Sample records for pseudo-acceleration response spectra

  1. Damping modification factors for acceleration response spectra

    Directory of Open Access Journals (Sweden)

    Heng Li


    Full Text Available DMF (Damping modification factors are used to modify elastic response spectral values corresponding to damping ratio 5% to other damping levels. The influence of seismological parameters (magnitude, epicentral distances and site conditions on DMF for acceleration spectra was analysed. The results show that for a given period as the magnitude or distance increase, the effect of damping on the seismic response will also increase, which indicates the response reduction from the structural damping will become more efficient. In the near-field of small earthquakes, the influence of site conditions on DMF is obvious, but it does not show a consistent rule. Furthermore, the DMF corresponding to different site conditions gradually close to unity with increasing magnitude and distance. The influence of the above mentioned parameters is related to the relative attenuation of the frequency components of the ground motion. The attenuation index alone is sufficient to take into account the influence. Based on these features, this paper proposes a formula of DMF for acceleration response spectra.

  2. Calculation of a Shock Response Spectra

    Directory of Open Access Journals (Sweden)

    Jiri Tuma


    Full Text Available As it is stated in the ISO 18431-4 Standard, a Shock Response Spectrum is defined as the response to a given accelerationacting at a set of mass-damper-spring oscillators, which are adjusted to the different resonance frequencies while their resonancegains (Q-factor are equal to the same value. The maximum of the absolute value of the calculated responses as a function of theresonance frequencies compose the shock response spectrum (SRS. The paper will deal with employing Signal Analyzer, the softwarefor signal processing, for calculation of the SRS. The theory is illustrated by examples.

  3. Real-Time Continuous Response Spectra Exceedance Calculation (United States)

    Vernon, Frank; Harvey, Danny; Lindquist, Kent; Franke, Mathias


    A novel approach is presented for near real-time earthquake alarms for critical structures at distributed locations using real-time estimation of response spectra obtained from near free-field motions. Influential studies dating back to the 1980s identified spectral response acceleration as a key ground motion characteristic that correlates well with observed damage in structures. Thus, monitoring and reporting on exceedance of spectra-based thresholds are useful tools for assessing the potential for damage to facilities or multi-structure campuses based on input ground motions only. With as little as one strong-motion station per site, this scalable approach can provide rapid alarms on the damage status of remote towns, critical infrastructure (e.g., hospitals, schools) and points of interests (e.g., bridges) for a very large number of locations enabling better rapid decision making during critical and difficult immediate post-earthquake response actions. Real-time calculation of PSA exceedance and alarm dissemination are enabled with Bighorn, a module included in the Antelope software package that combines real-time spectral monitoring and alarm capabilities with a robust built-in web display server. Examples of response spectra from several M 5 events recorded by the ANZA seismic network in southern California will be presented.

  4. Probabilistic seismic hazard assessment in Greece – Part 2: Acceleration response spectra and elastic input energy spectra

    Directory of Open Access Journals (Sweden)

    G-A. Tselentis


    Full Text Available This second part of the study, deals with the evaluation of the earthquake hazard in Greece in terms of the response spectral acceleration and the elastic input energy equivalent velocity. Four sets of predictive equations were selected, two for each type of spectra. Probabilistic hazard maps were created by determining the seismic hazard at grid points covering the region of interest. The maps are presented for the dominant periods of 0.2 s and 1.0 s for each spectrum. Uniform hazard response spectra (UHRS for six cities located in the regions of highest estimated hazard are also presented. The comparison with elastic design spectra proposed by the latest national building code, has shown that the UHRS values exceed the design values at almost all periods.

  5. Development of site-specific earthquake response spectra for eastern US sites

    Energy Technology Data Exchange (ETDEWEB)

    Beavers, J.E.; Brock, W.R.; Hunt, R.J.; Shaffer, K.E.


    Site-specific earthquake, uniform-hazard response spectra have been defined for the Department of Energy Oak Ridge, Tennessee, and Portsmouth, Ohio, sites for use in evaluating existing facilities and designing new facilities. The site-specific response spectra were defined from probabilistic and deterministic seismic hazard studies following the requirements in DOE-STD-1024-92, ``Guidelines for Probabilistic Seismic Hazard Curves at DOE Sites.` For these two sites, the results show that site-specific uniform-hazard response spectra are slightly higher in the high-frequency range and considerably lower in the low-frequency range compared with response spectra defined for these sites in the past.

  6. Determination of Standard Response Spectra and Effective Peak Ground Accelerations for Seismic Design and Evaluation

    National Research Council Canada - National Science Library

    Matheu, Enrique E; Yule, Don E; Kala, Raju V


    ...) to generate standard acceleration response spectra and effective peak ground accelerations for seismic design and evaluation of structural features of projects under the responsibility of the U.S...

  7. Proposed Site-Specific Response Spectra for Surabaya-Madura Bridge

    Directory of Open Access Journals (Sweden)

    Dyah Kusumastuti


    Full Text Available This paper presents a site-specific seismic hazard study to determine the recommended seismic design criteria for Suramadu Bridge. The study is performed using probabilistic seismic hazard approach to determine maximum acceleration and response spectra at bedrock and followed by local site effect analysis to determine maximum acceleration and response spectra at ground surface. The probabilistic seismic hazard analysis (PSHA is carried out using 3-dimension (3-D seismic source models (fault source model. Two hazard levels are analysed to represent 150 and 3,300 years return period of ground motion around site location. The local site effect analysis is performed using 1-dimension (1-D shear wave propagation theory to obtain peak ground acceleration and response spectra at ground surface. Finally, the site-specific surface response spectra with 5 percent damping are developed based on the mean plus one standard deviation concept from the result of local site effect analysis.

  8. Seismic site coefficients and acceleration design response spectra based on conditions in South Carolina : final report. (United States)


    The simplified procedure in design codes for determining earthquake response spectra involves : estimating site coefficients to adjust available rock accelerations to site accelerations. Several : investigators have noted concerns with the site coeff...

  9. Engineering and Design: Response Spectra and Seismic Analysis for Concrete Hydraulic Structures

    National Research Council Canada - National Science Library


    .... The manual provides guidance regarding how earthquake ground motions are characterized as design response spectra and how they are then used in the process of seismic structural analysis and design...

  10. Proposed Site-Specific Response Spectra for Surabaya-Madura Bridge


    Dyah Kusumastuti; R. Bambang Boediono; Hendriyawan Hendriyawan; Masyhur Irsyam; Donny T. Dangkua; Engkon K. Kertapati


    This paper presents a site-specific seismic hazard study to determine the recommended seismic design criteria for Suramadu Bridge. The study is performed using probabilistic seismic hazard approach to determine maximum acceleration and response spectra at bedrock and followed by local site effect analysis to determine maximum acceleration and response spectra at ground surface. The probabilistic seismic hazard analysis (PSHA) is carried out using 3-dimension (3-D) seismic source models (fault...

  11. The variability of PSV response spectra across a dense array deployed during the Northridge aftershock sequence (United States)

    Field, E.H.; Hough, S.E.


    This study addresses the variability of pseudo-velocity response spectra across an array deployed on stiff soil in the San Fernando Valley during the Northridge (Mw 6.7) aftershock sequence. The separation between stations ranged from 0.5 to 5 km, and the aftershock magnitudes ranged from 2.3 to 4.0. We find that 95-percent of observed response spectra are within a factor of 1.9 to 2.6 of the network average. Statistically significant relative amplification factors were found for some of the sites, but the variability of observed response spectra is not significantly reduced by correcting for these effects. This implies that microzonation efforts on less than 5-km distance scales are not warranted at these types of sites. We also found a distance dependence for the response-spectral variability between neighboring sites. 95-percent are within a factor of ???2.3 at 0.5 km, increasing to 95-percent within a factor of ???4.2 at 5 km. No frequency dependence in these values could be resolved. Additional work is needed to examine the influence of other factors such as earthquake magnitude.

  12. Responses of plant biochemical substances to reflectance spectra at leaf and canopy scales (United States)

    Shi, Runhe; Zhang, Huifang; Sun, Juan; Gao, Wei; Zhuang, Dafang; Niu, Zheng


    Plants cover more than 70% of our earth's land surface and play an important role in the exchange of materials and energy between land and atmosphere. The biochemical substances existing in leaves have been proven to be critical factors in influencing, or even controlling, this exchange by means of various physiological processes, including photosynthesis, evaportranspiration, litter decomposition, etc. Compared to traditional wet chemistry methods, estimation of their contents through leaf and canopy reflectance spectra has become a rapid, efficient, and promising method over the past few decades, which had been physically based on the selective absorption features of a particular substance. This paper discusses the responses of plant biochemical substances to the reflectance spectra at both leaf and canopy scales. We use a leaf optical model PROSPECT and a leaf-canopy coupled optical model PROSAIL to generate large amounts of leaf and canopy spectra. Both of these models contain three biochemical parameters: cab-chlorophyll concentration, Cw-equivalent leaf water thickness, and Cm-dry matter concentration. Local and global sensitivity analysis (SA) methods are used on the simulated spectra to differentiate their contributions to the outcome spectra at both scales so as to investigate their scale effects. Results show that the maximum sensitivities of chlorophyll and water are much higher than that of dry matter at leaf scale, and they tend to decrease at canopy scale because canopy shape, soil, and incident/reflected geometric factors have a large influence on canopy spectra. However, the sensitivity of dry matter exceeds the maximum sensitivity of mesophyll structure parameters at canopy scale and becomes the top contributor at the beginning of near infrared.

  13. Estimations of On-site Directional Wave Spectra from Measured Ship Responses

    DEFF Research Database (Denmark)

    Nielsen, Ulrik Dam


    spectrum is found directly as the values in a completely discretised frequency-directional domain without a priori assumptions on the spectrum. The paper outlines the theory of these two concepts, and it is shown how to deal with the speed-of-advance problem for operating ships. In addition, the methods......In general, two main concepts can be applied to estimate the on-site directional wave spectrum on the basis of ship response measurements: 1) a parametric method which assumes the wave spectrum to be composed by parameterised wave spectra, or 2) a non-parametric method where the directional wave...... include an quivalence of energy in the governing equations and, as regards the parametric concept, a frequency dependent spreading of the waves is introduced. The paper includes an extensive analysis of full-scale measurements for which the directional wave spectra are estimated by the two ship response...

  14. Determination of floor response spectra for the Brookhaven HFBR reactor building structure

    Energy Technology Data Exchange (ETDEWEB)

    Subudhi, M.; Goradia, H.


    In order to perform the dynamic analysis of various structural components of the HFBR reactor building at Brookhaven National Laboratory (BNL) subjected to seismic disturbances, it is necessary to obtain the floor response spectra of the primary structure. The mathematical model includes the four floor levels of the internal structure, the dome, and soil spring effects. The standard time history analysis is adopted to obtain the response spectrum for each floor of the internal structure. This report summarizes the results both in tabular and graphical form for various damping values.

  15. Detector-Response Correction of Two-Dimensional γ-Ray Spectra from Neutron Capture (United States)

    Rusev, G.; Jandel, M.; Arnold, C. W.; Bredeweg, T. A.; Couture, A.; Mosby, S. M.; Ullmann, J. L.


    The neutron-capture reaction produces a large variety of γ-ray cascades with different γ-ray multiplicities. A measured spectral distribution of these cascades for each γ-ray multiplicity is of importance to applications and studies of γ-ray statistical properties. The DANCE array, a 4π ball of 160 BaF2 detectors, is an ideal tool for measurement of neutron-capture γ-rays. The high granularity of DANCE enables measurements of high-multiplicity γ-ray cascades. The measured two-dimensional spectra (γ-ray energy, γ-ray multiplicity) have to be corrected for the DANCE detector response in order to compare them with predictions of the statistical model or use them in applications. The detector-response correction problem becomes more difficult for a 4π detection system than for a single detector. A trial and error approach and an iterative decomposition of γ-ray multiplets, have been successfully applied to the detector-response correction. Applications of the decomposition methods are discussed for two-dimensional γ-ray spectra measured at DANCE from γ-ray sources and from the 10B(n, γ) and 113Cd(n, γ) reactions.

  16. Detector-Response Correction of Two-Dimensional γ-Ray Spectra from Neutron Capture

    Directory of Open Access Journals (Sweden)

    Rusev G.


    Full Text Available The neutron-capture reaction produces a large variety of γ-ray cascades with different γ-ray multiplicities. A measured spectral distribution of these cascades for each γ-ray multiplicity is of importance to applications and studies of γ-ray statistical properties. The DANCE array, a 4π ball of 160 BaF2 detectors, is an ideal tool for measurement of neutron-capture γ-rays. The high granularity of DANCE enables measurements of high-multiplicity γ-ray cascades. The measured two-dimensional spectra (γ-ray energy, γ-ray multiplicity have to be corrected for the DANCE detector response in order to compare them with predictions of the statistical model or use them in applications. The detector-response correction problem becomes more difficult for a 4π detection system than for a single detector. A trial and error approach and an iterative decomposition of γ-ray multiplets, have been successfully applied to the detector-response correction. Applications of the decomposition methods are discussed for two-dimensional γ-ray spectra measured at DANCE from γ-ray sources and from the 10B(n, γ and 113Cd(n, γ reactions.

  17. Exciton Absorption Spectra by Linear Response Methods:Application to Conjugated Polymers

    Energy Technology Data Exchange (ETDEWEB)

    Mosquera, Martin A.; Jackson, Nicholas E.; Fauvell, Thomas J.; Kelley, Matthew S.; Chen, Lin X.; Schatz, George C.; Ratner, Mark A.


    The theoretical description of the timeevolution of excitons requires, as an initial step, the calculation of their spectra, which has been inaccessible to most users due to the high computational scaling of conventional algorithms and accuracy issues caused by common density functionals. Previously (J. Chem. Phys. 2016, 144, 204105), we developed a simple method that resolves these issues. Our scheme is based on a two-step calculation in which a linear-response TDDFT calculation is used to generate orbitals perturbed by the excitonic state, and then a second linear-response TDDFT calculation is used to determine the spectrum of excitations relative to the excitonic state. Herein, we apply this theory to study near-infrared absorption spectra of excitons in oligomers of the ubiquitous conjugated polymers poly(3-hexylthiophene) (P3HT), poly(2-methoxy-5-(2-ethylhexyloxy)-1,4-phenylenevinylene) (MEH-PPV), and poly(benzodithiophene-thieno[3,4-b]thiophene) (PTB7). For P3HT and MEH-PPV oligomers, the calculated intense absorption bands converge at the longest wavelengths for 10 monomer units, and show strong consistency with experimental measurements. The calculations confirm that the exciton spectral features in MEH-PPV overlap with those of the bipolaron formation. In addition, our calculations identify the exciton absorption bands in transient absorption spectra measured by our group for oligomers (1, 2, and 3 units) of PTB7. For all of the cases studied, we report the dominant orbital excitations contributing to the optically active excited state-excited state transitions, and suggest a simple rule to identify absorption peaks at the longest wavelengths. We suggest our methodology could be considered for further evelopments in theoretical transient spectroscopy to include nonadiabatic effects, coherences, and to describe the formation of species such as charge-transfer states and polaron pairs.

  18. Modelling the response of size and diversity spectra of fish assemblages to changes in exploitation

    DEFF Research Database (Denmark)

    Gislason, Henrik; Rice, J.


    to changes in natural mortality, but sensitive to changes in growth and to the relationship between stock and recruitment. The results agree will with results obtained from previous analysis of survey data from the North Sea and suggest that the slope of the size spectrum is a useful measure of fishing......In this paper we investigate whether single and multispecies fisheries models call be used to predict the response of sire and diversity spectra of fish assemblages to changes in exploitation. Both types of models estimate that the slope of the size spectrum will steepen and the intercept...... will increase when fishing intensity increases, while the response of the slope and intercept of the diversity spectrum depend on the model used. The changes in the slope and intercept of the size spectrum are found to be proportional to the change in fishing intensity. The proportionality is insensitive...

  19. Response spectra for differential motion of structures supports during earthquakes in Egypt

    Directory of Open Access Journals (Sweden)

    Mohamed I.S. Elmasry


    Full Text Available Differential motions of ground supports of stiff structures with large plan dimensions and separate foundations under earthquakes were studied by researchers during the last few decades. Such a type of structural response was previously underestimated. The importance of studying such a response comes up from the fact that usually the structures affected are of strategic importance such as bridges. During their expected life, structures may experience vibrations excited by ground waves of short wavelengths during near-source earthquakes, or during amplified earthquake signals, during explosions, or during vibrations induced from nearby strong vibration sources. This is the case when the differential motion of supports becomes considerable. This paper aims to review the effects of seismic signal variations along the structures dimensions with emphasis on Egypt as a case study. The paper shows some patterns of the damage imposed by such differential motion. A replication of the differential motion in the longitudinal direction is applied on a frame bridge model. The resulting straining actions show the necessity for considering the differential motion of supports in the design of special structures in Egypt. Finally, response spectra for the differential motion of supports, based on the available data from previous earthquakes in Egypt, is derived and proposed for designers to include in the design procedure when accounting for such type of structural response, and especially in long-span bridges.

  20. Kalman filtering for neural prediction of response spectra from mining tremors

    Energy Technology Data Exchange (ETDEWEB)

    Krok, A.; Waszczyszyn, Z. [Cracow University of Technology, Krakow (Poland)


    Acceleration response spectra (ARS) for mining tremors in the Upper Silesian Coalfield, Poland are generated using neural networks trained by means of Kalman filtering. The target ARS were computed on the base of measured accelerograms. It was proved that the standard feed-forward, layered neural network, trained by the DEFK (decoupled extended Kalman filter) algorithm is numerically much less efficient than the standard recurrent NN learnt by Recurrent DEKF, cf. (Haykin S, (editor). Kalman filtering and neural networks. New York: John Wiley & Sons; 2001). It is also shown that the studied KF algorithms are better than the traditional Resilient-Propagation learning method. The improvement of the training process and neural prediction due to introduction of an autoregressive input is also discussed in the paper.

  1. Multi-component ground motion response spectra for coupled horizontal, vertical, angular accelerations, and tilt (United States)

    Kalkan, E.; Graizer, V.


    Rotational and vertical components of ground motion are almost always ignored in design or in the assessment of structures despite the fact that vertical motion can be twice as much as the horizontal motion and may exceed 2g level, and rotational excitation may reach few degrees in the proximity of fault rupture. Coupling of different components of ground excitation may significantly amplify the seismic demand by introducing additional lateral forces and enhanced P-?? effects. In this paper, a governing equation of motion is postulated to compute the response of a SDOF oscillator under a multi-component excitation. The expanded equation includes secondary P-?? components associated with the combined impacts of tilt and vertical excitations in addition to the inertial forcing terms due to the angular and translational accelerations. The elastic and inelastic spectral ordinates traditionally generated considering the uniaxial input motion are compared at the end with the multi-component response spectra of coupled horizontal, vertical and tilting motions. The proposed multi-component response spectrum reflects kinematic characteristics of the ground motion that are not identifiable by the conventional spectrum itself, at least for the near-fault region where high intensity vertical shaking and rotational excitation are likely to occur.

  2. Empirical improvements for estimating earthquake response spectra with random‐vibration theory (United States)

    Boore, David; Thompson, Eric M.


    The stochastic method of ground‐motion simulation is often used in combination with the random‐vibration theory to directly compute ground‐motion intensity measures, thereby bypassing the more computationally intensive time‐domain simulations. Key to the application of random‐vibration theory to simulate response spectra is determining the duration (Drms) used in computing the root‐mean‐square oscillator response. Boore and Joyner (1984) originally proposed an equation for Drms , which was improved upon by Liu and Pezeshk (1999). Though these equations are both substantial improvements over using the duration of the ground‐motion excitation for Drms , we document systematic differences between the ground‐motion intensity measures derived from the random‐vibration and time‐domain methods for both of these Drms equations. These differences are generally less than 10% for most magnitudes, distances, and periods of engineering interest. Given the systematic nature of the differences, however, we feel that improved equations are warranted. We empirically derive new equations from time‐domain simulations for eastern and western North America seismological models. The new equations improve the random‐vibration simulations over a wide range of magnitudes, distances, and oscillator periods.

  3. Site classification of Indian strong motion network using response spectra ratios (United States)

    Chopra, Sumer; Kumar, Vikas; Choudhury, Pallabee; Yadav, R. B. S.


    In the present study, we tried to classify the Indian strong motion sites spread all over Himalaya and adjoining region, located on varied geological formations, based on response spectral ratio. A total of 90 sites were classified based on 395 strong motion records from 94 earthquakes recorded at these sites. The magnitude of these earthquakes are between 2.3 and 7.7 and the hypocentral distance for most of the cases is less than 50 km. The predominant period obtained from response spectral ratios is used to classify these sites. It was found that the shape and predominant peaks of the spectra at these sites match with those in Japan, Italy, Iran, and at some of the sites in Europe and the same classification scheme can be applied to Indian strong motion network. We found that the earlier schemes based on description of near-surface geology, geomorphology, and topography were not able to capture the effect of sediment thickness. The sites are classified into seven classes (CL-I to CL-VII) with varying predominant periods and ranges as proposed by Alessandro et al. (Bull Seismol Soc Am 102:680-695 2012). The effect of magnitudes and hypocentral distances on the shape and predominant peaks were also studied and found to be very small. The classification scheme is robust and cost-effective and can be used in region-specific attenuation relationships for accounting local site effect.

  4. Wavenumber-frequency Spectra of Pressure Fluctuations Measured via Fast Response Pressure Sensitive Paint (United States)

    Panda, J.; Roozeboom, N. H.; Ross, J. C.


    The recent advancement in fast-response Pressure-Sensitive Paint (PSP) allows time-resolved measurements of unsteady pressure fluctuations from a dense grid of spatial points on a wind tunnel model. This capability allows for direct calculations of the wavenumber-frequency (k-?) spectrum of pressure fluctuations. Such data, useful for the vibro-acoustics analysis of aerospace vehicles, are difficult to obtain otherwise. For the present work, time histories of pressure fluctuations on a flat plate subjected to vortex shedding from a rectangular bluff-body were measured using PSP. The light intensity levels in the photographic images were then converted to instantaneous pressure histories by applying calibration constants, which were calculated from a few dynamic pressure sensors placed at selective points on the plate. Fourier transform of the time-histories from a large number of spatial points provided k-? spectra for pressure fluctuations. The data provides first glimpse into the possibility of creating detailed forcing functions for vibro-acoustics analysis of aerospace vehicles, albeit for a limited frequency range.

  5. Predominant-period site classification for response spectra prediction equations in Italy (United States)

    Di Alessandro, Carola; Bonilla, Luis Fabian; Boore, David M.; Rovelli, Antonio; Scotti, Oona


    We propose a site‐classification scheme based on the predominant period of the site, as determined from the average horizontal‐to‐vertical (H/V) spectral ratios of ground motion. Our scheme extends Zhao et al. (2006) classifications by adding two classes, the most important of which is defined by flat H/V ratios with amplitudes less than 2. The proposed classification is investigated by using 5%‐damped response spectra from Italian earthquake records. We select a dataset of 602 three‐component analog and digital recordings from 120 earthquakes recorded at 214 seismic stations within a hypocentral distance of 200 km. Selected events are in the moment‐magnitude range 4.0≤Mw≤6.8 and focal depths from a few kilometers to 46 km. We computed H/V ratios for these data and used them to classify each site into one of six classes. We then investigate the impact of this classification scheme on empirical ground‐motion prediction equations (GMPEs) by comparing its performance with that of the conventional rock/soil classification. Although the adopted approach results in only a small reduction of the overall standard deviation, the use of H/V spectral ratios in site classification does capture the signature of sites with flat frequency‐response, as well as deep and shallow‐soil profiles, characterized by long‐ and short‐period resonance, respectively; in addition, the classification scheme is relatively quick and inexpensive, which is an advantage over schemes based on measurements of shear‐wave velocity.

