diagram. Calcium carbonate was found to exhibit both reversible and irreversible transformation phenomena among the four known phases which exist under these conditions. Time-dependent Raman intensity variations as the material is perturbed from its equilibrium state allow real-time kinetics measurements to be performed. Evidence suggests that the order of certain observed transformations may be pressure dependent. The utility of Raman spectroscopy to follow transformation phenomena and to estimate fundamental thermophysical properties from the stress dependence of vibrational mode frequencies is demonstrated

  3. Diffusion Raman et luminescence dans des aerogels de silice purs ou dopes Dy

    Science.gov (United States)

    Guerri, F.; Fabre, F.; Zwick, A.; Bournett, D.

    1994-02-01

    Light scattering studies of pure and Dy doped aerogels are presented. Careful examination of Stokes and anti-Stokes spectra allow the discrimination between Raman and luminescence processes. It is shown that in pure aerogels, scattered intensity is due to Raman processes only, and the density of vibrational states does not exhibit any singularity. The fractal properties of the structure imply modifications not only in the spectral distribution of the low frequency modes (usually labelled phonons and fractons) but alsoin the high frequency one, at least up to 600 cm-1. In Dy-doped dense silica, coupling between electronic and vibronic excitations is evidenced by the presence of anti-Stokes luminescence. In Dy-doped aerogels, the enlarged Dy3+ electronic levels, strongly coupled with vibrational states give rise to emission processes traducing the response of the sample as a whole, rather than resonant Raman scattering or luminescence processes.

  4. Effect of pressure on the second-order Raman scattering intensities of zincblende semiconductors

    Energy Technology Data Exchange (ETDEWEB)

    Trallero-Giner, C.; Syassen, K. [Max-Planck-Institut fuer Festkoerperforschung, Heisenbergstrasse 1, 70569 Stuttgart (Germany)

    2010-01-15

    A microscopic description of the two-phonon scattering intensities in direct-gap zincblende-type semiconductors as a function of hydrostatic pressure and for non-resonant excitation is presented. The calculations were performed according to the electron-two-phonon deformation potential interaction for the {gamma}{sub 1} and {gamma}{sub 15} components of the Raman tensor. It is shown that the effect of pressure on the Raman scattering cross-section exhibits a complex behavior according to the contribution of the acoustical or optical phonons to the overtones and combinations. Second-order scattering intensities via acoustical modes could decrease or increase with increasing hydrostatic pressure, while for combinations or overtones of optical phonons a decreasing intensity is obtained. Calculations of the effect of pressure on second-order Raman intensities are compared to experimental results for ZnTe. (Abstract Copyright [2010], Wiley Periodicals, Inc.)

  5. Anomalous lattice vibrations of monolayer MoS 2 probed by ultraviolet Raman scattering

    KAUST Repository

    Liu, Hsiang Lin

    2015-01-01

    We present a comprehensive Raman scattering study of monolayer MoS2 with increasing laser excitation energies ranging from the near-infrared to the deep-ultraviolet. The Raman scattering intensities from the second-order phonon modes are revealed to be enhanced anomalously by only the ultraviolet excitation wavelength 354 nm. We demonstrate theoretically that such resonant behavior arises from a strong optical absorption that forms near the Γ point and of the band structure and an inter-valley resonant electronic scattering by the M-point phonons. These results advance our understanding of the double resonance Raman scattering process in low-dimensional semiconducting nanomaterials and provide a foundation for the technological development of monolayer MoS2 in the ultraviolet frequency range. © the Owner Societies 2015.

  6. Next generation hazard detection via ultrafast coherent anti-Stokes Raman spectroscopy

    Science.gov (United States)

    Brady, John J.; Pellegrino, Paul M.