  6. Measuring the response of canopy emissivity spectra to leaf area index variation using thermal hyperspectral data (United States)

    Neinavaz, Elnaz; Darvishzadeh, Roshanak; Skidmore, Andrew K.; Groen, Thomas A.


    One of the plant biophysical factors affecting the canopy spectral reflectance of plants in the optical domain to receive research attention in recent decades is leaf area index (LAI). Although it is expected that the value of LAI affects the emission of radiation, it not known how. To our knowledge, the effect of LAI on plant canopy emissivity spectra has not yet been investigated in the thermal infrared region (TIR 8-14 μm). The overall aim of this study was to demonstrate the effect of LAI on canopy emissivity spectra of different species at the nadir position. The 279 spectral wavebands in the TIR domain were measured under controlled laboratory condition using a MIDAC spectrometer for four plant species. The corresponding LAI of each measurement was destructively calculated. We found a positive correlation between canopy emissivity spectra at various LAI values, indicating that emissivity increases concomitantly with LAI value. The canopy emissivity spectra of the four species were found to be statistically different at various wavebands even when the LAI values of the species were similar. It seems that other biophysical or biochemical factors also contribute to canopy emissivity spectra: this merits further investigation. We not only quantify the role of LAI on canopy emissivity spectra for the first time, but also demonstrate the potential of using hyperspectral thermal data to estimate LAI of plant species.

  7. General Method for Calculating the Response and Noise Spectra of Active Fabry-Perot Semiconductor Waveguides With External Optical Injection

    DEFF Research Database (Denmark)

    Blaaberg, Søren; Mørk, Jesper


    We present a theoretical method for calculating small-signal modulation responses and noise spectra of active Fabry-Perot semiconductor waveguides with external light injection. Small-signal responses due to either a modulation of the pump current or due to an optical amplitude or phase modulation...... amplifiers and an injection-locked laser. We also demonstrate the applicability of the method to analyze slow and fast light effects in semiconductor waveguides. Finite reflectivities of the facets are found to influence the phase changes of the injected microwave-modulated light....

  8. Response of bats to light with different spectra: light-shy and agile bat presence is affected by white and green, but not red light

    National Research Council Canada - National Science Library

    Spoelstra, K; van Grunsven, Roy H. A; Ramakers, J.J.C; Ferguson, Kim B; Raap, Thomas; Donners, Maurice; Veenendaal, Elmar M; Visser, Marcel E


    .... Different spectra may therefore be applied to reduce negative impacts. We used a unique set-up of eight field sites to study the response of bats to three different experimental light spectra in an otherwise dark and undisturbed natural habitat...

  9. Study of a sealed high gas pressure THGEM detector and response of alpha particle spectra (United States)

    Zhang, Yu-Ning; Liu, Qian; Liu, Hong-Bang; Xie, Yi-Gang; Lyu, Xiao-Rui; Chen, Shi; Huang, Wen-Qian; Hong, Dao-Jin; Zheng, Yang-Heng


    A sealed high gas pressure detector working in pure argon is assembled. It consists of a 5 cm × 5 cm PCB THGEM (THick Gaseous Electron Multiplier). The detector structure and experimental setup are described. The performance under high pressure (2 atm) is examined, selecting optimal voltages for the ionization region and induction region. The dependence of the shape of alpha particle spectra measured with relative gas gain on gas pressure (1.3-2.0 atm) has been studied. Eight data sets of relative gas gain versus working voltage of THGEM, expressed by weighting field E/P, are normalized, consistent with theory. The results show that the air tightness of the chamber is good, measured by a sensitive barometer and checked with gas gain. The experimental results are compared with Monte Carlo simulation of energy deposition without gas gain involved. Supported by National Natural Science Foundation of China (11575193, 11205240, 11265003, U1431109)

  10. Dynamic selection of ship responses for estimation of on-site directional wave spectra

    DEFF Research Database (Denmark)

    Andersen, Ingrid Marie Vincent; Storhaug, Gaute


    Knowledge of the wave environment in which a ship is operating is crucial for most on-board decision support systems. Previous research has shown that the directional wave spectrum can be estimated by the use of measured global ship responses and a set of transfer functions determined for the spe......Knowledge of the wave environment in which a ship is operating is crucial for most on-board decision support systems. Previous research has shown that the directional wave spectrum can be estimated by the use of measured global ship responses and a set of transfer functions determined...... for the specific ship. The approach can either be based on parametric or Bayesian (non-parametric) modelling, and in both cases a set of three ship responses usually provides the best estimation. The optimal response combination of three responses at any time depends on the environmental conditions...... and the operation of the ship. Since measurements of more than three responses are usually available, a quick, dynamic selection procedure of the three signals best suited for the wave spectrum estimation procedure is essential. In the present paper the concept of a selection method based on a simple pre...

  11. Approximate method in estimation sensitivity responses to variations in delayed neutron energy spectra

    Energy Technology Data Exchange (ETDEWEB)

    Yoo, J.; Shin, H. S.; Song, T. Y.; Park, W. S. [Korea Atomic Energy Research Institute, Taejon (Korea, Republic of)


    Previous our numerical results in computing point kinetics equations show a possibility in developing approximations to estimate sensitivity responses of nuclear reactor. We recalculate sensitivity responses by maintaining the corrections with first order of sensitivity parameter. We present a method for computing sensitivity responses of nuclear reactor based on an approximation derived from point kinetics equations. Exploiting this approximation, we found that the first order approximation works to estimate variations in the time to reach peak power because of their linear dependence on a sensitivity parameter, and that there are errors in estimating the peak power in the first order approximation for larger sensitivity parameters. To confirm legitimacy of out approximation, these approximate results are compared with exact results obtained from out previous numerical study. 4 refs., 2 figs., 3 tabs. (Author)

  12. Laser Doppler Vibrometer: Application of DOE/Taguchi Methodologies to Pyroshock Response Spectra

    Directory of Open Access Journals (Sweden)

    C. J. Litz


    Full Text Available Statistical methodologies were employed for measuring and analyzing the explosively induced transient responses of a flat steel plate excited with shock. The application of design of experiment methodology was made to structure and test a Taguchi L9(32 full factorial experimental matrix (which uses nine tests to study two factors, with each factor examined at three levels in which a helium-neon laser Doppler vibrometer and two piezocrystal accelerometers were used to monitor explosively induced vibrations ranging from 10 to 105 Hz on a 96 × 48 × 0.25 in. flat steel plate. Resulting conclusions were drawn indicating how these techniques aid in understanding the pyroshock phenomenon with respect to the effects and interrelationships of explosive-charge weight and location on the laser Doppler and contract accelerometer recording systems.

  13. Site specific seismic hazard analysis and determination of response spectra of Kolkata for maximum considered earthquake (United States)

    Shiuly, Amit; Sahu, R. B.; Mandal, Saroj


    This paper presents site specific seismic hazard analysis of Kolkata city, former capital of India and present capital of state West Bengal, situated on the world’s largest delta island, Bengal basin. For this purpose, peak ground acceleration (PGA) for a maximum considered earthquake (MCE) at bedrock level has been estimated using an artificial neural network (ANN) based attenuation relationship developed on the basis of synthetic ground motion data for the region. Using the PGA corresponding to the MCE, a spectrum compatible acceleration time history at bedrock level has been generated by using a wavelet based computer program, WAVEGEN. This spectrum compatible time history at bedrock level has been converted to the same at surface level using SHAKE2000 for 144 borehole locations in the study region. Using the predicted values of PGA and PGV at the surface, corresponding contours for the region have been drawn. For the MCE, the PGA at bedrock level of Kolkata city has been obtained as 0.184 g, while that at the surface level varies from 0.22 g to 0.37 g. Finally, Kolkata has been subdivided into eight seismic subzones, and for each subzone a response spectrum equation has been derived using polynomial regression analysis. This will be very helpful for structural and geotechnical engineers to design safe and economical earthquake resistant structures.

  14. Damping scaling factors for elastic response spectra for shallow crustal earthquakes in active tectonic regions: "average" horizontal component (United States)

    Rezaeian, Sanaz; Bozorgnia, Yousef; Idriss, I.M.; Abrahamson, Norman; Campbell, Kenneth; Silva, Walter


    Ground motion prediction equations (GMPEs) for elastic response spectra are typically developed at a 5% viscous damping ratio. In reality, however, structural and nonstructural systems can have other damping ratios. This paper develops a new model for a damping scaling factor (DSF) that can be used to adjust the 5% damped spectral ordinates predicted by a GMPE for damping ratios between 0.5% to 30%. The model is developed based on empirical data from worldwide shallow crustal earthquakes in active tectonic regions. Dependencies of the DSF on potential predictor variables, such as the damping ratio, spectral period, ground motion duration, moment magnitude, source-to-site distance, and site conditions, are examined. The strong influence of duration is captured by the inclusion of both magnitude and distance in the DSF model. Site conditions show weak influence on the DSF. The proposed damping scaling model provides functional forms for the median and logarithmic standard deviation of DSF, and is developed for both RotD50 and GMRotI50 horizontal components. A follow-up paper develops a DSF model for vertical ground motion.

  15. Inequality spectra (United States)

    Eliazar, Iddo


    Inequality indices are widely applied in economics and in the social sciences as quantitative measures of the socioeconomic inequality of human societies. The application of inequality indices extends to size-distributions at large, where these indices can be used as general gauges of statistical heterogeneity. Moreover, as inequality indices are plentiful, arrays of such indices facilitate high-detail quantification of statistical heterogeneity. In this paper we elevate from arrays of inequality indices to inequality spectra: continuums of inequality indices that are parameterized by a single control parameter. We present a general methodology of constructing Lorenz-based inequality spectra, apply the general methodology to establish four sets of inequality spectra, investigate the properties of these sets, and show how these sets generalize known inequality gauges such as: the Gini index, the extended Gini index, the Rényi index, and hill curves.

  16. Vibrational absorption spectra from vibrational coupled cluster damped linear response functions calculated using an asymmetric Lanczos algorithm

    DEFF Research Database (Denmark)

    Thomsen, Bo; Hansen, Mikkel Bo; Seidler, Peter


    We report the theory and implementation of vibrational coupled cluster (VCC) damped response functions. From the imaginary part of the damped VCC response function the absorption as function of frequency can be obtained, requiring formally the solution of the now complex VCC response equations. T...

  17. Research on the attribution evaluating methods of dynamic effects of various parameter uncertainties on the in-structure floor response spectra of nuclear power plant (United States)

    Li, Jianbo; Lin, Gao; Liu, Jun; Li, Zhiyuan


    Consideration of the dynamic effects of the site and structural parameter uncertainty is required by the standards for nuclear power plants (NPPs) in most countries. The anti-seismic standards provide two basic methods to analyze parameter uncertainty. Directly manually dealing with the calculated floor response spectra (FRS) values of deterministic approaches is the first method. The second method is to perform probability statistical analysis of the FRS results on the basis of the Monte Carlo method. The two methods can only reflect the overall effects of the uncertain parameters, and the results cannot be screened for a certain parameter's influence and contribution. In this study, based on the dynamic analyses of the floor response spectra of NPPs, a comprehensive index of the assessed impact for various uncertain parameters is presented and recommended, including the correlation coefficient, the regression slope coefficient and Tornado swing. To compensate for the lack of guidance in the NPP seismic standards, the proposed method can effectively be used to evaluate the contributions of various parameters from the aspects of sensitivity, acuity and statistical swing correlations. Finally, examples are provided to verify the set of indicators from systematic and intuitive perspectives, such as the uncertainty of the impact of the structure parameters and the contribution to the FRS of NPPs. The index is sensitive to different types of parameters, which provides a new technique for evaluating the anti-seismic parameters required for NPPs.

  18. Four-Component Damped Density Functional Response Theory Study of UV/Vis Absorption Spectra and Phosphorescence Parameters of Group 12 Metal-Substituted Porphyrins. (United States)

    Fransson, Thomas; Saue, Trond; Norman, Patrick


    The influences of group 12 (Zn, Cd, Hg) metal-substitution on the valence spectra and phosphorescence parameters of porphyrins (P) have been investigated in a relativistic setting. In order to obtain valence spectra, this study reports the first application of the damped linear response function, or complex polarization propagator, in the four-component density functional theory framework [as formulated in Villaume et al. J. Chem. Phys. 2010 , 133 , 064105 ]. It is shown that the steep increase in the density of states as due to the inclusion of spin-orbit coupling yields only minor changes in overall computational costs involved with the solution of the set of linear response equations. Comparing single-frequency to multifrequency spectral calculations, it is noted that the number of iterations in the iterative linear equation solver per frequency grid-point decreases monotonously from 30 to 0.74 as the number of frequency points goes from one to 19. The main heavy-atom effect on the UV/vis-absorption spectra is indirect and attributed to the change of point group symmetry due to metal-substitution, and it is noted that substitutions using heavier atoms yield small red-shifts of the intense Soret-band. Concerning phosphorescence parameters, the adoption of a four-component relativistic setting enables the calculation of such properties at a linear order of response theory, and any higher-order response functions do not need to be considered-a real, conventional, form of linear response theory has been used for the calculation of these parameters. For the substituted porphyrins, electronic coupling between the lowest triplet states is strong and results in theoretical estimates of lifetimes that are sensitive to the wave function and electron density parametrization. With this in mind, we report our best estimates of the phosphorescence lifetimes to be 460, 13.8, 11.2, and 0.00155 s for H2P, ZnP, CdP, and HgP, respectively, with the corresponding transition

  19. Alouatta trichromatic color vision: cone spectra and physiological responses studied with microspectrophotometry and single unit retinal electrophysiology. (United States)

    Silveira, Luiz Carlos L; Saito, Cézar A; da Silva Filho, Manoel; Kremers, Jan; Bowmaker, James K; Lee, Barry B


    The howler monkeys (Alouatta sp.) are the only New World primates to exhibit routine trichromacy. Both males and females have three cone photopigments. However, in contrast to Old World monkeys, Alouatta has a locus control region upstream of each opsin gene on the X-chromosome and this might influence the retinal organization underlying its color vision. Post-mortem microspectrophotometry (MSP) was performed on the retinae of two male Alouatta to obtain rod and cone spectral sensitivities. The MSP data were consistent with only a single opsin being expressed in each cone and electrophysiological data were consistent with this primate expressing full trichromacy. To study the physiological organization of the retina underlying Alouatta trichromacy, we recorded from retinal ganglion cells of the same animals used for MSP measurements with a variety of achromatic and chromatic stimulus protocols. We found MC cells and PC cells in the Alouatta retina with similar properties to those previously found in the retina of other trichromatic primates. MC cells showed strong phasic responses to luminance changes and little response to chromatic pulses. PC cells showed strong tonic response to chromatic changes and small tonic response to luminance changes. Responses to other stimulus protocols (flicker photometry; changing the relative phase of red and green modulated lights; temporal modulation transfer functions) were also similar to those recorded in other trichromatic primates. MC cells also showed a pronounced frequency double response to chromatic modulation, and with luminance modulation response saturation accompanied by a phase advance between 10-20 Hz, characteristic of a contrast gain mechanism. This indicates a very similar retinal organization to Old-World monkeys. Cone-specific opsin expression in the presence of a locus control region for each opsin may call into question the hypothesis that this region exclusively controls opsin expression.

  20. Alouatta trichromatic color vision: cone spectra and physiological responses studied with microspectrophotometry and single unit retinal electrophysiology.

    Directory of Open Access Journals (Sweden)

    Luiz Carlos L Silveira

    Full Text Available The howler monkeys (Alouatta sp. are the only New World primates to exhibit routine trichromacy. Both males and females have three cone photopigments. However, in contrast to Old World monkeys, Alouatta has a locus control region upstream of each opsin gene on the X-chromosome and this might influence the retinal organization underlying its color vision. Post-mortem microspectrophotometry (MSP was performed on the retinae of two male Alouatta to obtain rod and cone spectral sensitivities. The MSP data were consistent with only a single opsin being expressed in each cone and electrophysiological data were consistent with this primate expressing full trichromacy. To study the physiological organization of the retina underlying Alouatta trichromacy, we recorded from retinal ganglion cells of the same animals used for MSP measurements with a variety of achromatic and chromatic stimulus protocols. We found MC cells and PC cells in the Alouatta retina with similar properties to those previously found in the retina of other trichromatic primates. MC cells showed strong phasic responses to luminance changes and little response to chromatic pulses. PC cells showed strong tonic response to chromatic changes and small tonic response to luminance changes. Responses to other stimulus protocols (flicker photometry; changing the relative phase of red and green modulated lights; temporal modulation transfer functions were also similar to those recorded in other trichromatic primates. MC cells also showed a pronounced frequency double response to chromatic modulation, and with luminance modulation response saturation accompanied by a phase advance between 10-20 Hz, characteristic of a contrast gain mechanism. This indicates a very similar retinal organization to Old-World monkeys. Cone-specific opsin expression in the presence of a locus control region for each opsin may call into question the hypothesis that this region exclusively controls opsin expression.

  1. Stochastic Parameter Estimation of Non-Linear Systems Using Only Higher Order Spectra of the Measured Response (United States)

    Vasta, M.; Roberts, J. B.


    Methods for using fourth order spectral quantities to estimate the unknown parameters in non-linear, randomly excited dynamic systems are developed. Attention is focused on the case where only the response is measurable and the excitation is unmeasurable and known only in terms of a stochastic process model. The approach is illustrated through application to a non-linear oscillator with both non-linear damping and stiffness and with excitation modelled as a stationary Gaussian white noise process. The methods have applications in studies of the response of structures to random environmental loads, such as wind and ocean wave forces.

  2. Design response spectra-compliant real and synthetic GMS for seismic analysis of seismically isolated nuclear reactor containment building

    Directory of Open Access Journals (Sweden)

    Ahmer Ali


    Full Text Available Due to the severe impacts of recent earthquakes, the use of seismic isolation is paramount for the safety of nuclear structures. The diversity observed in seismic events demands ongoing research to analyze the devastating attributes involved, and hence to enhance the sustainability of base-isolated nuclear power plants. This study reports the seismic performance of a seismically-isolated nuclear reactor containment building (NRCB under strong short-period ground motions (SPGMs and long-period ground motions (LPGMs. The United States Nuclear Regulatory Commission-based design response spectrum for the seismic design of nuclear power plants is stipulated as the reference spectrum for ground motion selection. Within the period range(s of interest, the spectral matching of selected records with the target spectrum is ensured using the spectral-compatibility approach. NRC-compliant SPGMs and LPGMs from the mega-thrust Tohoku earthquake are used to obtain the structural response of the base-isolated NRCB. To account for the lack of earthquakes in low-to-moderate seismicity zones and the gap in the artificial synthesis of long-period records, wavelet-decomposition based autoregressive moving average modeling for artificial generation of real ground motions is performed. Based on analysis results from real and simulated SPGMs versus LPGMs, the performance of NRCBs is discussed with suggestions for future research and seismic provisions.

  3. Design response spectra-compliant real and synthetic GMS for seismic analysis of seismically isolated nuclear reactor containment building

    Energy Technology Data Exchange (ETDEWEB)

    Ali, Ahmer [ENVICO Consultants Co. Ltd., Seoul (Korea, Republic of); Abu-Hayah, Nadin; Kim, Doo Kie [Civil and Environmental Engineering, Kunsan National University, Gunsan (Korea, Republic of); Cho, Sung Gook [Innose Tech Co., Ltd., Incheon (Korea, Republic of)


    Due to the severe impacts of recent earthquakes, the use of seismic isolation is paramount for the safety of nuclear structures. The diversity observed in seismic events demands ongoing research to analyze the devastating attributes involved, and hence to enhance the sustainability of base-isolated nuclear power plants. This study reports the seismic performance of a seismically-isolated nuclear reactor containment building (NRCB) under strong short-period ground motions (SPGMs) and long-period ground motions (LPGMs). The United States Nuclear Regulatory Commission-based design response spectrum for the seismic design of nuclear power plants is stipulated as the reference spectrum for ground motion selection. Within the period range(s) of interest, the spectral matching of selected records with the target spectrum is ensured using the spectral-compatibility approach. NRC-compliant SPGMs and LPGMs from the mega-thrust Tohoku earthquake are used to obtain the structural response of the base-isolated NRCB. To account for the lack of earthquakes in low-to-moderate seismicity zones and the gap in the artificial synthesis of long-period records, wavelet-decomposition based autoregressive moving average modeling for artificial generation of real ground motions is performed. Based on analysis results from real and simulated SPGMs versus LPGMs, the performance of NRCBs is discussed with suggestions for future research and seismic provisions.

  4. Response of bats to light with different spectra: light-shy and agile bat presence is affected by white and green, but not red light. (United States)

    Spoelstra, Kamiel; van Grunsven, Roy H A; Ramakers, Jip J C; Ferguson, Kim B; Raap, Thomas; Donners, Maurice; Veenendaal, Elmar M; Visser, Marcel E


    Artificial light at night has shown a remarkable increase over the past decades. Effects are reported for many species groups, and include changes in presence, behaviour, physiology and life-history traits. Among these, bats are strongly affected, and how bat species react to light is likely to vary with light colour. Different spectra may therefore be applied to reduce negative impacts. We used a unique set-up of eight field sites to study the response of bats to three different experimental light spectra in an otherwise dark and undisturbed natural habitat. We measured activity of three bat species groups around transects with light posts emitting white, green and red light with an intensity commonly used to illuminate countryside roads. The results reveal a strong and spectrum-dependent response for the slow-flying Myotis and Plecotus and more agile Pipistrellus species, but not for Nyctalus and Eptesicus species. Plecotus and Myotis species avoided white and green light, but were equally abundant in red light and darkness. The agile, opportunistically feeding Pipistrellus species were significantly more abundant around white and green light, most likely because of accumulation of insects, but equally abundant in red illuminated transects compared to dark control. Forest-dwelling Myotis and Plecotus species and more synanthropic Pipistrellus species are thus least disturbed by red light. Hence, in order to limit the negative impact of light at night on bats, white and green light should be avoided in or close to natural habitat, but red lights may be used if illumination is needed. © 2017 The Author(s).

  5. Inverse modelling of Köhler theory – Part 1: A response surface analysis of CCN spectra with respect to surface-active organic species

    Directory of Open Access Journals (Sweden)

    S. Lowe


    Full Text Available In this study a novel framework for inverse modelling of cloud condensation nuclei (CCN spectra is developed using Köhler theory. The framework is established by using model-generated synthetic measurements as calibration data for a parametric sensitivity analysis. Assessment of the relative importance of aerosol physicochemical parameters, while accounting for bulk–surface partitioning of surface-active organic species, is carried out over a range of atmospherically relevant supersaturations. By introducing an objective function that provides a scalar metric for diagnosing the deviation of modelled CCN concentrations from synthetic observations, objective function response surfaces are presented as a function of model input parameters. Crucially, for the chosen calibration data, aerosol–CCN spectrum closure is confirmed as a well-posed inverse modelling exercise for a subset of the parameters explored herein. The response surface analysis indicates that the appointment of appropriate calibration data is particularly important. To perform an inverse aerosol–CCN closure analysis and constrain parametric uncertainties, it is shown that a high-resolution CCN spectrum definition of the calibration data is required where single-valued definitions may be expected to fail. Using Köhler theory to model CCN concentrations requires knowledge of many physicochemical parameters, some of which are difficult to measure in situ on the scale of interest and introduce a considerable amount of parametric uncertainty to model predictions. For all partitioning schemes and environments modelled, model output showed significant sensitivity to perturbations in aerosol log-normal parameters describing the accumulation mode, surface tension, organic : inorganic mass ratio, insoluble fraction, and solution ideality. Many response surfaces pertaining to these parameters contain well-defined minima and are therefore good candidates for calibration using a Monte

  6. Depth-dependent Vertical-to-Horizontal (V/H) Ratios of Free-Field Ground Motion Response Spectra for Deeply Embedded Nuclear Structures

    Energy Technology Data Exchange (ETDEWEB)

    Wei, X. [Brookhaven National Lab. (BNL), Upton, NY (United States); Braverman, J. [Brookhaven National Lab. (BNL), Upton, NY (United States); Miranda, M. [Brookhaven National Lab. (BNL), Upton, NY (United States); Rosario, M. E. [Brookhaven National Lab. (BNL), Upton, NY (United States); Costantino, C. J. [Brookhaven National Lab. (BNL), Upton, NY (United States)


    This report documents the results of a study to determine the depth-dependent V/H ratios of ground motion response spectra in the free field. The V/H ratios reported herein were developed from a worldwide database of surface and downhole acceleration recordings obtained from 45 vertical array stations. This database was specifically compiled for this project, and includes information from a diversity of active tectonic regions (California, Alaska, Taiwan, Japan), site conditions (rock to soft soil), ground motion intensity levels (PGAs between 0.01 g and 0.50 g), magnitudes (between ML 2.78 and JMA 8.1), epicentral distances (between 3.2 km and 812 km), and source depths (between 1.2 km and 112 km), as well as sensors at surface and at a wide range of depths relevant to the project. To study the significance of the depth effect, V/H ratios from all the records were sorted into a number of depth bins relevant to the project, and statistics (average, standard deviation, coefficient of variation, 16th, 50th, and 84th percentiles) of the V/H ratios within each bin were computed. Similar analyses were repeated, controlling for different site conditions, ground motion intensity levels, array locations, and source depths, to study their relative effect on the V/H ratios. Our findings confirm the importance of the depth effect on the V/H ratios. The research findings in this report can be used to provide guidance on the significance of the depth effect, and the extent to which this effect should be considered in the seismic design of deeply embedded SMR structures and NPP structures in general.

  7. Control spectra for Quito (United States)

    Aguiar, Roberto; Rivas-Medina, Alicia; Caiza, Pablo; Quizanga, Diego


    The Metropolitan District of Quito is located on or very close to segments of reverse blind faults, Puengasí, Ilumbisí-La Bota, Carcelen-El Inca, Bellavista-Catequilla and Tangahuilla, making it one of the most seismically dangerous cities in the world. The city is divided into five areas: south, south-central, central, north-central and north. For each of the urban areas, elastic response spectra are presented in this paper, which are determined by utilizing some of the new models of the Pacific Earthquake Engineering Research Center (PEER) NGA-West2 program. These spectra are calculated considering the maximum magnitude that could be generated by the rupture of each fault segment, and taking into account the soil type that exists at different points of the city according to the Norma Ecuatoriana de la Construcción (2015). Subsequently, the recurrence period of earthquakes of high magnitude in each fault segment is determined from the physical parameters of the fault segments (size of the fault plane and slip rate) and the pattern of recurrence of type Gutenberg-Richter earthquakes with double truncation magnitude (Mmin and Mmax) is used.

  8. Functional heterogeneity of the fucoxanthins and fucoxanthin-chlorophyll proteins in diatom cells revealed by their electrochromic response and fluorescence and linear dichroism spectra (United States)

    Szabó, Milán; Premvardhan, Lavanya; Lepetit, Bernard; Goss, Reimund; Wilhelm, Christian; Garab, Győző


    In this work, by analyzing the electrochromic transient spectra, the 77 K fluorescence emission and excitation, as well as the linear dichroism (LD) and circular dichroism (CD) spectra of low-light (LL) and high-light (HL) grown Phaeodactylum tricornutum cells, we show that the fucoxanthins (Fx) and fucoxanthin-chlorophyll proteins (FCP) exhibit marked functional heterogeneity. Electrochromic transients reveal that LL and HL cells differ substantially in their relative contents of two Fx forms, which absorb at 501 and 550 nm; they exhibit distinct LD signals but are CD silent. Fluorescence emission and excitation spectra at 77 K reveal that although both forms efficiently transfer excitation energy to Chl a, the red form feeds somewhat more energy to photosystem II than to photosystem I. Similar data obtained in Cyclotella meneghiniana cells suggest that the heterogeneity of the FCP pool, with different Fx forms, plays a role in the regulation of energy utilization in FCP-containing organisms.

  9. Response of conifer species from three latitudinal populations to light spectra generated by light-emitting diodes and high-pressure sodium lamps (United States)

    Kent G. Apostol; Kas Dumroese; Jeremy Pinto; Anthony S. Davis


    Light-emitting diode (LED) technology shows promise for supplementing photosynthetically active radiation (PAR) in forest nurseries because of the potential reduction in energy consumption and an ability to supply discrete wavelengths to optimize seedling growth. Our objective was to examine the effects of light spectra supplied by LED and traditional high-pressure...

  10. Spectra of stable sonoluminescence (United States)

    Lewis, Stephen D.


    The continuous emission of picosecond pulses of light has been observed to originate from a bubble trapped at the pressure antinode of a resonant sound field in water and in water/glycerin mixtures. The spectra of this light in several solutions has been measured with a scanning monochrometer/photomultiplier detector system. The spectra are broadband and show strong emission in the UV region. A comparison of this measurement to two other independently produced spectra is made. The spectra are also modeled by a blackbody radiation distribution to determine an effective blackbody temperature and a size is deduced as if Sonoluminescence were characterized by blackbody radiation.

  11. Optical absorption spectra of Ag-11 isomers

    DEFF Research Database (Denmark)

    Martinez, Jose Ignacio; Fernandez, E. M.


    The optical absorption spectra of the three most; stable structural isomers of the Ag-11 cluster were calculated using the time-dependent, density functional theory within the Casida formalism. The slightly different, spectra, of the isomers may permit the identification of the ground-stale confi......The optical absorption spectra of the three most; stable structural isomers of the Ag-11 cluster were calculated using the time-dependent, density functional theory within the Casida formalism. The slightly different, spectra, of the isomers may permit the identification of the ground......-stale configuration predominantly present in the laboratory beams based on a direct comparison between the calculated photoabsorptiou response for the Ag-11 isomers and the measured spectra of medium-size silver clusters trapped in noble gas Ar and Ne matrices at different, temperatures. This assignment is confirmed...

  12. The anisotropic effect of functional groups in 1H NMR spectra is the molecular response property of spatial nucleus independent chemical shifts (NICS)--conformational equilibria of exo/endo tetrahydrodicyclopentadiene derivatives. (United States)

    Kleinpeter, Erich; Lämmermann, Anica; Kühn, Heiner


    The inversion of the flexible five-membered ring in tetrahydrodicyclopentadiene (TH-DCPD) derivatives remains fast on the NMR timescale even at 103 K. Since the intramolecular exchange process could not be sufficiently slowed for spectroscopic evaluation, the conformational equilibrium is thus inaccessible by dynamic NMR. Fortunately, the spatial magnetic properties of the aryl and carbonyl groups attached to the DCPD skeleton can be employed in order to evaluate the conformational state of the system. In this context, the anisotropic effects of the functional groups in the (1)H NMR spectra prove to be the molecular response property of spatial nucleus independent chemical shifts (NICS).


    National Aeronautics and Space Administration — This data set contains 94 optical asteroid spectra obtained by Scott Sawyer as part of his Ph.D. dissertation at the University of Texas at Austin. Observational...

  14. Atomic Spectra Database (ASD) (United States)

    SRD 78 NIST Atomic Spectra Database (ASD) (Web, free access)   This database provides access and search capability for NIST critically evaluated data on atomic energy levels, wavelengths, and transition probabilities that are reasonably up-to-date. The NIST Atomic Spectroscopy Data Center has carried out these critical compilations.

  15. Spectra, Winter 2014 (United States)


    additional copies or more information, please email LEADINGEDGE 1 Contents 30 Navy Launches UAV from Submerged Submarine 31...the splash, Test Sub submerged and started moving underwater. Flying WANDA With the success of Test Sub, the Flimmer team applied the lessons to...coated for corrosion- proofing against the acidic environ- ment in the fuel cell and then welded together. Looking at the complexity of developing

  16. Pattern recognition in spectra (United States)

    Gebran, M.; Paletou, F.


    We present a new automated procedure that simultaneously derives the effective temperature Teff, surface gravity log g, metallicity [Fe/H], and equatorial projected rotational velocity ve sin i for stars. The procedure is inspired by the well-known PCA-based inversion of spectropolarimetric full-Stokes solar data, which was used both for Zeeman and Hanle effects. The efficiency and accuracy of this procedure have been proven for FGK, A, and late type dwarf stars of K and M spectral types. Learning databases are generated from the Elodie stellar spectra library using observed spectra for which fundamental parameters were already evaluated or with synthetic data. The synthetic spectra are calculated using ATLAS9 model atmospheres. This technique helped us to detect many peculiar stars such as Am, Ap, HgMn, SiEuCr and binaries. This fast and efficient technique could be used every time a pattern recognition is needed. One important application is the understanding of the physical properties of planetary surfaces by comparing aboard instrument data to synthetic ones.

  17. Estimating Spectra from Photometry (United States)

    Bryce Kalmbach, J.; Connolly, Andrew J.


    Measuring the physical properties of galaxies such as redshift frequently requires the use of spectral energy distributions (SEDs). SED template sets are, however, often small in number and cover limited portions of photometric color space. Here we present a new method to estimate SEDs as a function of color from a small training set of template SEDs. We first cover the mathematical background behind the technique before demonstrating our ability to reconstruct spectra based upon colors and then compare our results to other common interpolation and extrapolation methods. When the photometric filters and spectra overlap, we show that the error in the estimated spectra is reduced by more than 65% compared to the more commonly used techniques. We also show an expansion of the method to wavelengths beyond the range of the photometric filters. Finally, we demonstrate the usefulness of our technique by generating 50 additional SED templates from an original set of 10 and by applying the new set to photometric redshift estimation. We are able to reduce the photometric redshifts standard deviation by at least 22.0% and the outlier rejected bias by over 86.2% compared to original set for z ≤ 3.

  18. Comparability of red/near-infrared reflectance and NDVI based on the spectral response function between MODIS and 30 other satellite sensors using rice canopy spectra. (United States)

    Huang, Weijiao; Huang, Jingfeng; Wang, Xiuzhen; Wang, Fumin; Shi, Jingjing


    Long-term monitoring of regional and global environment changes often depends on the combined use of multi-source sensor data. The most widely used vegetation index is the normalized difference vegetation index (NDVI), which is a function of the red and near-infrared (NIR) spectral bands. The reflectance and NDVI data sets derived from different satellite sensor systems will not be directly comparable due to different spectral response functions (SRF), which has been recognized as one of the most important sources of uncertainty in the multi-sensor data analysis. This study quantified the influence of SRFs on the red and NIR reflectances and NDVI derived from 31 Earth observation satellite sensors. For this purpose, spectroradiometric measurements were performed for paddy rice grown under varied nitrogen levels and at different growth stages. The rice canopy reflectances were convoluted with the spectral response functions of various satellite instruments to simulate sensor-specific reflectances in the red and NIR channels. NDVI values were then calculated using the simulated red and NIR reflectances. The results showed that as compared to the Terra MODIS, the mean relative percentage difference (RPD) ranged from -12.67% to 36.30% for the red reflectance, -8.52% to -0.23% for the NIR reflectance, and -9.32% to 3.10% for the NDVI. The mean absolute percentage difference (APD) compared to the Terra MODIS ranged from 1.28% to 36.30% for the red reflectance, 0.84% to 8.71% for the NIR reflectance, and 0.59% to 9.32% for the NDVI. The lowest APD between MODIS and the other 30 satellite sensors was observed for Landsat5 TM for the red reflectance, CBERS02B CCD for the NIR reflectance and Landsat4 TM for the NDVI. In addition, the largest APD between MODIS and the other 30 satellite sensors was observed for IKONOS for the red reflectance, AVHRR1 onboard NOAA8 for the NIR reflectance and IKONOS for the NDVI. The results also indicated that AVHRRs onboard NOAA7-17 showed

  19. Photobleaching response of different sources of chromophoric dissolved organic matter exposed to natural solar radiation using absorption and excitation-emission matrix spectra.

    Directory of Open Access Journals (Sweden)

    Yunlin Zhang

    Full Text Available CDOM biogeochemical cycle is driven by several physical and biological processes such as river input, biogeneration and photobleaching that act as primary sinks and sources of CDOM. Watershed-derived allochthonous (WDA and phytoplankton-derived autochthonous (PDA CDOM were exposed to 9 days of natural solar radiation to assess the photobleaching response of different CDOM sources, using absorption and fluorescence (excitation-emission matrix spectroscopy. Our results showed a marked decrease in total dissolved nitrogen (TDN concentration under natural sunlight exposure for both WDA and PDA CDOM, indicating photoproduction of ammonium from TDN. In contrast, photobleaching caused a marked increase in total dissolved phosphorus (TDP concentration for both WDA and PDA CDOM. Thus TDN:TDP ratios decreased significantly both for WDA and PDA CDOM, which partially explained the seasonal dynamic of TDN:TDP ratio in Lake Taihu. Photobleaching rate of CDOM absorption a(254, was 0.032 m/MJ for WDA CDOM and 0.051 m/MJ for PDA CDOM from days 0-9, indicating that phototransformations were initially more rapid for the newly produced CDOM from phytoplankton than for the river CDOM. Extrapolation of these values to the field indicated that 3.9%-5.1% CDOM at the water surface was photobleached and mineralized every day in summer in Lake Taihu. Photobleaching caused the increase of spectral slope, spectral slope ratio and molecular size, indicating the CDOM mean molecular weight decrease which was favorable to further microbial degradation of mineralization. Three fluorescent components were validated in parallel factor analysis models calculated separately for WDA and PDA CDOM. Our study suggests that the humic-like fluorescence materials could be rapidly and easily photobleached for WDA and PDA CDOM, but the protein-like fluorescence materials was not photobleached and even increased from the transformation of the humic-like fluorescence substance to the protein

  20. Photobleaching response of different sources of chromophoric dissolved organic matter exposed to natural solar radiation using absorption and excitation-emission matrix spectra. (United States)

    Zhang, Yunlin; Liu, Xiaohan; Osburn, Christopher L; Wang, Mingzhu; Qin, Boqiang; Zhou, Yongqiang


    CDOM biogeochemical cycle is driven by several physical and biological processes such as river input, biogeneration and photobleaching that act as primary sinks and sources of CDOM. Watershed-derived allochthonous (WDA) and phytoplankton-derived autochthonous (PDA) CDOM were exposed to 9 days of natural solar radiation to assess the photobleaching response of different CDOM sources, using absorption and fluorescence (excitation-emission matrix) spectroscopy. Our results showed a marked decrease in total dissolved nitrogen (TDN) concentration under natural sunlight exposure for both WDA and PDA CDOM, indicating photoproduction of ammonium from TDN. In contrast, photobleaching caused a marked increase in total dissolved phosphorus (TDP) concentration for both WDA and PDA CDOM. Thus TDN:TDP ratios decreased significantly both for WDA and PDA CDOM, which partially explained the seasonal dynamic of TDN:TDP ratio in Lake Taihu. Photobleaching rate of CDOM absorption a(254), was 0.032 m/MJ for WDA CDOM and 0.051 m/MJ for PDA CDOM from days 0-9, indicating that phototransformations were initially more rapid for the newly produced CDOM from phytoplankton than for the river CDOM. Extrapolation of these values to the field indicated that 3.9%-5.1% CDOM at the water surface was photobleached and mineralized every day in summer in Lake Taihu. Photobleaching caused the increase of spectral slope, spectral slope ratio and molecular size, indicating the CDOM mean molecular weight decrease which was favorable to further microbial degradation of mineralization. Three fluorescent components were validated in parallel factor analysis models calculated separately for WDA and PDA CDOM. Our study suggests that the humic-like fluorescence materials could be rapidly and easily photobleached for WDA and PDA CDOM, but the protein-like fluorescence materials was not photobleached and even increased from the transformation of the humic-like fluorescence substance to the protein

  1. Sequencing BPS spectra

    Energy Technology Data Exchange (ETDEWEB)

    Gukov, Sergei [Walter Burke Institute for Theoretical Physics, California Institute of Technology,1200 E California Blvd, Pasadena, CA 91125 (United States); Max-Planck-Institut für Mathematik,Vivatsgasse 7, D-53111 Bonn (Germany); Nawata, Satoshi [Walter Burke Institute for Theoretical Physics, California Institute of Technology,1200 E California Blvd, Pasadena, CA 91125 (United States); Centre for Quantum Geometry of Moduli Spaces, University of Aarhus,Nordre Ringgade 1, DK-8000 (Denmark); Saberi, Ingmar [Walter Burke Institute for Theoretical Physics, California Institute of Technology,1200 E California Blvd, Pasadena, CA 91125 (United States); Stošić, Marko [CAMGSD, Departamento de Matemática, Instituto Superior Técnico,Av. Rovisco Pais, 1049-001 Lisbon (Portugal); Mathematical Institute SANU,Knez Mihajlova 36, 11000 Belgrade (Serbia); Sułkowski, Piotr [Walter Burke Institute for Theoretical Physics, California Institute of Technology,1200 E California Blvd, Pasadena, CA 91125 (United States); Faculty of Physics, University of Warsaw,ul. Pasteura 5, 02-093 Warsaw (Poland)


    This paper provides both a detailed study of color-dependence of link homologies, as realized in physics as certain spaces of BPS states, and a broad study of the behavior of BPS states in general. We consider how the spectrum of BPS states varies as continuous parameters of a theory are perturbed. This question can be posed in a wide variety of physical contexts, and we answer it by proposing that the relationship between unperturbed and perturbed BPS spectra is described by a spectral sequence. These general considerations unify previous applications of spectral sequence techniques to physics, and explain from a physical standpoint the appearance of many spectral sequences relating various link homology theories to one another. We also study structural properties of colored HOMFLY homology for links and evaluate Poincaré polynomials in numerous examples. Among these structural properties is a novel “sliding” property, which can be explained by using (refined) modular S-matrix. This leads to the identification of modular transformations in Chern-Simons theory and 3d N=2 theory via the 3d/3d correspondence. Lastly, we introduce the notion of associated varieties as classical limits of recursion relations of colored superpolynomials of links, and study their properties.

  2. Raman spectra of lithium compounds (United States)

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


    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.

  3. The use of synthetic spectra to test the preparedness to evaluate and analyze complex gamma spectra

    Energy Technology Data Exchange (ETDEWEB)

    Nikkinen, M [Doletom OY (Finland)


    This is the report of two exercises that were run under the NKS BOK-1.1 sub-project. In these exercises synthetic gamma spectra were developed to exercise the analysis of difficult spectra typically seen after a severe nuclear accident. The spectra were analyzed twice; first, participants were given short time to give results to resemble an actual emergency preparedness situation, then a longer period of time was allowed to tune the laboratory analysis results for quality assurance purposes. The exercise did prove that it is possible to move measurement data from one laboratory to another if second opinion of the analysis is needed. It was also felt that this kind of exercise would enhance the experience the laboratories have in analyzing accident data. Participants expressed the need for additional exercises of this type, this is inexpensive and an easy way to exercise quick emergency response situations not normally seen in daily laboratory routines. (au)

  4. Interpretation of wave energy spectra

    National Research Council Canada - National Science Library

    Thompson, E.F


    Guidelines for interpreting nondirectional wave energy spectra and presented. A simple method is given for using the spectrum to estimate a significant height and period for each major wave train in most sea states...

  5. Infrared spectra of mineral species

    CERN Document Server

    Chukanov, Nikita V


    This book details more than 3,000 IR spectra of more than 2,000 mineral species collected during last 30 years. It features full descriptions and analytical data of each sample for which IR spectrum was obtained.

  6. Pileup correction of microdosimetric spectra

    CERN Document Server

    Langen, K M; Lennox, A J; Kroc, T K; De Luca, P M


    Microdosimetric spectra were measured at the Fermilab neutron therapy facility using low pressure proportional counters operated in pulse mode. The neutron beam has a very low duty cycle (<0.1%) and consequently a high instantaneous dose rate which causes distortions of the microdosimetric spectra due to pulse pileup. The determination of undistorted spectra at this facility necessitated (i) the modified operation of the proton accelerator to reduce the instantaneous dose rate and (ii) the establishment of a computational procedure to correct the measured spectra for remaining pileup distortions. In support of the latter effort, two different pileup simulation algorithms using analytical and Monte-Carlo-based approaches were developed. While the analytical algorithm allows a detailed analysis of pileup processes it only treats two-pulse and three-pulse pileup and its validity is hence restricted. A Monte-Carlo-based pileup algorithm was developed that inherently treats all degrees of pileup. This algorithm...

  7. Photon spectra from WIMP annihilation


    Ruiz Cembranos, José Alberto; Cruz Dombriz, Álvaro de la; Dobado González, Antonio; Lineros, R. A.; López Maroto, Antonio


    If the present dark matter in the Universe annihilates into standard model particles, it must contribute to the fluxes of cosmic rays that are detected on the Earth and, in particular, to the observed gamma-ray fluxes. The magnitude of such a contribution depends on the particular dark matter candidate, but certain features of the produced photon spectra may be analyzed in a rather model-independent fashion. In this work we provide the complete photon spectra coming from WIMP annihilation int...


    Energy Technology Data Exchange (ETDEWEB)

    Sanchez Almeida, J.; Morales-Luis, A. B. [Instituto de Astrofisica de Canarias, E-38205 La Laguna, Tenerife (Spain); Terlevich, R.; Terlevich, E. [Instituto Nacional de Astrofisica, Optica y Electronica, Tonantzintla, Puebla (Mexico); Cid Fernandes, R., E-mail:, E-mail:, E-mail:, E-mail:, E-mail: [Departamento de Fisica-CFM, Universidade Federal de Santa Catarina, P.O. Box 476, 88040-900 Florianopolis, SC (Brazil)


    We describe a simple step-by-step guide to qualitative interpretation of galaxy spectra. Rather than an alternative to existing automated tools, it is put forward as an instrument for quick-look analysis and for gaining physical insight when interpreting the outputs provided by automated tools. Though the recipe is for general application, it was developed for understanding the nature of the Automatic Spectroscopic K-means-based (ASK) template spectra. They resulted from the classification of all the galaxy spectra in the Sloan Digital Sky Survey data release 7, thus being a comprehensive representation of the galaxy spectra in the local universe. Using the recipe, we give a description of the properties of the gas and the stars that characterize the ASK classes, from those corresponding to passively evolving galaxies, to H II galaxies undergoing a galaxy-wide starburst. The qualitative analysis is found to be in excellent agreement with quantitative analyses of the same spectra. We compare the mean ages of the stellar populations with those inferred using the code STARLIGHT. We also examine the estimated gas-phase metallicity with the metallicities obtained using electron-temperature-based methods. A number of byproducts follow from the analysis. There is a tight correlation between the age of the stellar population and the metallicity of the gas, which is stronger than the correlations between galaxy mass and stellar age, and galaxy mass and gas metallicity. The galaxy spectra are known to follow a one-dimensional sequence, and we identify the luminosity-weighted mean stellar age as the affine parameter that describes the sequence. All ASK classes happen to have a significant fraction of old stars, although spectrum-wise they are outshined by the youngest populations. Old stars are metal-rich or metal-poor depending on whether they reside in passive galaxies or in star-forming galaxies.