    2013-05-01

    Multiplex coherent anti-Stokes Raman spectroscopy (MCARS) is used to detect an explosive precursor material and two chemical warfare simulants. The spectral bandwidth of the femtosecond laser pulse used in these studies is sufficient to coherently and simultaneously drive all the vibrational modes in the molecule of interest. The research performed here demonstrates that MCARS has the capability to detect an explosive precursor (e.g., acetone) and hazardous materials, such as dimethyl methylphosphonate and 2-chloroethyl methyl sulfide (a sarin and a mustard gas chemical warfare simulant, respectively), with high specificity. Evidence shows that MCARS is capable of overcoming common the sensitivity limitations of spontaneous Raman scattering, thus allowing for the detection of the target material in milliseconds with standard USB spectrometers as opposed to seconds with intensified spectrometers. The exponential increase in the number of scattered photons suggests that the MCARS technique may be capable of overcoming range detection challenges common to spontaneous Raman scattering.

  7. Vibrational spectroscopy at very high pressures. Part 28. Raman and far-infrared spectra of some complex chlorides A2MCl6 under hydrostatic pressure

    DEFF Research Database (Denmark)

    Adams, David M.; Berg, Rolf W.; Williams, Alan D.

    1981-01-01

    Raman and far-IR mode frequency shifts with pressure have been observed under hydrostatic conditions in a gasketed diamond anvil cell (d.a.c.). Using compressibilities calculated from unit cell constants and lattice energies, Grüneisen parameters gammai have been obtained for all observed modes. ...

  8. Resonance Raman evidence for the mechanism of the allosteric control of O2-binding in a cobalt-substituted monomeric insect hemoglobin

    OpenAIRE

    Thompson, H.M.; Yu, N.T.; Gersonde, K.

    1987-01-01

    The substitution of iron for cobalt in the monomeric insect hemoglobin CTT (Chironomus thummi thummi) III does not alter the Bohr effect for O2-binding. The cobalt substitution in this hemoglobin allows us to identify not only the O-O and Co-O2 stretching mode but also the Co-O-O bending mode by resonance Raman spectroscopy. The assignments were made via 16O2/18O2 isotope exchange. The modes associated with the Co-O-O moiety are pH-dependent. These pH-induced changes of the resonance Raman sp...

  9. On the Raman and infrared vibrational spectra of the ɛ and ζ phases of oxygen. Systematic DFT studies with localized basis sets

    Science.gov (United States)

    Ochoa-Calle, A. J.; Zicovich-Wilson, C. M.; Ramírez-Solís, A.

    2015-10-01

    We address the pressure evolution of the Raman and infrared vibrational modes of the ɛ and ζ phases of oxygen. We use DFT with various GGA and hybrid functionals with localized atomic basis sets. The frequency evolution of the OV, MIR, FIR, L1 and L2 modes is in good agreement with experimental data. The better performance of all methods at pressures >30 GPa is related to the decreasing multireference character of the (O2)4 unit cell wavefunction. Hybrid functionals predict the ɛ-ζ phase transition by the appearance of red-shifted L1 and L2 Raman modes in the transition pressure region.

  10. Raman Spectroscopy of InAs Based Nanowires & Electronic Characterization of Heterostructure InAs/GaInAs Nanowires

    DEFF Research Database (Denmark)

    Tanta, Rawa

    The work presented in this thesis represents two main topics. The first one, which covers a bigger volume of the thesis, is mainly about Raman spectroscopy on individual InAs based nanowires. The second part presents electronic characterization of heterostructure InAs/GaInAs nanowires. Raman...... modes. In the last chapter of this thesis we present a study on electrical characterization of InAs/GaInAs heterostructure nanowires. First, we performed selective etching experiments in order to locate the barriers. Second, the barriers were probed electrically by performing thermally activated...... spectroscopy measurements on InAs based nanowires include several topics. Firstly, we use polarized Raman spectroscopy for determining the crystal orientation of the nanowires based on conventional Raman selection rules. We studied the effect of the high power laser irradiation on the nanowire, and its...