  9. Fluorescence Spectra of Highlighter Inks (United States)

    Birriel, Jennifer J.; King, Damon


    Fluorescence spectra excited by laser pointers have been the subject of several papers in "TPT". These papers all describe a fluorescence phenomenon in which the reflected laser light undergoes a change in color: this color change results from the combination of some partially reflected laser light and additional colors generated by…

  10. Correlation Functions and Power Spectra

    DEFF Research Database (Denmark)

    Larsen, Jan


    The present lecture note is a supplement to the textbook Digital Signal Processing by J. Proakis and D.G. Manolakis used in the IMM/DTU course 02451 Digital Signal Processing and provides an extended discussion of correlation functions and power spectra. The definitions of correlation functions...


    African Journals Online (AJOL)

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    characterized by melting point, molar conductivity, magnetic moment, elemental analysis, infrared spectra and thermal analyses. ... methyl-quinazolinone and the final products of the thermogravimetric analysis were recorded on a Perkin-Elmer FT-IR type ..... [Cu(CH3COO)(L)3]. CuO + 5C +12C2H2 + 4NO + NH3 + 0.5N2.

  12. An artificial solar spectrum substantially alters plant development compared with usual climate room irradiance spectra

    NARCIS (Netherlands)

    Hogewoning, S.W.; Douwstra, P.; Trouwborst, G.; Ieperen, van W.; Harbinson, J.


    Plant responses to the light spectrum under which plants are grown affect their developmental characteristics in a complicated manner. Lamps widely used to provide growth irradiance emit spectra which are very different from natural daylight spectra. Whereas specific responses of plants to a

  13. Ultraviolet Fluorescence Spectra of Fingerprints

    Directory of Open Access Journals (Sweden)

    Naoki Saitoh


    Full Text Available We have studied inherent fluorescence spectra and imaging of fingerprints in the deep ultraviolet (UV region with a nanosecond-pulsed Nd-YAG laser system that consists of a tunable laser, a cooled CCD camera, and a grating spectrometer. In this paper, we have studied UV fluorescence spectra of fingerprints under 266-nm illumination. Fluorescence spectra of fingerprints have two main peaks, around 330 nm (peak A and 440 nm (peak B. At first, when a fingerprint has just been pressed, peak A is dominant. However, its intensity reduces as the total illumination time increases. On the other hand, peak B is weak at first. It appears after enough 266-nm illumination and its intensity increases as time elapses. After 3 h of illumination, peak A almost diminishes and peak B becomes dominant. By leaving the fingerprint under a fluorescent lamp in a room without laser illumination, peak A can be restored partly, while the intensity of peak B still increases.Time-resolved fluorescence spectra were also measured for these two peaks. The lifetime of each peak is 2.0 nsec (peak A and 6.2 nsec (peak B on average. Both peaks seem to consist of several components with different lifetimes. In the case of peak A, the 330-nm peak decays fast and a new component at 360 nm becomes dominant when the delay time exceeds 20 nsec. In the case of peak B, unlike peak A, no clear peak separation is observed, but the peak position seems to move from 440 to 460 nm when the delay time becomes larger.

  14. Catalogue of representative meteor spectra (United States)

    Vojáček, V.; Borovička, J.; Koten, P.; Spurný, P.; Štork, R.


    Aims: We present a library of low-resolution meteor spectra that includes sporadic meteors, members of minor meteor showers, and major meteor showers. These meteors are in the magnitude range from +2 to -3, corresponding to meteoroid sizes from 1 mm to 10 mm. Methods: Parallel double-station video observations allowed us to compute heliocentric orbits for all meteors. Most observations were performed during the periods of activity of major meteor showers in the years between 2006 and 2012. Spectra are classified according to relative intensities of the low-temperature emission lines of Mg, Na, and Fe. Results: Shower meteors were found to be of normal composition, except for Southern δ Aquariids and some members of the Geminid shower, neither of which have Na in the meteor spectra. Variations in Na content are typical for the Geminid shower. Three populations of Na-free mereoroids were identified. The first population are iron meteorites, which have an asteroidal-chondritic origin, but one meteoroid with low perihelion (0.11 AU) was found among the iron meteorites. The second population were Sun-approaching meteoroids in which sodium is depleted by thermal desorption. The third population were Na-free meteoroids of cometary origin. Long exposure to cosmic rays on the surface of comets in the Oort cloud and disintegration of this crust might be the origin of this population of meteoroids. Spectra (Figs. 17-30) are only, Tables 4-6 are also available at the CDS via anonymous ftp to ( or via

  15. [Analysis of three-dimensional fluorescence overlapping spectra using differential spectra and independent component analysis]. (United States)

    Yu, Shao-Hui; Zhang, Yu-Jun; Zhao, Nan-Jing; Xiao, Xue; Wang, Huan-Bo; Yin, Gao-Fang


    The analysis of multi-component three-dimensional fluorescence overlapping spectra is always very difficult. In view of the advantage of differential spectra and based on the calculation principle of two-dimensional differential spectra, the three-dimensional fluorescence spectra with both excitation and emission spectra is fully utilized. Firstly, the excitation differential spectra and emission differential spectra are respectively computed after unfolding the three-dimensional fluorescence spectra. Then the excitation differential spectra and emission differential spectra of the single component are obtained by analyzing the multicomponent differential spectra using independent component analysis. In this process, the use of cubic spline increases the data points of excitation spectra, and the roughness penalty smoothing reduces the noise of emission spectra which is beneficial for the computation of differential spectra. The similarity indices between the standard spectra and recovered spectra show that independent component analysis based on differential spectra is more suitable for the component recognition of three-dimensional fluorescence overlapping spectra.

  16. Infrared Spectra of Polycyclic Aromatic Hydrocarbons (PAHs) (United States)

    Bauschlicher, Charles W., Jr.; Bakes, E. L. O.


    We have computed the synthetic infrared spectra of some polycyclic aromatic hydrocarbons containing up to 54 carbon atoms. The species studied include ovalene, circumcoronene, dicoronylene, and hexabenzocoronene. We report spectra for anions, neutrals, cations, and multiply charged cations.

  17. BPS spectra from BPS graphs


    Gabella, Maxime


    I present a simple graphical method to find the BPS spectra of $A_1$ theories of class S. BPS graphs provide a bridge between spectral networks and BPS quivers, the two main frameworks for the study of BPS states. Here I show how to essentially read off from a BPS graph the quantum spectrum generator (or BPS monodromy), expressed as a product of quantum dilogarithms. Thanks to the framed wall-crossing phenomenon for line defects, the determination of the BPS spectrum reduces to the computatio...

  18. Electron-phonon interaction spectra in beryllium

    Energy Technology Data Exchange (ETDEWEB)

    Najdyuk, Yu.G.; Shklyarevskij, O.I. (AN Ukrainskoj SSR, Kharkov. Fiziko-Tekhnicheskij Inst. Nizkikh Temperatur)


    Micro-contact (MC) method was used to investigate spectra of electron-phonon interaction (EPI) in berillium. MC spectra and the known dependences of phonon state density in this metal have been compared in detail. It is shown that the MC spectra can be used for refining the berillium phonon spectrum. The EPI integral parameter has been determined in the free electron model.

  19. Hierarchical resolution of power spectra (United States)

    Badii, R.; Finardi, M.; Broggi, G.; Sepúlveda, M. A.


    We identify the basic ingredients determining the structure of the power spectra of non-linear dynamical systems in a hierarchical order of importance. The analysis, performed with the help of symbolic methods, shows that dynamical invariants such as topological and metric properties of the symbolic orbits explain the main qualitative features of the spectra, whereas the coordinate-dependent values of the observable itself represent a less relevant contribution. Consideration of simple dynamical models with increasing number of topological transition rules evidences the formation of coherent structures (peaks) and explains their position and size. By constructing the parse tree of the allowed symbolic itineraries, it is possible to estimate conditional probabilities by considering orbits belonging to adjacent tree levels. Accordingly, a Markov transition matrix is obtained for each level l and is used to generate signals with statistical properties which approximate those of the actual one increasingly better for l → ∞. A considerable improvement is achieved by recoding the original signal in terms of variable-length words and by re-applying the above procedure to the transformed signal, which is equivalent to a renormalization operation of the associated dynamical map. The accuracy of the estimates is directly related to the convergence of the scaling function for the conditional probabilities. Analytic results are presented for the simplest five Markov models arising from piecewise-linear, continuous, one-dimensional maps. Numerical studies have been performed for the logistic and Hénon maps and for the Lorenz system.

  20. Multiscale climate emulator of multimodal wave spectra: MUSCLE-spectra (United States)

    Rueda, Ana; Hegermiller, Christie A.; Antolinez, Jose A. A.; Camus, Paula; Vitousek, Sean; Ruggiero, Peter; Barnard, Patrick L.; Erikson, Li H.; Tomás, Antonio; Mendez, Fernando J.


    Characterization of multimodal directional wave spectra is important for many offshore and coastal applications, such as marine forecasting, coastal hazard assessment, and design of offshore wave energy farms and coastal structures. However, the multivariate and multiscale nature of wave climate variability makes this complex problem tractable using computationally expensive numerical models. So far, the skill of statistical-downscaling model-based parametric (unimodal) wave conditions is limited in large ocean basins such as the Pacific. The recent availability of long-term directional spectral data from buoys and wave hindcast models allows for development of stochastic models that include multimodal sea-state parameters. This work introduces a statistical downscaling framework based on weather types to predict multimodal wave spectra (e.g., significant wave height, mean wave period, and mean wave direction from different storm systems, including sea and swells) from large-scale atmospheric pressure fields. For each weather type, variables of interest are modeled using the categorical distribution for the sea-state type, the Generalized Extreme Value (GEV) distribution for wave height and wave period, a multivariate Gaussian copula for the interdependence between variables, and a Markov chain model for the chronology of daily weather types. We apply the model to the southern California coast, where local seas and swells from both the Northern and Southern Hemispheres contribute to the multimodal wave spectrum. This work allows attribution of particular extreme multimodal wave events to specific atmospheric conditions, expanding knowledge of time-dependent, climate-driven offshore and coastal sea-state conditions that have a significant influence on local nearshore processes, coastal morphology, and flood hazards.

  1. Scikit-spectra: Explorative Spectroscopy in Python

    Directory of Open Access Journals (Sweden)

    Adam Hughes


    Full Text Available Scikit-spectra is an intuitive framework for explorative spectroscopy in Python. Scikit-spectra leverages the Pandas library for powerful data processing to provide datastructures and an API designed for spectroscopy. Utilizing the new IPython Notebook widget system, scikit-spectra is headed towards a GUI when you want it, API when you need it approach to spectral analysis. As an application, analysis is presented of the surface-plasmon resonance shift in a solution of gold nanoparticles induced by proteins binding to the gold’s surface. Please refer to the scikit-spectra website for full documentation and support:

  2. Reflectance spectra of primitive chondrites (United States)

    Trigo-Rodríguez, J. M.; Moyano-Cambero, C. E.; Llorca, J.


    We are studying a wide sample of pristine carbonaceous chondrites from the NASA Antarctic collection in order to get clues on the physico-chemical processes occurred in the parent bodies of these meteorites. We are obtaining laboratory reflectance spectra of different groups of carbonaceous chondrites, but here we focus in CM and CI chondrites. We discuss the main spectral features that can be used to identify primitive carbonaceous asteroids by remote sensing techniques. Two different spectrometers were used covering the entire 0.3 to 30 μm electromagnetic window. Only a handful of Near Earth Objects (NEOs) exhibit bands or features clearly associated with aqueous alteration. Among them are the target asteroids of Osiris Rex and Marco Polo-R missions.

  3. Graviton spectra in string cosmology

    Energy Technology Data Exchange (ETDEWEB)

    Galluccio, Massimo [Osservatorio Astronomico di Roma (Roma-IT); Litterio, Marco [Istituto Astronomico dell' Universita (Roma-IT); Occhionero, Franco [Osservatorio Astronomico di Roma (Roma-IT)


    We propose to uncover the signature of a stringy era in the primordial Universe by searching for a prominent peak in the relic graviton spectrum. This feature, which in our specific model terminates an ω³ increase and initiates an ω⁻⁷ decrease, is induced during the so far overlooked bounce of the scale factor between the collapsing deflationary era (or pre-Big Bang) and the expanding inflationary era (or post-Big Bang). We evaluate both analytically and numerically the frequency and the intensity of the peak and we show that they may likely fall in the realm of the new generation of interferometric detectors. The existence of a peak is at variance with ordinarily monotonic (either increasing or decreasing) graviton spectra of canonical cosmologies; its detection would therefore offer strong support to string cosmology.

  4. Infrared and ultraviolet spectra of some ( Z)-α-phenyl-β(2-thienyl) acrylonitriles (United States)

    Amato, M. E.; Carbone, D.; Fisichella, S.; Scarlata, G.

    The i.r. spectra of some ( Z)-α-( p-substituted-phenyl)-β-(5-substituted-2-thienyl)acrylonitriles have been investigated for the identification of the main absorption frequencies of cyano, ethylenic and thienyl groups. The u.v. spectra have been discussed in order to obtain further information about the chromophores responsible for the absorption.

  5. Prediction of electroencephalographic spectra from neurophysiology (United States)

    Robinson, P. A.; Rennie, C. J.; Wright, J. J.; Bahramali, H.; Gordon, E.; Rowe, D. L.


    A recent neurophysical model of propagation of electrical waves in the cortex is extended to include a physiologically motivated subcortical feedback loop via the thalamus. The electroencephalographic spectrum when the system is driven by white noise is then calculated analytically in terms of physiological parameters, including the effects of filtering of signals by the cerebrospinal fluid, skull, and scalp. The spectral power at low frequencies is found to vary as f-1 when awake and f-3 when asleep, with a breakpoint to a steeper power-law tail at frequencies above about 20 Hz in both cases; the f-1 range concurs with recent magnetoencephalographic observations of such a regime. Parameter sensitivities are explored, enabling a model with fewer free parameters to be proposed, and showing that spectra predicted for physiologically reasonable parameter values strongly resemble those observed in the laboratory. Alpha and beta peaks seen near 10 Hz and twice that frequency, respectively, in the relaxed wakeful state are generated via subcortical feedback in this model, thereby leading to predictions of their frequencies in terms of physiological parameters, and of correlations in their occurrence. Subcortical feedback is also predicted to be responsible for production of anticorrelated peaks in deep sleep states that correspond to the occurrence of theta rhythm at around half the alpha frequency and sleep spindles at 3/2 times the alpha frequency. An additional positively correlated waking peak near three times the alpha frequency is also predicted and tentatively observed, as are two new types of sleep spindle near 5/2 and 7/2 times the alpha frequency, and anticorrelated with alpha. These results provide a theoretical basis for the conventional division of EEG spectra into frequency bands, but imply that the exact bounds of these bands depend on the individual. Three types of potential instability are found: one at zero frequency, another in the theta band at around

  6. Hysteresis and Soil Site Dependent Input and Hysteretic Energy Spectra for Far-Source Ground Motions

    Directory of Open Access Journals (Sweden)

    Mebrahtom Gebrekirstos Mezgebo


    Full Text Available Earthquake input energy spectra for four soil site classes, four hysteresis models, and five ductility levels are developed for far-source ground motion effect. These energy spectra are normalized by a quantity called velocity index (VI. The use of VI allows for the creation of dimensionless spectra and results in smaller coefficients of variation. Hysteretic energy spectra are then developed to address the demand aspect of an energy-based seismic design of structures with 5% critical damping and ductility that ranges from 2 to 5. The proposed input and hysteretic energy spectra are then compared with response spectra generated using nonlinear time history analyses of real ground motions and are found to produce reasonably good results over a relatively large period range.

  7. Structure of high-resolution NMR spectra

    CERN Document Server

    Corio, PL


    Structure of High-Resolution NMR Spectra provides the principles, theories, and mathematical and physical concepts of high-resolution nuclear magnetic resonance spectra.The book presents the elementary theory of magnetic resonance; the quantum mechanical theory of angular momentum; the general theory of steady state spectra; and multiple quantum transitions, double resonance and spin echo experiments.Physicists, chemists, and researchers will find the book a valuable reference text.

  8. Calculation of reactor antineutrino spectra in TEXONO

    CERN Document Server

    Chen Dong Liang; Mao Ze Pu; Wong, T H


    In the low energy reactor antineutrino physics experiments, either for the researches of antineutrino oscillation and antineutrino reactions, or for the measurement of abnormal magnetic moment of antineutrino, the flux and the spectra of reactor antineutrino must be described accurately. The method of calculation of reactor antineutrino spectra was discussed in detail. Furthermore, based on the actual circumstances of NP2 reactors and the arrangement of detectors, the flux and the spectra of reactor antineutrino in TEXONO were worked out

  9. Mass Spectra of Tetraselenafulvalenes, Diselenadithiafulvalenes and Tetrathiafulvalenes

    DEFF Research Database (Denmark)

    Andersen, Jan Rud; Egsgaard, Helge; Larsen, Elfinn


    The mass spectra of 13 heterofulvalenes are reported. The spectra show great similarities within the selenium and within the sulphur series. The main difference between the selenium and the sulphur compounds results from the more facile loss of selenium compared with sulphur, and from the first...

  10. Spectra of Velocity components over Complex Terrain

    DEFF Research Database (Denmark)

    Panofsky, H. A.; Larko, D.; Lipschut, R.


    Spectra have been measured over a variety of types of complex terrain: on tops of hills and escarpments, over land downstream of a water surface, and over rolling terrain. Differences between spectra over many types of complex terrain, and over uniform terrain, can be explained by these hypotheses...

  11. Resolution enhancement in second-derivative spectra. (United States)

    Czarnecki, Mirosław A


    Derivative spectroscopy is a powerful tool for the resolution enhancement in infrared, near-infrared, Raman, ultraviolet-visible, nuclear magnetic resonance, electron paramagnetic resonance, and fluorescence spectroscopy. Despite its great significance in analytical chemistry, not all aspects of the applications of this method have been explored as yet. This is the first systematic study of the parameters that influence the resolution enhancement in the second derivative spectra. The derivative spectra were calculated with the Savitzky-Golay method with different window size (5, 15, 25) and polynomial order (2, 4). The results obtained in this work show that the resolution enhancement in the second derivative spectra strongly depends on the data spacing in the original spectra, window size, polynomial order, and peak profile. As shown, the resolution enhancement is related to variations in the width of the peaks upon the differentiation. The present study reveals that in order to maximize the separation of the peaks in the second derivative spectra, the original spectra should be recorded at high resolution and differentiated using a small window size and high polynomial order. However, working with the real spectra one has to compromise between the noise reduction and optimization of the resolution enhancement in the second derivative spectra.

  12. Aircraft Measurements of Atmospheric Kinetic Energy Spectra

    DEFF Research Database (Denmark)

    Lundtang Petersen, Erik; Lilly, D. K.


    Wind velocity data obtained from a jet airliner are used to construct kinetic energy spectra over the range of wavelengths from 2.5 to 2500 km. The spectra exhibit an approximate -5/3 slope for wavelengths of less than about 150 km, steepening to about -2.2 at larger scales. These results support...

  13. Simplified expressions that incorporate finite pulse effects into coherent two-dimensional optical spectra (United States)

    Do, Thanh Nhut; Gelin, Maxim F.; Tan, Howe-Siang


    We derive general expressions that incorporate finite pulse envelope effects into a coherent two-dimensional optical spectroscopy (2DOS) technique. These expressions are simpler and less computationally intensive than the conventional triple integral calculations needed to simulate 2DOS spectra. The simplified expressions involving multiplications of arbitrary pulse spectra with 2D spectral response function are shown to be exactly equal to the conventional triple integral calculations of 2DOS spectra if the 2D spectral response functions do not vary with population time. With minor modifications, they are also accurate for 2D spectral response functions with quantum beats and exponential decay during population time. These conditions cover a broad range of experimental 2DOS spectra. For certain analytically defined pulse spectra, we also derived expressions of 2D spectra for arbitrary population time dependent 2DOS spectral response functions. Having simpler and more efficient methods to calculate experimentally relevant 2DOS spectra with finite pulse effect considered will be important in the simulation and understanding of the complex systems routinely being studied by using 2DOS.

  14. Decomposition of spectra using maximum autocorrelation factors

    DEFF Research Database (Denmark)

    Larsen, Rasmus


    This paper addresses the problem of generating a low dimensional representation of the variation present in a set of spectra, e.g. reflection spectra recorded from a series of objects. The resulting low dimensional description may subseque ntly be input through variable selection schemes into cla......This paper addresses the problem of generating a low dimensional representation of the variation present in a set of spectra, e.g. reflection spectra recorded from a series of objects. The resulting low dimensional description may subseque ntly be input through variable selection schemes...... Fourier decomposition these new variables are located in frequency as well as well wavelength. The proposed algorithm is tested on 100 samples of NIR spectra of wheat....

  15. General Notes on Processes and Their Spectra

    Directory of Open Access Journals (Sweden)

    Gustav Cepciansky


    Full Text Available The frequency spectrum performs one of the main characteristics of a process. The aim of the paper is to show the coherence between the process and its own spectrum and how the behaviour and properties of a process itself can be deduced from its spectrum. Processes are categorized and general principles of their spectra calculation and recognition are given. The main stress is put on power spectra of electric and optic signals, as they also perform a kind of processes. These spectra can be directly measured, observed and examined by means of spectral analyzers and they are very important characteristics which can not be omitted at transmission techniques in telecommunication technologies. Further, the paper also deals with non electric processes, mainly with processes and spectra at mass servicing and how these spectra can be utilised in praxis.

  16. SpectraPLOT, Visualization Package with a User-Friendly Graphical Interface (United States)

    Sebald, James; Macfarlane, Joseph; Golovkin, Igor


    SPECT3D is a collisional-radiative spectral analysis package designed to compute detailed emission, absorption, or x-ray scattering spectra, filtered images, XRD signals, and other synthetic diagnostics. The spectra and images are computed for virtual detectors by post-processing the results of hydrodynamics simulations in 1D, 2D, and 3D geometries. SPECT3D can account for a variety of instrumental response effects so that direct comparisons between simulations and experimental measurements can be made. SpectraPLOT is a user-friendly graphical interface for viewing a wide variety of results from SPECT3D simulations, and applying various instrumental effects to the simulated images and spectra. We will present SpectraPLOT's ability to display a variety of data, including spectra, images, light curves, streaked spectra, space-resolved spectra, and drilldown plasma property plots, for an argon-doped capsule implosion experiment example. Future SpectraPLOT features and enhancements will also be discussed.