  11. Thermal expansion, anharmonicity and temperature-dependent Raman spectra of single- and few-layer MoSe₂ and WSe₂.

    Science.gov (United States)

    Late, Dattatray J; Shirodkar, Sharmila N; Waghmare, Umesh V; Dravid, Vinayak P; Rao, C N R

    2014-06-06

    We report the temperature-dependent Raman spectra of single- and few-layer MoSe2 and WSe2 in the range 77-700 K. We observed linear variation in the peak positions and widths of the bands arising from contributions of anharmonicity and thermal expansion. After characterization using atomic force microscopy and high-resolution transmission electron microscopy, the temperature coefficients of the Raman modes were determined. Interestingly, the temperature coefficient of the A(2)(2u) mode is larger than that of the A(1g) mode, the latter being much smaller than the corresponding temperature coefficients of the same mode in single-layer MoS2 and of the G band of graphene. The temperature coefficients of the two modes in single-layer MoSe2 are larger than those of the same modes in single-layer WSe2. We have estimated thermal expansion coefficients and temperature dependence of the vibrational frequencies of MoS2 and MoSe2 within a quasi-harmonic approximation, with inputs from first-principles calculations based on density functional theory. We show that the contrasting temperature dependence of the Raman-active mode A(1g) in MoS2 and MoSe2 arises essentially from the difference in their strain-phonon coupling. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  12. Infrared and Raman spectroscopy: principles and spectral interpretation

    National Research Council Canada - National Science Library

    Larkin, Peter

    2011-01-01

    "Infrared and Raman Spectroscopy: Principles and Spectral Interpretation explains the background, core principles and tests the readers understanding of the important techniques of Infrared and Raman Spectroscopy...

  13. FEM, FIM and STM studies of Hf adsorption on W: the annealing effects

    International Nuclear Information System (INIS)

    Szczudlo, Z.; Trembulowicz, A.; Ciszewksi, A.

    2004-01-01

    Full text: Surface alloys have attracted much attention recently, and investigation of them is a growing research field. Laves intermetallic phase with the regular structure of C15 is formed for the Hf-W System. Space filling in Laves phases is higher than that in the close-packed structures of fcc and hcp metals, and obviously higher than in bcc W. The former studies showed no evidence for Hf dissolution in the substrate in the temperature range 300 - 1500 K, though some evidence was found of Hf dissolution in the range 1500 - 1700 K and a possible surface alloy formation. In the present work, Hf layers of various thickness were deposited on tungsten field emitter tips and on W(110) and W(100) oriented single crystals at room temperature under UHV conditions previous to gradual annealing from 700 - 2300 K. Topographical and structural changes caused by annealing have been studied by field electron microscopy (FEM), field ion microscopy FIM in the case of the tips and by scanning tunneling microscopy (STM) in the case of W(110) and W(100) single crystals. The FEM and FIM studies showed faceting around the and poles of tungsten caused by annealing of the hafnium adsorption layers as well as strong development of the W {110} planes. The STM studies revealed that Hf deposited at room temperature on W(110) accumulate mainly along the step edges of the substrate. Sometimes islands were formed on terraces. Sporadically there were wide unfilled trays or hollows in the flat adsorbate layer. Growth of an ordered adsorbate layer proceeds mainly by sticking the Hf atoms at a terrace edge of the substrate. After heating up to 1650 K contrast changes were observed indicating that kind of a surface alloy could be formed on some terraces, originating at terrace edges. The width of the terraces on which the alloy was formed increased to 40 - 60 nm. In the case of Hf adsorption on W(100) after annealing up to 1200 K small separate islands of the adsorbate were formed. Evidences of

  14. Analysis of ancient pigments by Raman microscopy

    International Nuclear Information System (INIS)