  17. Influence of borehole and formation characteristics on elemental standard spectra in geochemical logging (United States)

    Wu, Wensheng; Yue, Aizhong; Xiang, Wei; Wang, Shusheng; Fan, Dechang


    Accurate acquisition of elemental standard spectra is one of the key links in geochemical elemental logging. Because elemental standard spectra are affected by borehole and formation characteristics, it is necessary to study the borehole and formation conditions required for the acquisition of ideal spectra. For these, we constructed a model comprising instruments, borehole and formation; applied the Monte Carlo N-Particle Transport Code to simulate elemental standard spectral responses under different borehole and formation conditions; and performed a comparative analysis of these responses. The results demonstrate that, for the standard capture spectra of an element, a fresh water borehole yields spectra with good statistical properties and significant characteristic peaks. For elements with a high capture cross section and prominent characteristic peaks, a borehole of small diameter yields ideal spectra; conversely, a borehole of slightly larger diameter is suitable for elements with a low capture cross section and insignificant characteristic peaks. A formation containing a certain number of pores full of fresh water can yield better standard spectra except for elements that have a giant capture cross section such as Gd. A formation composed of various compounds of an element yields standard spectra with different effects, which means that an elemental compound has to be selected to get an ideal standard spectrum. For the standard inelastic spectrum of an element, the influence of the borehole fluid or pore fluid should be avoided as much as possible except for oxygen; formations composed of an elementary substance, or chlorides or hydrides of an element yields a better standard spectrum than one composed of its oxides, carbonates or other compounds containing elements with a large inelastic cross section. The compactness of the formation influences the characteristic peaks and statistical properties of the standard spectra. The simulation method takes fully

  18. Spectra of conformal sigma models

    Energy Technology Data Exchange (ETDEWEB)

    Tlapak, Vaclav


    In this thesis the spectra of conformal sigma models defined on (generalized) symmetric spaces are analysed. The spaces where sigma models are conformal without the addition of a Wess-Zumino term are supermanifolds, in other words spaces that include fermionic directions. After a brief review of the general construction of vertex operators and the background field expansion, we compute the diagonal terms of the one-loop anomalous dimensions of sigma models on semi-symmetric spaces. We find that the results are formally identical to the symmetric case. However, unlike for sigma models on symmetric spaces, off diagonal terms that lead to operator mixing are also present. These are not computed here. We then present a detailed analysis of the one-loop spectrum of the supersphere S{sup 3} {sup vertical} {sup stroke} {sup 2} sigma model as one of the simplest examples. The analysis illustrates the power and simplicity of the construction. We use this data to revisit a duality with the OSP(4 vertical stroke 2) Gross-Neveu model that was proposed by Candu and Saleur. With the help of a recent all-loop result for the anomalous dimension of (1)/(2)BPS operators of Gross-Neveu models, we are able to recover the entire zero-mode spectrum of the supersphere model. We also argue that the sigma model constraints and its equations of motion are implemented correctly in the Gross-Neveu model, including the one-loop data. The duality is further supported by a new all-loop result for the anomalous dimension of the ground states of the sigma model. However, higher-gradient operators cannot be completely recovered. It is possible that this discrepancy is related to a known instability of the sigma model. The instability of sigma models is due to symmetry preserving high-gradient operators that become relevant at arbitrarily small values of the coupling. This feature has been observed long ago in one-loop calculations of the O(N)-vector model and soon been realized to be a generic

  19. Statistical properties of Fermi GBM GRBs' spectra (United States)

    Rácz, István I.; Balázs, Lajos G.; Horvath, Istvan; Tóth, L. Viktor; Bagoly, Zsolt


    Statistical studies of gamma-ray burst (GRB) spectra may result in important information on the physics of GRBs. The Fermi GBM catalogue contains GRB parameters (peak energy, spectral indices, and intensity) estimated fitting the gamma-ray spectral energy distribution of the total emission (fluence, flnc), and during the time of the peak flux (pflx). Using contingency tables, we studied the relationship of the models best-fitting pflx and flnc time intervals. Our analysis revealed an ordering of the spectra into a power law - Comptonized - smoothly broken power law - Band series. This result was further supported by a correspondence analysis of the pflx and flnc spectra categorical variables. We performed a linear discriminant analysis (LDA) to find a relationship between categorical (spectral) and model independent physical data. LDA resulted in highly significant physical differences among the spectral types, that is more pronounced in the case of the pflx spectra, than for the flnc spectra. We interpreted this difference as caused by the temporal variation of the spectrum during the outburst. This spectral variability is confirmed by the differences in the low-energy spectral index and peak energy, between the pflx and flnc spectra. We found that the synchrotron radiation is significant in GBM spectra. The mean low-energy spectral index is close to the canonical value of α = -2/3 during the peak flux. However, α is ˜ -0.9 for the spectra of the fluences. We interpret this difference as showing that the effect of cooling is important only for the fluence spectra.

  20. On computing first and second order derivative spectra (United States)

    Roy, Indrajit G.


    Enhancing resolution in spectral response and an ability to differentiate spectral mixing in delineating the endmembers from the spectral response are central to the spectral data analysis. First and higher order derivatives analysis of absorbance and reflectance spectral data is commonly used techniques in differentiating the spectral mixing. But high sensitivity of derivative to the noise in data is a major problem in the robust estimation of derivative of spectral data. An algorithm of robust estimation of first and second order derivative spectra from evenly spaced noisy normal spectral data is proposed. The algorithm is formalized in the framework of an inverse problem, where based on the fundamental theorem of calculus a matrix equation is formed using a Volterra type integral equation of first kind. A regularization technique, where the balancing principle is used in selecting a posteriori optimal regularization parameter is designed to solve the inverse problem for robust estimation of first order derivative spectra. The higher order derivative spectra are obtained while using the algorithm in sequel. The algorithm is tested successfully with synthetically generated spectral data contaminated with additive white Gaussian noise, and also with real absorbance and reflectance spectral data for fresh and sea water respectively.

  1. Improved peak shape fitting in alpha spectra. (United States)

    Pommé, S; Caro Marroyo, B


    Peak overlap is a recurrent issue in alpha-particle spectrometry, not only in routine analyses but also in the high-resolution spectra from which reference values for alpha emission probabilities are derived. In this work, improved peak shape formulae are presented for the deconvolution of alpha-particle spectra. They have been implemented as fit functions in a spreadsheet application and optimum fit parameters were searched with built-in optimisation routines. Deconvolution results are shown for a few challenging spectra with high statistical precision. The algorithm outperforms the best available routines for high-resolution spectrometry, which may facilitate a more reliable determination of alpha emission probabilities in the future. It is also applicable to alpha spectra with inferior energy resolution. Copyright © 2014 The Authors. Published by Elsevier Ltd.. All rights reserved.

  2. Power spectra of currents off Bombay

    Digital Repository Service at National Institute of Oceanography (India)

    Varkey, M.J.

    Current measurements were carried out using a recording current meter across the continental shelf off Bombay, Maharashtra, India at 4 stations from an anchored ship. Power spectra were computed for selected lengths of records. Spectral energy...

  3. LARSON FTS SPECTRA V1.0 (United States)

    National Aeronautics and Space Administration — This data set contains 107 asteroid spectra obtained between the years 1975 and 1982 inclusive, with the infrared fourier transform spectrometer (FTS) of H. P....

  4. VILAS ASTEROID SPECTRA V1.0 (United States)

    National Aeronautics and Space Administration — This data set contains 85 published spectra of asteroids obtained by Faith Vilas during the years 1982 - 1992. These appeared in the following papers:...

  5. Determination of diagnostic X ray spectra scattered by a phantom

    Energy Technology Data Exchange (ETDEWEB)

    Fehrenbacher, G.; Panzer, W.; Regulla, D. [GSF - National Research Center for Environment and Health, Neuherberg (Germany). Inst. of Radiation Protection; Tesfu, K. [Addis Ababa Univ. (Ethiopia)


    Photon spectra are reported that result from the scatter of diagnostic X rays at an appropriate water phantom that represents a patient. The tube voltages considered are between 52 kV and 110 kV, the scatter angles from 10{sup o} to 142{sup o} to the normal radiation incidence direction. All spectral measurements were performed with a high-purity germanium detector. Spectral photon fluences are computed from the measured pulse height distribution by using an unfolding procedure. The required response functions of the detection system were obtained by using Monte Carlo methods. Reference is made to a catalogue compiling 35 spectra of scattered X rays in diagnostics resulting from a human substitute, together with information on relevant primary field parameters as well as air kerma for the scattered X rays. (Author).

  6. Automated data processing of high-resolution mass spectra

    DEFF Research Database (Denmark)

    Hansen, Michael Adsetts Edberg; Smedsgaard, Jørn

    infusion of crude extracts into the source taking advantage of the high sensitivity, high mass resolution and accuracy and the limited fragmentation. Unfortunately, there has not been a comparable development in the data processing techniques to fully exploit gain in high resolution and accuracy...... of the massive amounts of data. We present an automated data processing method to quantitatively compare large numbers of spectra from the analysis of complex mixtures, exploiting the full quality of high-resolution mass spectra. By projecting all detected ions - within defined intervals on both the time...... infusion analyses of crude extract to find the relationship between species from several species terverticillate Penicillium, and also that the ions responsible for the segregation can be identified. Furthermore the process can automate the process of detecting unique species and unique metabolites....

  7. Improved peak shape fitting in alpha spectra




    Peak overlap is a recurrent issue ina lpha-particle spectrometry, not only in routine analyses but also in the high-resolution spectra from which reference values for alpha emission probabilities are derived. In this work, improved peak shape formulae are presented for the deconvolution of alpha-particle spectra. They have been implemented as fit functions in a spreadsheet application and optimum fit parameters were searched with built-in optimisation routines. Deconvolution results are shown...

  8. Quantum twin spectra in nanocrystalline silicon (United States)

    Matsumoto, Takahiro; Ohhara, Takashi; Sugimoto, Hidehiko; Bennington, Stephen M.; Ikeda, Susumu


    Using inelastic neutron-scattering spectroscopy, we have identified twin-split scattering spectra in hydrogen-terminated nanocrystalline silicon. We show that this duality originates from the cooperative motion of hydrogen and silicon. Our formalism for the inelastic neutron-scattering spectrum, which is derived from the Hermite orthogonal wave functions in terms of the normal coordinates, elucidates the physical origin of the observed quantum twin spectra and predicts the possible occurrence of this behavior in other materials such as metal hydrides.

  9. Baryon spectra with instanton induced forces


    Semay, Claude; Brau, Fabian; Silvestre-Brac, B.


    Except the vibrational excitations of $K$ and $K^*$ mesons, the main features of spectra of mesons composed of quarks $u$, $d$, and $s$ can be quite well described by a semirelativistic potential model including instanton induced forces. The spectra of baryons composed of the same quarks is studied using the same model. The results and the limitations of this approach are described. Some possible improvements are suggested.

  10. Selection and Characterization of Interesting Grism Spectra


    Meurer, G. R.


    Observations with the ACS Wide Field Camera and G800L grism can produce thousands of spectra within a single WFC field producing a potentially rich treasure trove of information. However, the data are complicated to deal with. Here we describe algorithms to find and characterize spectra of emission line galaxies and supernovae using tools we have developed in conjunction with off the shelf software.

  11. Identifying Broadband Rotational Spectra with Neural Networks (United States)

    Zaleski, Daniel P.; Prozument, Kirill


    A typical broadband rotational spectrum may contain several thousand observable transitions, spanning many species. Identifying the individual spectra, particularly when the dynamic range reaches 1,000:1 or even 10,000:1, can be challenging. One approach is to apply automated fitting routines. In this approach, combinations of 3 transitions can be created to form a "triple", which allows fitting of the A, B, and C rotational constants in a Watson-type Hamiltonian. On a standard desktop computer, with a target molecule of interest, a typical AUTOFIT routine takes 2-12 hours depending on the spectral density. A new approach is to utilize machine learning to train a computer to recognize the patterns (frequency spacing and relative intensities) inherit in rotational spectra and to identify the individual spectra in a raw broadband rotational spectrum. Here, recurrent neural networks have been trained to identify different types of rotational spectra and classify them accordingly. Furthermore, early results in applying convolutional neural networks for spectral object recognition in broadband rotational spectra appear promising. Perez et al. "Broadband Fourier transform rotational spectroscopy for structure determination: The water heptamer." Chem. Phys. Lett., 2013, 571, 1-15. Seifert et al. "AUTOFIT, an Automated Fitting Tool for Broadband Rotational Spectra, and Applications to 1-Hexanal." J. Mol. Spectrosc., 2015, 312, 13-21. Bishop. "Neural networks for pattern recognition." Oxford university press, 1995.

  12. Computer simulation of backscattering spectra from paint (United States)

    Mayer, M.; Silva, T. F.


    To study the role of lateral non-homogeneity on backscattering analysis of paintings, a simplified model of paint consisting of randomly distributed spherical pigment particles embedded in oil/binder has been developed. Backscattering spectra for lead white pigment particles in linseed oil have been calculated for 3 MeV H+ at a scattering angle of 165° for pigment volume concentrations ranging from 30 vol.% to 70 vol.% using the program STRUCTNRA. For identical pigment volume concentrations the heights and shapes of the backscattering spectra depend on the diameter of the pigment particles: This is a structural ambiguity for identical mean atomic concentrations but different lateral arrangement of materials. Only for very small pigment particles the resulting spectra are close to spectra calculated supposing atomic mixing and assuming identical concentrations of all elements. Generally, a good fit can be achieved when evaluating spectra from structured materials assuming atomic mixing of all elements and laterally homogeneous depth distributions. However, the derived depth profiles are inaccurate by a factor of up to 3. The depth range affected by this structural ambiguity ranges from the surface to a depth of roughly 0.5-1 pigment particle diameters. Accurate quantitative evaluation of backscattering spectra from paintings therefore requires taking the correct microstructure of the paint layer into account.

  13. Response of bats to light with different spectra

    NARCIS (Netherlands)

    Spoelstra, Kamiel; Grunsven, van Roy H.A.; Ramakers, Jip J.C.; Ferguson, Kim B.; Raap, Thomas; Donners, Maurice; Veenendaal, Elmar M.; Visser, Marcel E.


    Artificial light at night has shown a remarkable increase over the past decades. Effects are reported for many species groups, and include changes in presence, behaviour, physiology and life-history traits. Among these, bats are strongly affected, and how bat species react to light is likely to

  14. Parameterizing Stellar Spectra Using Deep Neural Networks (United States)

    Li, Xiang-Ru; Pan, Ru-Yang; Duan, Fu-Qing


    Large-scale sky surveys are observing massive amounts of stellar spectra. The large number of stellar spectra makes it necessary to automatically parameterize spectral data, which in turn helps in statistically exploring properties related to the atmospheric parameters. This work focuses on designing an automatic scheme to estimate effective temperature ({T}{eff}), surface gravity ({log}g) and metallicity [Fe/H] from stellar spectra. A scheme based on three deep neural networks (DNNs) is proposed. This scheme consists of the following three procedures: first, the configuration of a DNN is initialized using a series of autoencoder neural networks; second, the DNN is fine-tuned using a gradient descent scheme; third, three atmospheric parameters {T}{eff}, {log}g and [Fe/H] are estimated using the computed DNNs. The constructed DNN is a neural network with six layers (one input layer, one output layer and four hidden layers), for which the number of nodes in the six layers are 3821, 1000, 500, 100, 30 and 1, respectively. This proposed scheme was tested on both real spectra and theoretical spectra from Kurucz’s new opacity distribution function models. Test errors are measured with mean absolute errors (MAEs). The errors on real spectra from the Sloan Digital Sky Survey (SDSS) are 0.1477, 0.0048 and 0.1129 dex for {log}g, {log}{T}{eff} and [Fe/H] (64.85 K for {T}{eff}), respectively. Regarding theoretical spectra from Kurucz’s new opacity distribution function models, the MAE of the test errors are 0.0182, 0.0011 and 0.0112 dex for {log}g, {log}{T}{eff} and [Fe/H] (14.90 K for {T}{eff}), respectively.

  15. Background noise spectra of global seismic stations

    Energy Technology Data Exchange (ETDEWEB)

    Wada, M.M.; Claassen, J.P.


    Over an extended period of time station noise spectra were collected from various sources for use in estimating the detection and location performance of global networks of seismic stations. As the database of noise spectra enlarged and duplicate entries became available, an effort was mounted to more carefully select station noise spectra while discarding others. This report discusses the methodology and criteria by which the noise spectra were selected. It also identifies and illustrates the station noise spectra which survived the selection process and which currently contribute to the modeling efforts. The resulting catalog of noise statistics not only benefits those who model network performance but also those who wish to select stations on the basis of their noise level as may occur in designing networks or in selecting seismological data for analysis on the basis of station noise level. In view of the various ways by which station noise were estimated by the different contributors, it is advisable that future efforts which predict network performance have available station noise data and spectral estimation methods which are compatible with the statistics underlying seismic noise. This appropriately requires (1) averaging noise over seasonal and/or diurnal cycles, (2) averaging noise over time intervals comparable to those employed by actual detectors, and (3) using logarithmic measures of the noise.

  16. Cloud supersaturations from CCN spectra Hoppel minima (United States)

    Hudson, James G.; Noble, Stephen; Tabor, Samantha


    High-resolution cloud condensation nucleus (CCN) spectral measurements in two aircraft field projects, Marine Stratus/Stratocumulus Experiment (MASE) and Ice in Clouds Experiment-Tropical (ICE-T), often showed bimodality that had previously been observed in submicrometer aerosol size distributions obtained by differential mobility analyzers. However, a great deal of spectral shape variability from very bimodal to very monomodal was observed in close proximity. Cloud supersaturation (S) estimates based on critical S, Sc, at minimal CCN concentrations between two modes (Hoppel minima) were ascertained for 63% of 325 measured spectra. These cloud S were lower than effective S (Seff) determined by comparing ambient CCN spectra with nearby cloud droplet concentrations (Nc). Averages for the polluted MASE stratus were 0.15 and 0.23% and for the cumulus clouds of ICE-T 0.44 and 1.03%. This cloud S disagreement between the two methods might in part be due to the fact that Hoppel minima include the effects of cloud processing, which push CCN spectra toward lower S. Furthermore, there is less cloud processing by the smaller cloud droplets, which might be related to smaller droplets evaporating more readily. Significantly lower concentrations within the more bimodal spectra compared with the monomodal spectra indicated active physical processes: Brownian capture of interstitial CCN and droplet coalescence. Chemical cloud processing also contributed to bimodality, especially in MASE.

  17. Program Spectra Analysis with Theory of Evidence

    Directory of Open Access Journals (Sweden)

    Rattikorn Hewett


    Full Text Available This paper presents an approach to automatically analyzing program spectra, an execution profile of program testing results for fault localization. Using a mathematical theory of evidence for uncertainty reasoning, the proposed approach estimates the likelihood of faulty locations based on evidence from program spectra. Our approach is theoretically grounded and can be computed online. Therefore, we can predict fault locations immediately after each test execution is completed. We evaluate the approach by comparing its performance with the top three performing fault localizers using a benchmark set of real-world programs. The results show that our approach is at least as effective as others with an average effectiveness (the reduction of the amount of code examined to locate a fault of 85.6% over 119 versions of the programs. We also study the quantity and quality impacts of program spectra on our approach where the quality refers to the spectra support in identifying that a certain unit is faulty. The results show that the effectiveness of our approach slightly improves with a larger number of failed runs but not with a larger number of passed runs. Program spectra with support quality increases from 1% to 100% improves the approach's effectiveness by 3.29%.

  18. Artificial intelligence analysis of paraspinal power spectra. (United States)

    Oliver, C W; Atsma, W J


    OBJECTIVE: As an aid to discrimination of sufferers with back pain an artificial intelligence neural network was constructed to differentiate paraspinal power spectra. DESIGN: Clinical investigation using surface electromyography. METHOD: The surface electromyogram power spectra from 60 subjects, 33 non-back-pain sufferers and 27 chronic back pain sufferers were used to construct a back propagation neural network that was then tested. Subjects were placed on a test frame in 30 degrees of lumbar forward flexion. An isometric load of two-thirds maximum voluntary contraction was held constant for 30 s whilst surface electromyograms were recorded at the level of the L(4-5). Paraspinal power spectra were calculated and loaded into the input layer of a three-layer back propagation network. The neural network classified the spectra into normal or back pain type. RESULTS: The back propagation neural was shown to have satisfactory convergence with a specificity of 79% and a sensitivity of 80%. CONCLUSIONS: Artificial intelligence neural networks appear to be a useful method of differentiating paraspinal power spectra in back-pain sufferers.

  19. Disk-averaged synthetic spectra of Mars. (United States)

    Tinetti, Giovanna; Meadows, Victoria S; Crisp, David; Fong, William; Velusamy, Thangasamy; Snively, Heather


    The principal goal of the NASA Terrestrial Planet Finder (TPF) and European Space Agency's Darwin mission concepts is to directly detect and characterize extrasolar terrestrial (Earthsized) planets. This first generation of instruments is expected to provide disk-averaged spectra with modest spectral resolution and signal-to-noise. Here we use a spatially and spectrally resolved model of a Mars-like planet to study the detectability of a planet's surface and atmospheric properties from disk-averaged spectra. We explore the detectability as a function of spectral resolution and wavelength range, for both the proposed visible coronograph (TPFC) and mid-infrared interferometer (TPF-I/Darwin) architectures. At the core of our model is a spectrum-resolving (line-by-line) atmospheric/surface radiative transfer model. This model uses observational data as input to generate a database of spatially resolved synthetic spectra for a range of illumination conditions and viewing geometries. The model was validated against spectra recorded by the Mars Global Surveyor-Thermal Emission Spectrometer and the Mariner 9-Infrared Interferometer Spectrometer. Results presented here include disk-averaged synthetic spectra, light curves, and the spectral variability at visible and mid-infrared wavelengths for Mars as a function of viewing angle, illumination, and season. We also considered the differences in the spectral appearance of an increasingly ice-covered Mars, as a function of spectral resolution, signal-to-noise and integration time for both TPF-C and TPFI/ Darwin.

  20. Understanding reconstructed Dante spectra using high resolution spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    May, M. J., E-mail:; Widmann, K.; Kemp, G. E.; Thorn, D.; Colvin, J. D.; Schneider, M. B.; Moore, A.; Blue, B. E. [L-170 Lawrence Livermore National Laboratory, 7000 East Ave., Livermore, California 94551 (United States); Weaver, J. [Naval Research Laboratory, 4555 Overlook Ave. SW, Washington, DC 20375 (United States)


    The Dante is an 18 channel filtered diode array used at the National Ignition Facility (NIF) to measure the spectrally and temporally resolved radiation flux between 50 eV and 20 keV from various targets. The absolute flux is determined from the radiometric calibration of the x-ray diodes, filters, and mirrors and a reconstruction algorithm applied to the recorded voltages from each channel. The reconstructed spectra are very low resolution with features consistent with the instrument response and are not necessarily consistent with the spectral emission features from the plasma. Errors may exist between the reconstructed spectra and the actual emission features due to assumptions in the algorithm. Recently, a high resolution convex crystal spectrometer, VIRGIL, has been installed at NIF with the same line of sight as the Dante. Spectra from L-shell Ag and Xe have been recorded by both VIRGIL and Dante. Comparisons of these two spectroscopic measurements yield insights into the accuracy of the Dante reconstructions.

  1. Understanding reconstructed Dante spectra using high resolution spectroscopy (United States)

    May, M. J.; Weaver, J.; Widmann, K.; Kemp, G. E.; Thorn, D.; Colvin, J. D.; Schneider, M. B.; Moore, A.; Blue, B. E.


    The Dante is an 18 channel filtered diode array used at the National Ignition Facility (NIF) to measure the spectrally and temporally resolved radiation flux between 50 eV and 20 keV from various targets. The absolute flux is determined from the radiometric calibration of the x-ray diodes, filters, and mirrors and a reconstruction algorithm applied to the recorded voltages from each channel. The reconstructed spectra are very low resolution with features consistent with the instrument response and are not necessarily consistent with the spectral emission features from the plasma. Errors may exist between the reconstructed spectra and the actual emission features due to assumptions in the algorithm. Recently, a high resolution convex crystal spectrometer, VIRGIL, has been installed at NIF with the same line of sight as the Dante. Spectra from L-shell Ag and Xe have been recorded by both VIRGIL and Dante. Comparisons of these two spectroscopic measurements yield insights into the accuracy of the Dante reconstructions.

  2. Power spectra of the angular fractals (United States)

    Zhong, Xihua; Zhu, Yafen; Zhou, Yueming


    Based on the angular backbone taken from the triangular Sierpinski gasket, several seLf-similar structures are disigned, corresponding diffraction screens are made, and the Fraunhofer patterns as power spectra of them are given. Based upon a viewpoint of generative production and by means of the ui-branched displacement operation, we have found the recurrence formulae of spectral structure factor for these angular fractals. As a example, the recurrence formulae of power spectra for a coherent point group is given, corresponding a series of curves as well as an isogram are plotted. The analysis of result shows that the power spectra of this fractal point group has a rotation symmetry and a mirror symmetry, and appears a period doubling phenomenon which follows the process of generative production.

  3. Tunneling spectra of graphene on copper unraveled

    DEFF Research Database (Denmark)

    Zhang, Xin; Stradi, Daniele; Liu, Lei


    mechanisms, etc. The interpretation of the spectra can be complicated, however. Specifically for graphene grown on copper, there have been conflicting reports of tunneling spectra. A clear understanding of the mechanisms behind the variability is desired. In this work, we have revealed that the root cause...... of the variability in tunneling spectra is the variation in graphene-substrate coupling under various experimental conditions, providing a salutary perspective on the important role of 2D material-substrate interactions. The conclusions are drawn from measured data and theoretical calculations for monolayer, AB......-stacked bilayer, and twisted bilayer graphene coexisting on the same substrates in areas with and without intercalated oxygen, demonstrating a high degree of consistency. The Van Hove singularities of the twisted graphene unambiguously indicate the Dirac energy between them, lending strong evidence to our...

  4. General and efficient method for calculating modulation ressponses and noise spectra of active semiconductor waveguides

    DEFF Research Database (Denmark)

    Blaaberg, Søren; Öhman, Filip; Mørk, Jesper


    We present a theoretical method for obtaining small-signal responses in a spatially resolved active semiconductor waveguide including finite end-facet reflectivities and amplified spontaneous emission. RF-modulation responses and output noise spectra of an SOA are shown....

  5. Frequency-dependent magneto-impedance spectra in manganite oxides

    CERN Document Server

    Fu, C M; Lin, M L; Wen, Z H


    We present a theoretical analysis which explains the specific feature of frequency dependence of the impedance on the sintered manganese oxides, based on the classical electromagnetism. The occurrence of dielectric and magnetization response has to be taken into account in order to obtain good agreement of experimental data with the theoretical expression in a good dielectric approximation. The result implies that the specific feature of impedance spectra may be related to the interplay of high-frequency electromagnetic field with carriers in the complex dielectric as well as magnetic states.

  6. BETA SPECTRA. I. Negatrons spectra; ESPECTROS BETA. I. Espectros simples de negatrones

    Energy Technology Data Exchange (ETDEWEB)

    Grau Malonda, A.; Garcia-Torano, E.


    Using the Fermi theory of beta decay, the beta spectra for 62 negatrons emitters have been computed introducing a correction factor for unique forbidden transitions. These spectra are plotted vs. energy, once normal i sed, and tabulated with the related Fermi functions. The average and median energies are calculated. (Author)

  7. On Thom spectra, orientability, and cobordism

    CERN Document Server

    Rudyak, Yu B


    For many years, algebraic topology rests on three legs: 'ordinary' cohomology, K-theory, and cobordism. This book is the first guide on the subject of cobordism since R. Stong's encyclopaedic and influential notes of a generation ago. It concentrates on Thom spaces (spectra), orientability theory and (co)bordism theory (including (co)bordism with singularities and, in particular, Morava K-theories), framed by (co)homology theories and spectra. From the Foreword by Haynes Miller The author has also performed a service to the history of science in this book, giving detailed attributions. This sa

  8. Energy spectra of geomagnetically trapped oxygen ions

    CERN Document Server

    Leicher, M; Enge, W


    In a series of COSMOS satellite flights plastic nuclear track detectors have been exposed in low-earth orbits to monitor anomalous cosmic rays (ACR) at energies below 25 MeV/nuc. The analysis of energy spectra has now been extended to energies up to 40 MeV/nuc for two exposures aboard COSMOS 2260 in 1993 and COSMOS 2311 in 1995. Our data on trapped ACR (TACR) oxygen energy spectra might indicate the influence of energy-dependent stripping probabilities and the presence of multiply charged ACR oxygen at high energies as reported by latest SAMPEX observations.

  9. Nonlinear FMR spectra in yttrium iron garnet

    Directory of Open Access Journals (Sweden)

    Yu.M. Bunkov, P.M. Vetoshko, I.G. Motygullin, T.R. Safin, M.S. Tagirov, N.A. Tukmakova


    Full Text Available Results of demagnetizing effect studies in yttrium iron garnet Y3Fe5O12 thin films are reported. Experiments were performed on X-Band of electron paramagnetic resonance spectrometer at room temperature. The ferromagnetic resonance (FMR spectra were obtained for one-layer single crystal YIG films for different values of the applied microwave power. Nonlinear FMR spectra transformation by the microwave power increasing in various directions of magnetic field sweep was observed. It is explained by the influence of the demagnetization action of nonequilibrium magnons.

  10. RM-CLEAN: RM spectra cleaner (United States)

    Heald, George


    RM-CLEAN reads in dirty Q and U cubes, generates rmtf based on the frequencies given in an ASCII file, and cleans the RM spectra following the algorithm given by Brentjens (2007). The output cubes contain the clean model components and the CLEANed RM spectra. The input cubes must be reordered with mode=312, and the output cubes will have the same ordering and thus must be reordered after being written to disk. RM-CLEAN runs as a MIRIAD (ascl:1106.007) task and a Python wrapper is included with the code.

  11. Algorithms for classification of astronomical object spectra (United States)

    Wasiewicz, P.; Szuppe, J.; Hryniewicz, K.


    Obtaining interesting celestial objects from tens of thousands or even millions of recorded optical-ultraviolet spectra depends not only on the data quality but also on the accuracy of spectra decomposition. Additionally rapidly growing data volumes demands higher computing power and/or more efficient algorithms implementations. In this paper we speed up the process of substracting iron transitions and fitting Gaussian functions to emission peaks utilising C++ and OpenCL methods together with the NOSQL database. In this paper we implemented typical astronomical methods of detecting peaks in comparison to our previous hybrid methods implemented with CUDA.

  12. [Characteristics analysis of human tongue reflectance spectra]. (United States)

    Zhao, Jing; Liu, Ming; Lu, Xiao-zuo; Li, Gang


    The present paper presents the spectroscopic analysis method. Eighty samples of spectra data of tongue parts with coating and without coating were collected by Usb4000 spectrometer of Ocean Optics, then comparing the spectra data of the different parts of tongue we found that there was a relation between the spectra characteristics and tongue coating, and further analysis of the spectra data showed that there was a big difference between the two parts within the wavelength range between 500 and 600 nm. It was also found that the biggest differences appear when the wavelength is 579.39 nm, and at the same time, different colors of tongue coating were also compared, and the spectrum was also quite different because of different color and thickness of the tongue coating. The experiment results show that different color, thickness, and dryness of the human tongue coating lead to different spectral characteristics, and compared with the current colorimetric method of tongue characterization, spectral reflectance can reflect more physiological and pathological information. The experiment results also indicated that the different spectral characteristics of tongue property and tongue coating will be used for further separation of these two parts, and to provide an objective analysis index for tongue coating qualitative and quantitative analysis, so as to promote the objectivity of the TCM.

  13. Computer program package for PIXE spectra evaluation

    Energy Technology Data Exchange (ETDEWEB)

    Kajfosz, J. [Institute of Nuclear Physics, Cracow (Poland)


    The computer programs described here were developed for calculating the concentrations of elements in samples analysed by the PIXE (Proton Induced X-ray Emission) method from the X-ray spectra obtained in those analyses. (author). 10 refs, 2 figs.

  14. [Fluorescence spectra of ponceau-4R]. (United States)

    Shi, Ai-Min; Zhu, Tuo; Gu, En-Dong; Liu, Zhou-Yi; Xu, Hui


    The fluorescence spectra of ponceau 4R induced by 220-400 nm light were studied in the present paper. The result shows that ponceau 4R has four obvious fluorescence spectral peaks respectively located at 420, 530, 635 and 687 nm, each of these fluorescence spectral peaks has different best induced light, and the corresponding fluorescence spectra were listed. It was considered that this fluorescence comes from the transition n --> pi* of n electrons in the -OH and pi* --> pi of pi electrons in the naphthalene. The fluorescence spectral peaks at 420 nm come from the transition n --> pi* and the other three fluorescence spectral peaks come from pi* --> pi. But the intensity of the four fluorescence spectral peaks changes differently with the excited wavelength This paper attempted to give the expression of the four fluorescence spectral peaks based on the microcosmic mechanism. The reason for that ponceau 4R has complex fluorescence characteristic is that ponceau 4R not only has big and conjugate structure such as naphthalene and provides electron group -OH which can intensify its ability to emit fluorescence, but also absorbs electron group such as N=N which can depress its ability to emit fluorescence. Investigation on the fluorescence spectra and its characteristics will contribute to the study on the fluorescence spectra of other azo pigment and help find a new way for checking food safety.

  15. Generalized pattern spectra sensitive to spatial information

    NARCIS (Netherlands)

    Wilkinson, MHF; Kasturi, R; Laurendeau, D; Suen, C


    Morphological pattern spectra computed from granulometrics are frequently used to classify the size classes of details in textures and images. An extension of this technique, which retains information on the spatial distribution of the details in each size class is developed. Algorithms for

  16. Polarization Spectra of Extrasolar Giant Planets

    NARCIS (Netherlands)

    Stam, D.M.


    We present simulated spectra of the flux and degree of polarization of starlight that is reflected by extrasolar giant planets (EGPs). In particular the polarization depends strongly on the structure of the planetary atmosphere, and appears to be a valuable tool for the characterization of EGPs.

  17. Spectra of turbulent flow in cumulus cloud (United States)

    Gotoh, Toshiyuki; Saito, Izumi; Watanabe, Takeshi


    We have seamlessly simulated evolution of droplets and turbulence for about ten minutes in a small box which is ascending inside the maritime cumulus cloud. Under the prescribed vertical structure of the mean temperature and water vapor mixing ratio and the periodic boundary condition, the turbulence is computed by the DNS and the particles evolve obeying the condensation-evaporation, collision-coalescence with the hydrodynamic interaction, the Reynolds number dependent drag, and the gravitational sedimentation. It is found that the kinetic energy spectrum obeys nearly Kolmogorov spectrum k - 5 / 3 while the spectra of the temperature and water vapor mixing ratio are much shallower than k - 5 / 3. An explanation of modification of the spectra is explored by examining the droplet number density spectrum En(k , t) and the condensation rate spectrum ECd(k , t) . Two spectra are very similar to each other, nearly k1 at low wavenumber range and k-α , 1 droplets and temperature and water vapor mixing ratio through the condensation-evaporation yields the shallow spectra. Comparison with the data observed at mountain top is also made. JSPS Kakenhi 15H02218, HPCI hp160085 and hp170189, JHPCN jh170013.

  18. Exploring the Morphology of RAVE Stellar Spectra

    NARCIS (Netherlands)

    Matijevic, G.; Zwitter, T.; Bienayme, O.; Bland-Hawthorn, J.; Boeche, C.; Freeman, K. C.; Gibson, B. K.; Gilmore, G.; Grebel, E. K.; Helmi, A.; Munari, U.; Navarro, J.; Parker, Q. A.; Reid, W.; Seabroke, G.; Siebert, A.; Siviero, A.; Steinmetz, M.; Watson, F. G.; Williams, M.; Wyse, R. F. G.

    The RAdial Velocity Experiment (RAVE) is a medium-resolution (R similar to 7500) spectroscopic survey of the Milky Way that has already obtained over half a million stellar spectra. They present a randomly selected magnitude-limited sample, so it is important to use a reliable and automated


    NARCIS (Netherlands)



    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

  20. Discriminating Dysarthria Type from Envelope Modulation Spectra (United States)

    Liss, Julie M.; LeGendre, Sue; Lotto, Andrew J.


    Purpose: Previous research demonstrated the ability of temporally based rhythm metrics to distinguish among dysarthrias with different prosodic deficit profiles (J. M. Liss et al., 2009). The authors examined whether comparable results could be obtained by an automated analysis of speech envelope modulation spectra (EMS), which quantifies the…

  1. Infrared spectra, thermogravimetric analysis and antifungal studies ...

    African Journals Online (AJOL)

    O, FeCl3.6H2O and Cu(CH3COO)2.2H2O in a mixture of an ethanol-bidistilled water (1:1), at 60 °C. They were characterized by melting point, molar conductivity, magnetic moment, elemental analysis, infrared spectra and thermal analyses.

  2. Students' Mental Models of Atomic Spectra (United States)

    Körhasan, Nilüfer Didis; Wang, Lu


    Mental modeling, which is a theory about knowledge organization, has been recently studied by science educators to examine students' understanding of scientific concepts. This qualitative study investigates undergraduate students' mental models of atomic spectra. Nine second-year physics students, who have already taken the basic chemistry and…

  3. Mid-infrared spectra of comet nuclei (United States)

    Kelley, Michael S. P.; Woodward, Charles E.; Gehrz, Robert D.; Reach, William T.; Harker, David E.


    Comet nuclei and D-type asteroids have several similarities at optical and near-IR wavelengths, including near-featureless red reflectance spectra, and low albedos. Mineral identifications based on these characteristics are fraught with degeneracies, although some general trends can be identified. In contrast, spectral emissivity features in the mid-infrared provide important compositional information that might not otherwise be achievable. Jovian Trojan D-type asteroids have emissivity features strikingly similar to comet comae, suggesting that they have the same compositions and that the surfaces of the Trojans are highly porous. However, a direct comparison between a comet and asteroid surface has not been possible due to the paucity of spectra of comet nuclei at mid-infrared wavelengths. We present 5-35 μm thermal emission spectra of comets 10P/Tempel 2, and 49P/Arend-Rigaux observed with the Infrared Spectrograph on the Spitzer Space Telescope. Our analysis reveals no evidence for a coma or tail at the time of observation, suggesting the spectra are dominated by the comet nucleus. We fit each spectrum with the near-Earth asteroid thermal model (NEATM) and find sizes in agreement with previous values. However, the NEATM beaming parameters of the nuclei, 0.74-0.83, are systematically lower than the Jupiter-family comet population mean of 1.03 ± 0.11, derived from 16- and 22-μm photometry. We suggest this may be either an artifact of the spectral reduction, or the consequence of an emissivity low near 16 μm. When the spectra are normalized by the NEATM model, a weak 10-μm silicate plateau is evident, with a shape similar to those seen in mid-infrared spectra of D-type asteroids. A silicate plateau is also evident in previously published Spitzer spectra of the nucleus of comet 9P/Tempel 1. We compare, in detail, these comet nucleus emission features to those seen in spectra of the Jovian Trojan D-types (624) Hektor, (911) Agamemnon, and (1172) Aneas, as well

  4. Direct measurement of mammographic x-ray spectra using a CdZnTe detector. (United States)

    Matsumoto, M; Yamamoto, A; Honda, I; Taniguchi, A; Kanamori, H


    Our purpose is to directly measure mammographic x-ray spectra with collimators and a low-efficiency CdZnTe detector developed recently and to find out the best fit response function of CdZnTe detector to correct the measured spectra. Photon spectra (target Mo or Rh) produced by a mammographic x-ray unit at 25-32 kV and 240 mAs (= 3 times of 80 mAs) and transmitted through 0.03 mm Mo or 0.025 mm Rh filter and object (0.1 mm Al to 0.8 mm Al phantoms) have been analyzed. Since detected spectra were distorted by the response of CdZnTe detector and did not present the true photon spectra, the correction was applied by the stripping procedure. The response function of detector used in this procedure has been determined by the evaluation of interactions (K-escape, coherent scattering, and Compton scattering processes) and incomplete charge collection calculated using the Monte Carlo method. We have used Kalpha1, Kalpha2, Kbeta1, Kbeta2 radiations of Cd, Zn, and Te, respectively and have used the weight function for the incomplete charge collection and have considered Compton scattering. The Monte Carlo simulations were continued by changing the important factors (mean path length of hole lambda(h), dead layer of the CZT crystal and weight factor Wq) of incomplete charge collection until the best fit response function was found out. Corrected photon spectra were compared with the mammographic x-ray spectral data of Bureau of Radiological Health (BRH) measured using a Ge detector. Attenuation curves of aluminum for 25-32 kV were calculated from the corrected photon spectra and compared with the attenuation curves measured using an ionization chamber. These results obtained using the CdZnTe detector agreed with the mammographic x-ray spectral data of BRH and attenuation curves obtained by the ionization chamber.

  5. An Interactive Gallery of Planetary Nebula Spectra (United States)

    Kwitter, K. B.; Henry, R. B. C.


    We have created a website containing high-quality moderate-resolution spectra of 88 planetary nebulae (PNe) from 3600 to 9600 Å, obtained at KPNO and CTIO. Spectra are displayed in a zoomable window, and there are templates available that show wavelength and ion identifications. In addition to the spectra themselves, the website also contains a brief discussion of PNe as astronomical objects and as contributors to our understanding of stellar evolution, and a table with atlas information for each object along with a link to an image. This table can be re-ordered by object name, galactic or equatorial coordinates, distance from the sun, the galactic center, or the galactic plane. We envision that this website, which concentrates a large amount of data in one place, will be of interest to a variety of users. PN researchers might need to check the spectrum of a particular object of interest; the non-specialist astronomer might simply be interested in perusing such a collection of spectra; and finally, teachers of introductory astronomy can use this database to illustrate basic principles of atomic physics and radiation. To encourage such use, we have written two simple exercises at a basic level to introduce beginning astronomy students to the wealth of information that PN spectra contain. We are grateful to Adam Wang of the Williams College OIT and to his summer student teams who worked on various apects of the implementation of this website. This work has been supported by NSF grant AST-9819123 and by Williams College and the University of Oklahoma.

  6. Improving interpretation of infrared spectra for OM characterization by subtraction of spectra from incinerated samples (United States)

    Ellerbrock, Ruth H.; Gerke, Horst H.; Leue, Martin


    Non-destructive methods such as diffuse reflectance infrared Fourier transform spectroscopy (DRIFT) have been applied to characterize organic matter (OM) at intact structural surfaces among others. However, it is often difficult to distinguish effects of organic components on DRIFT signal intensities from those of mineral components. The objective of this study was to re-evaluate DRIFT spectra from intact earthworm burrow walls and coated cracks to improve the interpretation of C-H and C=O bands. We compared DRIFT and transmission Fourier transform infrared (FTIR) spectra of entire samples that were from the same pedogenetic soil horizon, but different in mineral composition and texture (i.e., glacial till versus loess). Spectra of incinerated samples were subtracted from the original spectra. Transmission FTIR and DRIFT spectra were almost identical for entire soil samples. However, the DRIFT spectra were affected by the bulk mode bands (i.e., wavenumbers 2000 to 1700 cm-1) that affected spectral resolution and reproducibility. The ratios between C-H and C=O band intensities as indicator for OM quality obtained with DRIFT were smaller than those obtained from transmission FTIR. A spectral subtraction procedure was found to reduce effects of mineral absorption bands on DRIFT spectra allowing an improved interpretation. DRIFT spectroscopy as a non-destructive method for analyzing OM composition at intact surfaces in structured soils could be calibrated with information obtained with the more detailed transmission FTIR and complementary methods.

  7. Evaluating the New Automatic Method for the Analysis of Absorption Spectra Using Synthetic Spectra

    Directory of Open Access Journals (Sweden)

    Matthew B. Bainbridge


    Full Text Available We recently presented a new “artificial intelligence” method for the analysis of high-resolution absorption spectra (Bainbridge and Webb, Mon. Not. R. Astron. Soc. 2017, doi:10.1093/mnras/stx179. This new method unifies three established numerical methods: a genetic algorithm (GVPFIT; non-linear least-squares optimisation with parameter constraints (VPFIT; and Bayesian Model Averaging (BMA. In this work, we investigate the performance of GVPFIT and BMA over a broad range of velocity structures using synthetic spectra. We found that this new method recovers the velocity structures of the absorption systems and accurately estimates variation in the fine structure constant. Studies such as this one are required to evaluate this new method before it can be applied to the analysis of large sets of absorption spectra. This is the first time that a sample of synthetic spectra has been utilised to investigate the analysis of absorption spectra. Probing the variation of nature’s fundamental constants (such as the fine structure constant, through the analysis of absorption spectra, is one of the most direct ways of testing the universality of physical laws. This “artificial intelligence” method provides a way to avoid the main limiting factor, i.e., human interaction, in the analysis of absorption spectra.

  8. Analysis of K-net and Kik-net data: implications for ground motion prediction - acceleration time histories, response spectra and nonlinear site response; Analyse des donnees accelerometriques de K-net et Kik-net: implications pour la prediction du mouvement sismique - accelerogrammes et spectres de reponse - et la prise en compte des effets de site non-lineaire

    Energy Technology Data Exchange (ETDEWEB)

    Pousse, G


    This thesis intends to characterize ground motion during earthquake. This work is based on two Japanese networks. It deals with databases of shallow events, depth less than 25 km, with magnitude between 4.0 and 7.3. The analysis of K-net allows to compute a spectral ground motion prediction equation and to review the shape of the Eurocode 8 design spectra. We show the larger amplification at short period for Japanese data and bring in light the soil amplification that takes place at large period. In addition, we develop a new empirical model for simulating synthetic stochastic nonstationary acceleration time histories. By specifying magnitude, distance and site effect, this model allows to produce many time histories, that a seismic event is liable to produce at the place of interest. Furthermore, the study of near-field borehole records of the Kik-net allows to explore the validity domain of predictive equations and to explain what occurs by extrapolating ground motion predictions. Finally, we show that nonlinearity reduces the dispersion of ground motion at the surface. (author)

  9. Measurement of Neutron Energy Spectra behind Shielding of a 120 GeV/c Hadron Facility

    Energy Technology Data Exchange (ETDEWEB)

    Nakao, N.; Rokni, S.H.; Vincke, H.; Khater, Hesham; Prinz, A.A.; /SLAC; Taniguchi, S.; /JAERI-RIKEN, Hyogo; Roesler, S.; Brugger, M.; /CERN; Hagiwara, Masayuki; /Tohoku U.


    Neutron energy spectra were measured behind the lateral shield of the CERF (CERN-EU High Energy Reference Field) facility at CERN with a 120 GeV/c positive hadron beam (mainly a mixture of protons and pions) on a cylindrical copper target (7-cm diameter by 50-cm long). NE213 organic liquid scintillator (12.7-cm diameter by 12.7-cm long) was located at various longitudinal positions behind shields of 80- and 160-cm thick concrete and 40-cm thick iron. Neutron energy spectra in the energy range between 12 MeV and 380 MeV were obtained by unfolding the measured pulse height spectra with the detector response functions which have been experimentally verified in the neutron energy range up to 380 MeV in separate experiments. The corresponding MARS15 Monte Carlo simulations generally gave good agreements with the experimental energy spectra.

  10. Identifying leaf traits that signal stress in TIR spectra (United States)

    Buitrago Acevedo, Maria F.; Groen, Thomas A.; Hecker, Christoph A.; Skidmore, Andrew K.