    Zuo Jian; Xu Cunyi

    1999-01-01

    Raman microscopy can be applied for the spatial resolution, and non-destructive in situ analysis of inorganic pigments in pottery, manuscripts and paintings. Compared with other techniques, it is the best single technique for this purpose. An overview is presented of the applications of Raman microscopy in the analysis of ancient pigments

  15. INFRARED AND RAMAN SPECTROSCOPIC STUDY OF ION ...

    African Journals Online (AJOL)

    Infrared and Raman spectroscopy techniques have been used to study the ionic interactions of strontium(II) and barium(II) with thiocyanate ion in liquid ammonia. A number of bands were observed in both n (CN) and n (CS) regions of infrared and Raman spectra and these were assigned to 1:1 contact ion pair, ...

  16. Resonance Raman spectroscopic investigation of MLCT character ...

    Indian Academy of Sciences (India)

    Administrator

    Resonance Raman spectroscopy, because of its utility in understanding resonant state dynamics and structure, is an ideal tool to investigate MLCT states of inorganic complexes. In particular, the tunability of the excitation wavelength and thus the resulting resonance Raman intensities provide information on the nuclear ...

  17. Applications of Raman spectroscopy in life science

    Science.gov (United States)

    Martin, Airton A.; T. Soto, Cláudio A.; Ali, Syed M.; Neto, Lázaro P. M.; Canevari, Renata A.; Pereira, Liliane; Fávero, Priscila P.

    2015-06-01

    Raman spectroscopy has been applied to the analysis of biological samples for the last 12 years providing detection of changes occurring at the molecular level during the pathological transformation of the tissue. The potential use of this technology in cancer diagnosis has shown encouraging results for the in vivo, real-time and minimally invasive diagnosis. Confocal Raman technics has also been successfully applied in the analysis of skin aging process providing new insights in this field. In this paper it is presented the latest biomedical applications of Raman spectroscopy in our laboratory. It is shown that Raman spectroscopy (RS) has been used for biochemical and molecular characterization of thyroid tissue by micro-Raman spectroscopy and gene expression analysis. This study aimed to improve the discrimination between different thyroid pathologies by Raman analysis. A total of 35 thyroid tissues samples including normal tissue (n=10), goiter (n=10), papillary (n=10) and follicular carcinomas (n=5) were analyzed. The confocal Raman spectroscopy allowed a maximum discrimination of 91.1% between normal and tumor tissues, 84.8% between benign and malignant pathologies and 84.6% among carcinomas analyzed. It will be also report the application of in vivo confocal Raman spectroscopy as an important sensor for detecting advanced glycation products (AGEs) on human skin.

  18. Raman Spectroscopic Studies of Methane Gas Hydrates

    DEFF Research Database (Denmark)

    Hansen, Susanne Brunsgaard; Berg, Rolf W.

    2009-01-01

    A brief review of the Raman spectroscopic studies of methane gas hydrates is given, supported by some new measurements done in our laboratory.......A brief review of the Raman spectroscopic studies of methane gas hydrates is given, supported by some new measurements done in our laboratory....

  19. PULSED MULTICHANNEL RAMAN SPECTROMETRY OF TRANSIENT STATES

    OpenAIRE

    Buntinx, G.; Bridoux, M.; Deffontaine, A.; Poizat, O.

    1987-01-01

    Spontaneous Raman spectroscopy is a nonperturbing diagnostic tool that provides detailed structural information about molecules through the vibrational-line positions and intensities. Because of many specific properties, pulsed Raman spectroscopy can provide valuable information in situations in which ultrarapid recording of the vibrational spectra is of crucial importance.

  20. RAMAN-SPECTRA OF HUMAN DENTAL CALCULUS

    NARCIS (Netherlands)

    TSUDA, H; ARENDS, J

    1993-01-01

    Raman spectra of human dental calculus have been observed for the first time by use of micro-Raman spectroscopy. The spectral features of calculus were influenced easily by heating caused by laser irradiation. Therefore, the measurements were carried out at relatively low power (5 mW, 1-mu m spot