    Plants under constant water and temperature stress experience a chain of reactions that in the long term alter their leaf traits (morphology, anatomy and chemistry). The use of these traits as proxies for assessing plant stress was so far mainly based on conventional laboratory methods, which are expensive and time-consuming. Remote sensing methods based on spectral changes can detect changes in pigments and productivity using the visible and near infrared. However, the use of infrared spectra, where changes in the spectra are associated with physical changes of the leaf, is still incipient. In this study plants of Rhododendron cf. catawbiense, were exposed to low temperatures and low soil water content during a six months experiment. The spectral response in the infrared region 1.4-16 μm, microstructural variables, leaf water content, leaf area and leaf molecules such as lignin and cellulose concentrations were measured in individual leaves after the period of stress. This study revealed that under cold conditions plants have most changes in leaf water content, lignin and cellulose concentrations and leaf area, while under drought conditions the most striking change is water loss. These leaf trait modifications are also correlated with changes in thermal infrared spectra, showing their potential as proxies for detecting plant stress in this species. A multinomial model allows the estimation of the stress treatments imposed on these plants from their infrared spectra. This model reveals a group of 15 bands in the SWIR and MWIR between 2.23 and 7.77 μm, which show relatively large changes, and had an overall accuracy of 87%. Finally, individual partial least squares regression models show that lignin, cellulose, leaf water content and leaf area are the leaf traits reacting significantly to long-term stress and that are also generating measurable changes in the infrared spectra. Although these models are based on laboratory data, the congruence of the identified

  11. Enhancing metabolomic data analysis with Progressive Consensus Alignment of NMR Spectra (PCANS

    Directory of Open Access Journals (Sweden)

    O'Connell Thomas M


    Full Text Available Abstract Background Nuclear magnetic resonance spectroscopy is one of the primary tools in metabolomics analyses, where it is used to track and quantify changes in metabolite concentrations or profiles in response to perturbation through disease, toxicants or drugs. The spectra generated through such analyses are typically confounded by noise of various types, obscuring the signals and hindering downstream statistical analysis. Such issues are becoming increasingly significant as greater numbers of large-scale systems or longitudinal studies are being performed, in which many spectra from different conditions need to be compared simultaneously. Results We describe a novel approach, termed Progressive Consensus Alignment of Nmr Spectra (PCANS, for the alignment of NMR spectra. Through the progressive integration of many pairwise comparisons, this approach generates a single consensus spectrum as an output that is then used to adjust the chemical shift positions of the peaks from the original input spectra to their final aligned positions. We characterize the performance of PCANS by aligning simulated NMR spectra, which have been provided with user-defined amounts of chemical shift variation as well as inter-group differences as would be observed in control-treatment applications. Moreover, we demonstrate how our method provides better performance than either template-based alignment or binning. Finally, we further evaluate this approach in the alignment of real mouse urine spectra and demonstrate its ability to improve downstream PCA and PLS analyses. Conclusions By avoiding the use of a template or reference spectrum, PCANS allows for the creation of a consensus spectrum that enhances the signals within the spectra while maintaining sample-specific features. This approach is of greatest benefit when complex samples are being analyzed and where it is expected that there will be spectral features unique and/or strongly different between subgroups

  12. Gamma-ray Spectra of Starburst Galaxies (United States)

    Moncada, Roberto Jose; Paglione, Timothy


    Starburst galaxies offer a unique window into the nature of star formation, its driving forces, and the energetic interactions within the galaxy. Their supernovae enrich the surrounding environment with cosmic rays that interact with the interstellar medium and galactic magnetic fields producing gamma-rays and non-thermal radio emission. We generated gamma-ray spectra for the 7 brightest starburst galaxies using 8.6 years of Pass 8 Large Area Telescope (LAT) data from the Fermi Gamma-ray Space Telescope. In addition to new detections, we will report on the results of simultaneously modeling the gamma-ray and radio spectra. These results confirm prior studies favoring high magnetic field strengths in the starburst regions.

  13. Strategies for Interpreting Two Dimensional Microwave Spectra (United States)

    Martin-Drumel, Marie-Aline; Crabtree, Kyle N.; Buchanan, Zachary


    Microwave spectroscopy can uniquely identify molecules because their rotational energy levels are sensitive to the three principal moments of inertia. However, a priori predictions of a molecule's structure have traditionally been required to enable efficient assignment of the rotational spectrum. Recently, automated microwave double resonance spectroscopy (AMDOR) has been employed to rapidly generate two dimensional spectra based on transitions that share a common rotational level, which may enable automated extraction of rotational constants without any prior estimates of molecular structure. Algorithms used to date for AMDOR have relied on making several initial assumptions about the nature of a subset of the linked transitions, followed by testing possible assignments by "brute force." In this talk, we will discuss new strategies for interpreting AMDOR spectra, using eugenol as a test case, as well as prospects for library-free, automated identification of the molecules in a volatile mixture.

  14. Cathodoluminescence spectra of gallium nitride nanorods. (United States)

    Tsai, Chia-Chang; Li, Guan-Hua; Lin, Yuan-Ting; Chang, Ching-Wen; Wadekar, Paritosh; Chen, Quark Yung-Sung; Rigutti, Lorenzo; Tchernycheva, Maria; Julien, François Henri; Tu, Li-Wei


    Gallium nitride [GaN] nanorods grown on a Si(111) substrate at 720°C via plasma-assisted molecular beam epitaxy were studied by field-emission electron microscopy and cathodoluminescence [CL]. The surface topography and optical properties of the GaN nanorod cluster and single GaN nanorod were measured and discussed. The defect-related CL spectra of GaN nanorods and their dependence on temperature were investigated. The CL spectra along the length of the individual GaN nanorod were also studied. The results reveal that the 3.2-eV peak comes from the structural defect at the interface between the GaN nanorod and Si substrate. The surface state emission of the single GaN nanorod is stronger as the diameter of the GaN nanorod becomes smaller due to an increased surface-to-volume ratio.

  15. The New NIST Atomic Spectra Database (United States)

    Kelleher, D. E.; Martin, W. C.; Wiese, W. L.; Sugar, J.; Fuhr, J. R.; Olsen, K.; Musgrove, A.; Mohr, P. J.; Reader, J.; Dalton, G. R.

    The new Atomic Spectra Database (ASD), Version 2.0, of the National Institute of Standards and Technology (NIST) contains significantly more data and covers a wider range of atomic and ionic transitions and energy levels than earlier versions. All data are integrated. It also has a new user interface and search engine. ASD contains spectral reference data which have been critically evaluated and compiled by NIST. Version 2.0 contains data on 900 spectra, with about 70000 energy levels and 91000 lines ranging from about 1 Ångström to 200 micrometers, roughly half of which have transition probabilities with estimated uncertainties. References to the NIST compilations and original data sources are listed in the ASD bibliography. A detailed “Help” file serves as a user's manual, and full search and filter capabilities are provided.

  16. Polarization in astronomical spectra - Theoretical evidence (United States)

    Fymat, A. L.


    Theoretical evidence for the existence and behavior of polarization in astronomical spectra is provided. The theory for the study of spectral multiple scattering of arbitrarily polarized light is first developed, and the detailed and integrated spectropolarimetry of a planetary atmosphere is then studied for cases in which the spectra are formed in the presence of either very small nonspherical particles (Rayleigh-Cabannes scattering) or large polydisperse spherical particles (Mie scattering). It is shown in both cases that polarization is indeed present; it increases with the line strength but decreases afterwards as the line becomes very strong and tends to saturation. A polarization reversal is also predicted during latitudinal (pole-to-equator) scan and possibly also during longitudinal (terminator-to-limb) scan of the planet. The reversal happened at all phase angles considered. Our companion article (Forbes and Fymat) will provide observational substantiation to these theoretical predictions.

  17. Dynamical analysis of highly excited molecular spectra

    Energy Technology Data Exchange (ETDEWEB)

    Kellman, M.E. [Univ. of Oregon, Eugene (United States)


    The goal of this program is new methods for analysis of spectra and dynamics of highly excited vibrational states of molecules. In these systems, strong mode coupling and anharmonicity give rise to complicated classical dynamics, and make the simple normal modes analysis unsatisfactory. New methods of spectral analysis, pattern recognition, and assignment are sought using techniques of nonlinear dynamics including bifurcation theory, phase space classification, and quantization of phase space structures. The emphasis is chaotic systems and systems with many degrees of freedom.

  18. High Resolution Spectra of HE Detonations (United States)


    region. We shall assume for present purposes that the emissivity of the detonation products of a 50 to 100 lb HE explosion is also in the viciity of... speed . Incorporated in the emulsion layers are dye forming coup- lers which react simultaneously during I , developmentto produce a separate dye S...Best Available Cop 1~EV~ AFTAC-TR-80-24 HIGH RESOLUTION SPECTRA OF HE DETONATIONS HSS Inc 2 Alfred Circle Bedford, MA 01730 7 JULY 1980 AUG 4 9D

  19. Understanding the baryon and meson spectra

    Energy Technology Data Exchange (ETDEWEB)

    Pennington, Michael R. [JLAB


    A brief overview is given of what we know of the baryon and meson spectra, with a focus on what are the key internal degrees of freedom and how these relate to strong coupling QCD. The challenges, experimental, theoretical and phenomenological, for the future are outlined, with particular reference to a program at Jefferson Lab to extract hadronic states in which glue unambiguously contributes to their quantum numbers.

  20. Molecular Dynamics and Spectra. II. Diatomic Raman. (United States)


    a degeneracy factor g is introduced which depends on the symmetry of the molecule For our IT- homonuclear diatomic, z is gj, the nuclear spin...classi~a mechanical viewpoint. with some caveats for features In which anharmonicity is important, such as the de- tailed shape of Q branches. it compute the Spectra of coa- plex molecular systems, for example of large molecules , clusters, liquids, solutions, and solids. Second, this

  1. Janus spectra in two-dimensional flows

    CERN Document Server

    Liu, Chien-Chia; Chakraborty, Pinaki


    In theory, large-scale atmospheric flows, soap-film flows and other two-dimensional flows may host two distinct types of turbulent energy spectra---in one, $\\alpha$, the spectral exponent of velocity fluctuations, equals $3$ and the fluctuations are dissipated at the small scales, and in the other, $\\alpha=5/3$ and the fluctuations are dissipated at the large scales---but measurements downstream of obstacles have invariably revealed $\\alpha = 3$. Here we report experiments on soap-film flows where downstream of obstacles there exists a sizable interval in which $\\alpha$ has transitioned from $3$ to $5/3$ for the streamwise fluctuations but remains equal to $3$ for the transverse fluctuations, as if two mutually independent turbulent fields of disparate dynamics were concurrently active within the flow. This species of turbulent energy spectra, which we term the Janus spectra, has never been observed or predicted theoretically. Our results may open up new vistas in the study of turbulence and geophysical flows...

  2. Analysis of positron lifetime spectra in polymers (United States)

    Singh, Jag J.; Mall, Gerald H.; Sprinkle, Danny R.


    A new procedure for analyzing multicomponent positron lifetime spectra in polymers was developed. It requires initial estimates of the lifetimes and the intensities of various components, which are readily obtainable by a standard spectrum stripping process. These initial estimates, after convolution with the timing system resolution function, are then used as the inputs for a nonlinear least squares analysis to compute the estimates that conform to a global error minimization criterion. The convolution integral uses the full experimental resolution function, in contrast to the previous studies where analytical approximations of it were utilized. These concepts were incorporated into a generalized Computer Program for Analyzing Positron Lifetime Spectra (PAPLS) in polymers. Its validity was tested using several artificially generated data sets. These data sets were also analyzed using the widely used POSITRONFIT program. In almost all cases, the PAPLS program gives closer fit to the input values. The new procedure was applied to the analysis of several lifetime spectra measured in metal ion containing Epon-828 samples. The results are described.

  3. The ultraviolet spectra of the Jovian aurora

    Energy Technology Data Exchange (ETDEWEB)

    Liu, W.; Dalgarno, A. [Harvard-Smithsonian Center for Astrophysics, 60 Garden Street, Cambridge, Massachusetts 02138 (United States)


    The ultraviolet spectra of molecular hydrogen H{sub 2} due to electron impact excitation are calculated and compared with the high-resolution (0.56 A) spectra of the Jovian aurora obtained with the {ital Hubble} {ital Space} {ital Telescope} Goddard High-Resolution Spectrograph. All the observed features are reproduced by electron impact excitation emissions of H{sub 2}, and the predicted intensities agree well with the observed intensities. Accurate molecular parameters are used, and effects of secondary electrons are included. The auroral emissions are reproduced by energetic electron impact excitation of H{sub 2} with a temperature of 400{endash}600 K. Large temperature gradients occur with respect to altitude within the auroral emission regions. The auroral spectra contain a cascade contribution to the Lyman band emission from high-lying {ital E} and {ital F} states that are populated by the low-energy secondary electrons produced as the energetic auroral electrons slow down. {copyright} {ital 1996 The American Astronomical Society.}

  4. Two-dimensional second-order nonlinear optical spectra: landscape of second-order nonlinear optics. (United States)

    Chen, Jiu; Wang, Ming Qian; Zhou, Xin; Yang, Ling; Li, Wei-Qi; Tian, Wei Quan


    The landscape of second-order nonlinear optical (2nd NLO) responses of a system can be depicted as two-dimensional second-order nonlinear optical spectra in a range of external fields, and this is difficult to be realized in experiment for a wide range of external fields. In the present study, an efficient method for application of sum-over-states model to simulate electronic two-dimensional NLO (2DNLO) spectra has been developed, and techniques to analyze NLO response-structure correlation have been proposed. This 2DNLO method has been applied to simulate the 2DNLO spectra of a series of typical electron push-pull chromophores under external fields of up to 5.00 eV. The correlation between the NLO properties and structure has been disclosed, and a further strategy to enhance the NLO properties of push-pull chromophores has been proposed.

  5. Spectra-structure correlations from the infrared spectra of some transition metal complexes of 8-hydroxyquinoline (United States)

    Engelter, Carola; Jackson, Graham E.; Knight, Cheryl L.; Thornton, David A.


    The IR spectra of twenty-one transition metal complexes of 8-hydroxyquinoline over the range 700-50 cm -1 are discussed in relation to their known or inferred structures. The complexes are of three types: (a) the bis(aquo) complexes of the 3 d metal(II) ions trans-[M(ox) 2(H 2O) 2] (M = Mn, Fe, Co, Ni, Cu, Zn); (b) the corresponding anhydrous complexes, [M(ox) 2] (M = Mn, Co, Ni, Cu, Zn); and (c) the complexes of the metal(III) ions, [M(ox) 3] (M = Sc, V, Cr, Mn, Fe, Co, Ga). 8-Hydroxyquinoline- d7 has been synthesized and used to assist in the metal-ligand assignments which are further based on 64,68Zn labelling of the bis(aquo) zinc complex and on the effects of metal ion substitution in relation to expectations based on crystal field theory. The effects of Jahn-Teller distortion on the spectra of the complexes of Cu(II) and Mn(III) are discussed. The spectra of the bis(aquo) adducts support the previously proposed trans-octahedral structure. The spectra of the anhydrous complexes are consistent with tetrahedral Mn, Ni and Zn but suggest that the Co complex has polymeric octahedral coordination rather than the previously-proposed tetrahedral structure. The six-coordinate α-Cu complex and five-coordinate β-Cu complex exhibit distinctive differences in their spectra which support the elongated axial Cu-O bonds observed in crystal structure determinations. The spectra of the metal(III) tris(oxinates) are consistent with the facial ( cis-cis) coordination previously proposed. The spectra of these complexes are discussed in relation to bonding considerations based on crystal field theory.

  6. Modeling of uncertain spectra through stochastic autoregressive systems (United States)

    Wang, Yiwei; Wang, X. Q.; Mignolet, Marc P.; Yang, Shuchi; Chen, P. C.


    The focus of this investigation is on the formulation and validation of a modeling strategy of the uncertainty that may exist on the specification of the power spectral density of scalar stationary processes and on the spectral matrices of vector ones. These processes may, for example, be forces on a structure originating from natural phenomena which are coarsely modeled (i.e., with epistemic uncertainty) or are specified by parameters unknown (i.e., with aleatoric uncertainty) in the application considered. The propagation of the uncertainty, e.g., to the response of the structure, may be carried out provided that a stochastic model of the uncertainty in the power spectral density/matrix is available from which admissible samples can be efficiently generated. Such a stochastic model will be developed here through an autoregressive-based parameterization of the specified baseline power spectral density/matrix and of its random samples. Autoregressive (AR) models are particularly well suited for this parametrization since their spectra are known to converge to a broad class of spectra (all non-pathological spectra) as the AR order increases. Note that the characterization of these models is not achieved directly in terms of their coefficients but rather in terms of their reflection coefficients which lie (or their eigenvalues in the vector process case) in the domain [0,1) as a necessary and sufficient condition for stability. Maximum entropy concepts are then employed to formulate the distribution of the reflection coefficients in both scalar and vector process case leading to a small set of hyperparameters of the uncertain model. Depending on the information available, these hyperparameters could either be varied in a parametric study format to assess the effects of uncertainty or could be identified, e.g., in a maximum likelihood format, from observed data. The validation and assessment of these concepts is finally achieved on several examples including the

  7. Measurements of {sup 237}Np secondary neutron spectra

    Energy Technology Data Exchange (ETDEWEB)

    Kornilov, N.V.


    The activities carried out during the first year of the project are summarized. The main problems for Np spectra measurements arise from high intrinsic gamma-ray activity of the sample and admixture of the oxygen and iron nuclei. The inelastically scattered neutrons and the fission neutrons spectra for {sup 237}Np were measured by time-of-flight spectrometer of the IPPE at incident neutron energies {approx_equal}1.5 MeV, and {approx_equal}0.5 MeV. A solid tritium target and a Li-metallic target were used as neutron sources. The neutron scattering on C sample (C(n,n) standard reaction) was measured to normalize the Np data. The experimental data should be simulated by Monte Carlo method to correct the experimental data for oxygen and iron admixture as well as for multiple scattering of the neutrons in the sample. Therefore the response function of the spectrometer, and the neutron energy distribution from the source were investigated in detail. (author)

  8. Studies of photon spectra from a thallium-204 foil source as an aid to dosimetry and shielding

    CERN Document Server

    Francis, T M


    Beta ray foil sources incorporating nuclides such as thallium-204, promethium-147 and strontium-90 plus yttrium-90 ar increasingly used in industrial devices such as thickness gauges. These sources are so constructed that they give rise to complex photon spectra containing low energy Bremsstrahlung and X-rays characteristic of the constructional materials. The energy response of practical monitoring instruments is such that they are likely to underestimate the dose due to such spectra unless they are calibrated using appropriate spectra. This report describes a series of measurements carried out on a commercially available thallium-204 foil source and five commonly used shielding materials. The measurements made with a NaI(T1) spectrometer have been corrected for instrumental distortions to obtain the photon spectra in air. These spectra are presented and have been used to compute dose in air with the help of published data on mass energy-absorption coefficients. Also included in the report are data derived f...

  9. Classification of specialty seed meals from NIR reflectance spectra (United States)

    Near infrared reflectance spectroscopy was used to identify alternative seed meals proposed for food and feed formulations. Spectra were collected from cold pressed Camelina (Camelina sativa), Coriander (Coriandrum sativum), and Pennycress (Thlaspi arvense) meals. Additional spectra were collected ...

  10. Evaluation of secondary and prompt fission neutron spectra

    Energy Technology Data Exchange (ETDEWEB)

    Porodzinskij, Yu.V.; Sukhovitskij, E.Sh. [Radiation Physics and Chemistry Problems Inst., Minsk-Sosny (Belarus)


    A simple model allowing to split neutron emission spectra into reaction partials is suggested. Predicted spectra of (n,n`{gamma}), (n,n`f), etc appear to be much harder than usually evaluated. (author)

  11. Photon and photoneutron spectra produced in radiotherapy Linacs

    Energy Technology Data Exchange (ETDEWEB)

    Vega C, H. R. [Universidad Autonoma de Zacatecas, Unidad Academica de Estudios Nucleares, Calle Cipres No. 10, Fracc. La Penuela, 98068 Zacatecas (Mexico); Martinez O, S. A. [Universidad Pedagogica y Tecnologica de Colombia, Grupo de Fisica Nuclear Aplicada y Simulacion, Av. Central del Norte Km. 1, Via Paipa Tunja, Boyaca (Colombia); Benites R, J. L. [Universidad Autonoma de Nayarit, Postgrado CBAP, Carretera Tepic Compostela Km. 9, Xalisco, Nayarit (Mexico); Lallena, A. M., E-mail: [Universida de Granada, Departamento de Fisica Atomica, Molecular y Nuclear, E-18071 Granada (Spain)


    A Monte Carlo calculation, using the MCNPX code, was carried out in order to estimate the photon and neutron spectra in two locations of two linacs operating at 15 and 18 MV. Detailed models of both linac heads were used in the calculations. Spectra were estimated below the flattening filter and at the isocenter. Neutron spectra show two components due to evaporation and knock-on neutrons. Lethargy spectra under the filter were compared to the spectra calculated from the function quoted by Tosi et al. that describes reasonably well neutron spectra beyond 1 MeV, though tends to underestimate the energy region between 10{sup -6} and 1 MeV. Neutron and Bremsstrahlung spectra show the same features regardless of the linac voltage. The amount of photons and neutrons produced by the 15 MV linac is smaller than that found for the 18 MV linac. As expected, Bremsstrahlung spectra ends according to the voltage used to accelerate the electrons. (Author)

  12. GADRAS Detector Response Function.

    Energy Technology Data Exchange (ETDEWEB)

    Mitchell, Dean J.; Harding, Lee; Thoreson, Gregory G; Horne, Steven M.


    The Gamma Detector Response and Analysis Software (GADRAS) applies a Detector Response Function (DRF) to compute the output of gamma-ray and neutron detectors when they are exposed to radiation sources. The DRF is fundamental to the ability to perform forward calculations (i.e., computation of the response of a detector to a known source), as well as the ability to analyze spectra to deduce the types and quantities of radioactive material to which the detectors are exposed. This document describes how gamma-ray spectra are computed and the significance of response function parameters that define characteristics of particular detectors.

  13. LOFAR imaging of Cygnus A - direct detection of a turnover in the hotspot radio spectra

    NARCIS (Netherlands)

    McKean, J.P.; Godfrey, L.E.H.; Vegetti, S.; Wise, M.W.; Morganti, R.; Bentum, Marinus Jan; Hardcastle, M.J.; Rafferty, D.; Anderson, J.; Avruch, I.M.; Beck, R.; Bell, M.E.; van Bemmel, I.; Bernardi, G.


    The low-frequency radio spectra of the hotspots within powerful radio galaxies can provide valuable information about the physical processes operating at the site of the jet termination. These processes are responsible for the dissipation of jet kinetic energy, particle acceleration, and

  14. QSFIT: automatic analysis of optical AGN spectra (United States)

    Calderone, G.; Nicastro, L.; Ghisellini, G.; Dotti, M.; Sbarrato, T.; Shankar, F.; Colpi, M.


    We present QSFIT (Quasar Spectral Fitting package), a new software package to automatically perform the analysis of active galactic nuclei (AGNs) optical spectra. The software provides luminosity estimates for the AGN continuum, the Balmer continuum, both optical and ultraviolet iron blended complex, host galaxy and emission lines, as well as width, velocity offset and equivalent width of 20 emission lines. Improving on a number of previous studies on AGN spectral analysis, QSFIT fits all the components simultaneously, using an AGN continuum model which extends over the entire available spectrum, and is thus a probe of the actual AGN continuum whose estimates are scarcely influenced by localized features (e.g. emission lines) in the spectrum. We used QSFIT to analyse 71 251 optical spectra of Type 1 AGN at z < 2 (obtained by the Sloan Digital Sky Survey, SDSS) and to produce a publicly available catalogue of AGN spectral properties. Such catalogue allowed us (for the first time) to estimate the AGN continuum slope and the Balmer continuum luminosity on a very large sample, and to show that there is no evident correlation between these quantities the redshift. All data in the catalogue, the plots with best-fitting model and residuals, and the IDL code we used to perform the analysis, are available on a dedicated website. The whole fitting process is customizable for specific needs, and can be extended to analyse spectra from other data sources. The ultimate purpose of QSFIT is to allow astronomers to run standardized recipes to analyse the AGN data, in a simple, replicable and shareable way.

  15. Characterizing Sky Spectra Using SDSS BOSS Data (United States)

    Florez, Lina Maria; Strauss, Michael A.


    In the optical/near-infrared spectra gathered by a ground-based telescope observing very faint sources, the strengths of the emission lines due to the Earth’s atmosphere can be many times larger than the fluxes of the sources we are interested in. Thus the limiting factor in faint-object spectroscopy is the degree to which systematics in the sky subtraction can be minimized. Longwards of 6000 Angstroms, the night-sky spectrum is dominated by multiple vibrational/rotational transitions of the OH radical from our upper atmosphere. While the wavelengths of these lines are the same in each sky spectrum, their relative strengths vary considerably as a function of time and position on the sky. The better we can model their strengths, the better we can hope to subtract them off. We expect that the strength of lines from common upper energy levels will be correlated with one another. We used flux-calibrated sky spectra from the Sloan Digital Sky Survey Baryon Oscillation Spectroscopic Survey (SDSS BOSS) to explore these correlations. Our aim is to use these correlations for creating improved sky subtraction algorithms for the Prime Focus Spectrograph (PFS) on the 8.2-meter Subaru Telescope. When PFS starts gathering data in 2019, it will be the most powerful multi-object spectrograph in the world. Since PFS will be gathering data on sources as faint as 24th magnitude and fainter, it's of upmost importance to be able to accurately measure and subtract sky spectra from the data that we receive.

  16. The spectra and dynamics of diatomic molecules

    CERN Document Server

    Lefebvre-Brion, Helene


    This book is written for graduate students just beginning research, for theorists curious about what experimentalists actually can and do measure, and for experimentalists bewildered by theory. It is a guide for potential users of spectroscopic data, and uses language and concepts that bridge the frequency-and time-domain spectroscopic communities. Key topics, concepts, and techniques include: the assignment of simple spectra, basic experimental techniques, definition of Born-Oppenheimer and angular momentum basis sets and the associated spectroscopic energy level patterns (Hund's ca

  17. Spaces of orderings and abstract real spectra

    CERN Document Server

    Marshall, Murray A


    This book is of interest to students as well as experts in the area of real algebraic geometry, quadratic forms, orderings, valuations, lattice ordered groups and rings, and in model theory. The original motivation comes from orderings on fields and commutative rings. This is explained as is the important application to minimal generation of semi-algebraic sets. Many results in the new theory of abstract real spectra (also called spaces of signs) appear here for the first time. The reader needs elementary knowledge of commutative rings, ordered fields and real closed fields and valuations.

  18. Interactive computer analysis of nuclear backscattering spectra (United States)

    Saunders, Philip A.; Ziegler, J. F.


    A review will be made of a computer-based interactive nuclear backscattering analysis system. Users without computer experience can develop moderate competence with the system after only brief instruction because of the menu-driven organization. Publishable quality figures can be obtained without any computer expertise. Among the quantities which can be displayed over the data are depth scales for any element, element identification, relative concentrations and theoretical spectra. Captions and titling can made from a selection of 30 font styles. Lettering is put on the graphs under joy-stick control such that placement is exact without needing complicated commands.

  19. Beamstrahlung spectra in next generation linear colliders

    Energy Technology Data Exchange (ETDEWEB)

    Barklow, T.; Chen, P. (Stanford Linear Accelerator Center, Menlo Park, CA (United States)); Kozanecki, W. (DAPNIA-SPP, CEN-Saclay (France))


    For the next generation of linear colliders, the energy loss due to beamstrahlung during the collision of the e{sup +}e{sup {minus}} beams is expected to substantially influence the effective center-of-mass energy distribution of the colliding particles. In this paper, we first derive analytical formulae for the electron and photon energy spectra under multiple beamstrahlung processes, and for the e{sup +}e{sup {minus}} and {gamma}{gamma} differential luminosities. We then apply our formulation to various classes of 500 GeV e{sup +}e{sup {minus}} linear collider designs currently under study.

  20. Interpreting peptide mass spectra by VEMS

    DEFF Research Database (Denmark)

    Mathiesen, Rune; Lundsgaard, M.; Welinder, Karen G.


    of peptide MS/MS spectra imported in text file format. Peaks are annotated, the monoisotopic peaks retained, and the b-and y-ion series identified in an interactive manner. The called peptide sequence is searched against a local protein database for sequence identity and peptide mass. The report compares...... the calculated and the experimental mass spectrum of the called peptide. The program package includes four accessory programs. VEMStrans creates protein databases in FASTA format from EST or cDNA sequence files. VEMSdata creates a virtual peptide database from FASTA files. VEMSdist displays the distribution...

  1. Quark Spectra, Topology, and Random Matrix Theory

    Energy Technology Data Exchange (ETDEWEB)

    Edwards, R.G.; Heller, U.M. [SCRI, Florida State University, Tallahassee, Florida 32306-4130 (United States); Kiskis, J. [Department of Physics, University of California, Davis, California 95616 (United States); Narayanan, R. [Department of Physics, Building 510A, Brookhaven National Laboratory, P.O. Box 5000, Upton, New York 11973 (United States)


    Quark spectra in QCD are linked to fundamental properties of the theory including the identification of pions as the Goldstone bosons of spontaneously broken chiral symmetry. The lattice overlap Dirac operator provides a nonperturbative, ultraviolet-regularized description of quarks with the correct chiral symmetry. Properties of the spectrum of this operator and their relation to random matrix theory are studied here. In particular, the predictions from chiral random matrix theory in topologically nontrivial gauge field sectors are tested for the first time. {copyright} {ital 1999} {ital The American Physical Society}

  2. Boundary layer heights derived from velocity spectra

    Energy Technology Data Exchange (ETDEWEB)

    Hoejstrup, J.; Barthelmie, R.J. [Risoe National Lab., Roskilde (Denmark); Kaellstrand, B. [Univ. of Uppsala, Uppsala (Sweden)


    It is a well-known fact that the height of the mixed layer determines the size of the largest and most energetic eddies that can be observed in the unstable boundary layer, and consequently a peak can be observed in the power spectra of the along-wind velocity component at scales comparable to the mixed layer depth. We will now show how the mixed layer depth can be derived from the u-specta and the results will be compared with direct measurements using pibal and tethersonde measurements. (au)

  3. Symmetry in bonding and spectra an introduction

    CERN Document Server

    Douglas, Bodie E


    Many courses dealing with the material in this text are called ""Applications of Group Theory."" Emphasizing the central role and primary importance of symmetry in the applications, Symmetry in Bonding and Spectra enables students to handle applications, particularly applications to chemical bonding and spectroscopy. It contains the essential background in vectors and matrices for the applications, along with concise reviews of simple molecular orbital theory, ligand field theory, and treatments of molecular shapes, as well as some quantum mechanics. Solved examples in the text illustra

  4. Conductance Spectra in Graphene-Superconductor Junctions (United States)

    Tian, Jie; Zhou, Shi-Ping; Deng, Zhen-Yan


    The conductance spectra of a graphene ribbon and graphene-superconductor (G-S) junctions are investigated, using the tight-binding model and non-equilibrium Green' function formalism. It is found that the quantized conductance related to graphene' edge-states is robust against perturbations in the model parameters for a graphene monolayer ribbon with the zigzag boundary. With appropriate model parameter of the spin-orbit interaction strength, a new bound state with odd-frequency symmetry is found in the G-S junction. An enhancement in the zero-energy conductance amplitude is followed.

  5. Removing The Instrument Function From Fluorescence Spectra (United States)

    Childs, Andrew F.


    The spectrum acquired at the sample phototnultiplier tube of a fluorescence spectrophotometer is a product of the sample spectrum and the instrument function. The determination of the instrument function and its removal from the acquired spectrum is often critical to the accurate determination of the physical properties of the sample. Methods are discussed for the determination and removal of the instrument function from excitation and emission spectra. Methods considered include quantum counters and ratio circuits for excitation correction, and emission correction against calibrated excitation systems, calibrated tungsten lamps, and NBS standard quinine sulfate.

  6. Wave spectra of strongly coupled magnetized plasmas (United States)

    Kaehlert, Hanno; Reynolds, Alexi; Ott, Torben; Bonitz, Michael


    Results are presented for the wave propagation in a strongly coupled, magnetized one-component plasma. For different angles of the wave vector with respect to the external magnetic field we discuss the dispersion and polarization based on the quasi-localized charge approximation (QLCA). Further, the results of the QLCA are compared with molecular dynamics simulations, extending previous results for two-dimensional systems, e.g.,. The dependence of the wave spectra on the coupling parameter and the magnetic field strength is examined. Support by the Deutsche Forschungsgemeinschaft via SFB-TR 24 and DAAD via the RISE program is acknowledged.

  7. Measurement of turbulence spectra using scanning pulsed wind lidars

    NARCIS (Netherlands)

    Sathe, A.; Mann, J.


    Turbulent velocity spectra, as measured by a scanning pulsed wind lidar (WindCube), are analyzed. The relationship between ordinary velocity spectra and lidar derived spectra is mathematically very complex, and deployment of the three-dimensional spectral velocity tensor is necessary. The resulting

  8. Publicly Released Prompt Radiation Spectra Suitable for Nuclear Detonation Simulations (United States)


    Publicly Released Prompt Radiation Spectra Suitable for Nuclear Detonation Simulations DISTRIBUTION A. Approved for public release; distribution is...TITLE AND SUBTITLE 5a. CONTRACT NUMBER Publicly Released Prompt Radiation Spectra Suitable for Nuclear Detonation Simulations HDTRA1-14-D...NOTES 14. ABSTRACT This technical report describes unclassified source leakage spectra that can be used to simulate a nuclear device or weapon

  9. Noise spectra in balanced optical detectors based on transimpedance amplifiers (United States)

    Masalov, A. V.; Kuzhamuratov, A.; Lvovsky, A. I.


    We present a thorough theoretical analysis and experimental study of the shot and electronic noise spectra of a balanced optical detector based on an operational amplifier connected in a transimpedance scheme. We identify and quantify the primary parameters responsible for the limitations of the circuit, in particular, the bandwidth and shot-to-electronic noise clearance. We find that the shot noise spectrum can be made consistent with the second-order Butterworth filter, while the electronic noise grows linearly with the second power of the frequency. Good agreement between the theory and experiment is observed; however, the capacitances of the operational amplifier input and the photodiodes appear significantly higher than those specified in manufacturers' datasheets. This observation is confirmed by independent tests.

  10. Components of Program for Analysis of Spectra and Their Testing

    Directory of Open Access Journals (Sweden)

    Ivan Taufer


    Full Text Available The spectral analysis of aqueous solutions of multi-component mixtures is used for identification and distinguishing of individual componentsin the mixture and subsequent determination of protonation constants and absorptivities of differently protonated particles in the solution in steadystate (Meloun and Havel 1985, (Leggett 1985. Apart from that also determined are the distribution diagrams, i.e. concentration proportions ofthe individual components at different pH values. The spectra are measured with various concentrations of the basic components (one or severalpolyvalent weak acids or bases and various pH values within the chosen range of wavelengths. The obtained absorbance response area has to beanalyzed by non-linear regression using specialized algorithms. These algorithms have to meet certain requirements concerning the possibility ofcalculations and the level of outputs. A typical example is the SQUAD(84 program, which was gradually modified and extended, see, e.g., (Melounet al. 1986, (Meloun et al. 2012.

  11. Global ultraviolet spectra derived directly from observations with multichannel radiometers. (United States)

    Fuenzalida, H A


    Some general features of multichannel filter radiometers operating in the UV region of the solar spectrum are reviewed with emphasis on calibration problems that are due to incomplete knowledge of responsivity in the UV-B region. An alternative calibration procedure that is able to generate a full UV spectrum obtained by a constrained inversion method is presented. Accuracy of such spectra is assessed with simulated and with real data. A comparison between customary calibration and an alternative procedure is made in terms of monochromatic UV-B irradiance and CIE dose rate (CIE is the Commission Internationale de l'Eclairage) and indicates that irradiances are estimated within 8% accuracy with solar zenith angles as great as 60 degrees and that dose rates are within 6% for any solar zenith angle. The advantage of having an additional channel in the UV-B region is considered.

  12. Mapping SOC in a river catchment by integrating laboratory spectra wavelength with remote sensing spectra

    DEFF Research Database (Denmark)

    Peng, Yi; Xiong, Xiong; Knadel, Maria

    soil spectral features indicative of SOC from laboratory visible near-infrared reflectance (vis-NlR) spectra and incorporate them with remote sensing (RS) images to improve predictions of top SOC in the Skjem river catchment, Denmark. The secondary objective was to improve prediction results...... by separately calibrating samples from upland and wetland. We hypbthesize that final prediction accuracy is significantly improved by incorporatin1 laboratory vis-NlR images upscaled from point-based spectra to catchment scale and RS data for topsoil SOC spatial modeling....

  13. Lightning spectra at 100,000 fps (United States)

    McHarg, M. G.; Harley, J.; Haaland, R. K.; Edens, H. E.; Stenbaek-Nielsen, H.


    A fundamental understanding of lightning can be inferred from the spectral emissions resulting from the leader and return stroke channel. We examine an event recorded at 00:58:07 on 19 July 2015 at Langmuir Laboratory. We recorded lightning spectra using a 100 line per mm grating in front of a Phantom V2010 camera with an 85mm Nikon lens recording at 100,000 frames per second. Coarse resolution spectra (approximately 5nm resolution) are produced from approximately 400 nm to 800 nm for each frame. Electric field data from the Langmuir Electric Field Array for the 03:19:19 event show 10 V/m changes in the electric field associated with multiple return strokes visible in the spectral data. We used the spectral data to compare temperatures at the top, middle and bottom of the lightning channel. Lightning Mapping Array data at Langmuir for the 00:58:07 event show a complex flash extending 10 km in the East-West plane and 6 km in the North-South plane. The imagery data imply that this is a bolt-from-the-blue event.

  14. Non-yrast quadrupole-octupole spectra

    Directory of Open Access Journals (Sweden)

    Lenske H.


    Full Text Available A model of strongly coupled quadrupole and octupole vibrations and rotations is applied to describe non-yrast alternating-parity sequences in even-even nuclei and split parity-doublet spectra in odd-mass nuclei. In even-even nuclei the yrast alternating-parity sequence includes the ground-state band and the lowest negative-parity levels with odd angular momenta, while the non-yrast sequences include excited β-bands and higher negative-parity levels. In odd-mass nuclei the yrast levels are described as low-energy rotation-vibration modes coupled to the ground single-particle (s.p. state, while the non-yrast parity-doublets are obtained as higher-energy rotation-vibration modes coupled to excited s.p. configurations. We show that the extended model scheme describes the yrast and non-yrast quadrupole-octupole spectra in both even-even and odd-A nuclei. The involvement of the reflection-asymmetric deformed shell model to explain the single-particle motion and the Coriolis interaction in odd nuclei is discussed.

  15. Intrinsic Spectra of Hyperluminous Infrared Galaxies (United States)

    Rieke, George; Hines, Dean


    We will use the low and high spectral resolution capabilities of the IRS aboard SIRTF to obtain high signal-to-noise mid-infrared spectra of a small sample of the most luminous Active Galactic Nuclei, which are characterized by their "warm" far-infrared spectral energy distributions as obtained by IRAS (the so called Hyperluminous Infrared Galaxies or HIGs). The sample consists of both Type 2 and Type 1 AGNs. The Type 1 objects present a relatively unobscured view of the central engine, and also have a polarized (scattered) component that is completely unobscured. The Type 2 objects have Type 1 polarized spectra, but this scattered light is highly extinguished indicating some obscuration even along the line of sight to the scattering region. The sample will allow us to compare the properties of the Type 1s and Type 2s, thus providing a check on the orientation and providing strong constraints on the geometry and internal structure of all four objects.

  16. Vibration spectra of single atomic nanocontacts

    Energy Technology Data Exchange (ETDEWEB)

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


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

  17. Vibrational relaxation beyond the linear damping limit in two-dimensional optical spectra of molecular aggregates (United States)

    Perlík, Václav; Šanda, František


    We present a computational model for the spectra of molecular aggregates with signatures of vibronic progression. Vibronic dynamics is implemented by coupling the dynamics of Frenkel excitons with underdamped vibrations. Vibrational dynamics includes linear damping resulting in the exponential decay and quadratic damping inducing subexponential or power law relaxation and increasing vibrational decoherence as demonstrated on lineshapes of the absorption spectrum. Simulations of the third-order coherent response account for bath reorganization during excitonic transport, which allows us to study the line-shape evolution of cross peaks of 2D spectra.

  18. Representative spectra of the wave resource from real sea wave measurements

    DEFF Research Database (Denmark)

    Lavelle, John; Kofoed, Jens Peter


    When dealing with the estimation of the power production of Wave Energy Converters (WECs), from either physical laboratory or numerical models, or measured data from real sea testing of prototype, an accurate representation of the wave spectra at the target location is important for accurate power...... production estimates. This due to the typically highly frequency-dependent response of the WECs. Depending on the location and other factors, real sea spectral shapes may deviate significantly from standard spectra such as the JONSWAP, often assumed in such estimations. Here, an alternative approach...

  19. Optical coherence tomography with pre-calculated reference spectra (United States)

    Wang, Yi; Chen, Xiaodong; Liang, Haitao; Yu, Daoyin


    The resample of spectra which is essential for high-precision spectral-domain OCT data processing is sophisticated, and its precision is dependent on the method and equipment. In this paper, we proposed an OCT without inverse FFT. A series of reference spectra corresponding to different optical path length difference was used to convolve with spectra gotten by OCT to acquire time-domain tomography instead of inverse FFT, thus eliminating the resample of spectra. The reference spectra were calculated before imaging and corrected with correction spectrum from sample arm to compensate the influence of sample arm. Experiment was done with a mirror as sample and validated our setup.

  20. Energetic Proton Spectra Measured by the Van Allen Probes (United States)

    Summers, Danny; Shi, Run; Engebretson, Mark J.; Oksavik, Kjellmar; Manweiler, Jerry W.; Mitchell, Donald G.


    We test the hypothesis that pitch angle scattering by electromagnetic ion cyclotron (EMIC) waves can limit ring current proton fluxes. For two chosen magnetic storms, during 17-20 March 2013 and 17-20 March 2015, we measure proton energy spectra in the region 3 ≤ L ≤ 6 using the RBSPICE-B instrument on the Van Allen Probes. The most intense proton spectra are observed to occur during the recovery periods of the respective storms. Using proton precipitation data from the POES (NOAA and MetOp) spacecraft, we deduce that EMIC wave action was prevalent at the times and L-shell locations of the most intense proton spectra. We calculate limiting ring current proton energy spectra from recently developed theory. Comparisons between the observed proton energy spectra and the theoretical limiting spectra show reasonable agreement. We conclude that the measurements of the most intense proton spectra are consistent with self-limiting by EMIC wave scattering.

  1. The prediction and measurement of microdosimetric spectra relating to neutron cancer therapy

    CERN Document Server

    Taylor, G C


    The primary aim of this work has been to characterise the beam of the MRC's high energy neutron cancer therapy cyclotron at the Clatterbridge Hospital, Bebington, the Wirral, by measuring a series of microdosimetric spectra for a variety of irradiation conditions. In order to interpret the variation between these spectra, so that the underlying physics of the neutron beam could be determined, it was necessary to identify the most influential factors in the production of microdosimetric responses. Experimental procedures were tested in a series of measurements using 14 and 15 MeV monoenergetic neutrons from the Birmingham Dynamitron; these were instrumental in establishing the rigorous calibration regime necessary for the Clatterbridge measurement programme. The (analytical) predictive code NESLES was used to investigate the effect on microdosimetric spectra of having a low energy neutron component in the primary beam,, and also to highlight the shortcomings of the tissue-equivalent media used in microdosimetr...

  2. In vivo absorption spectra of the two stable states of the Euglena photoreceptor photocycle. (United States)

    Barsanti, Laura; Coltelli, Primo; Evangelista, Valtere; Passarelli, Vincenzo; Frassanito, Anna Maria; Vesentini, Nicoletta; Santoro, Fabrizio; Gualtieri, Paolo


    Euglena gracilis possesses a simple but sophisticated light detecting system, consisting of an eyespot formed by carotenoids globules and a photoreceptor. The photoreceptor of Euglena is characterized by optical bistability, with two stable states. In order to provide important and discriminating information on the series of structural changes that Euglena photoreceptive protein(s) undergoes inside the photoreceptor in response to light, we measured the in vivo absorption spectra of the two stable states A and B of photoreceptor photocycle. Data were collected using two different devices, i.e. a microspectrophotometer and a digital microscope. Our results show that the photocycle and the absorption spectra of the photoreceptor possess strong spectroscopic similarities with a rhodopsin-like protein. Moreover, the analysis of the absorption spectra of the two stable states of the photoreceptor and the absorption spectrum of the eyespot suggests an intriguing hypothesis for the orientation of microalgae toward light.

  3. Modeling degradation in SOEC impedance spectra

    DEFF Research Database (Denmark)

    Jensen, Søren Højgaard; Hauch, Anne; Knibbe, Ruth


    Solid oxide cell (SOC) performance is limited by various processes. One way to investigate these processes is by electrochemical impedance spectroscopy. In order to quantify and characterize the processes, an equivalent circuit can be used to model the SOC impedance spectra (IS). Unfortunately......, the optimal equivalent circuit is often unknown and to complicate matters further, several processes contribute to the SOC impedance - making detailed process characterization difficult. In this work we analyze and model a series of IS measured during steam electrolysis operation of an SOC. During testing......, degradation is only observed in the Ni/YSZ electrode and not in the electrolyte or the LSM/YSZ electrode. A batch fit of the differences between the IS shows that a modified Gerischer element provides a better fit to the Ni/YSZ electrode impedance than the frequently used RQ element - albeit neither...

  4. Workshop to establish databases of carbohydrate spectra

    Energy Technology Data Exchange (ETDEWEB)



    The workshop was organized to formulate guidelines for establishing spectral databases of complex carbohydrates. The databases will enable the scientific community to avoid the great waste of research effort and funds that frequently occurs when carbohydrate chemists are forced to duplicate the structural characterization of previously characterized complex carbohydrates. Chemists waste their effort on repetitive characterizations because in the absence of spectral databases they are unaware they are analyzing a known molecule until they have completely determined its structure. Chemists will be able to avoid much of this wasted effort when the collections of mass and of nuclear magnetic resonance (NMR) spectra initiated at the workshop are subsequently developed into searchable databases. Then scientists only need query the databases with the spectrum or with information defining the spectrum of an unidentified carbohydrate to find out if it has been previously characterized.

  5. Correlating features in the primordial spectra

    CERN Document Server

    Achúcarro, Ana; Palma, Gonzalo A; Patil, Subodh P


    Heavy fields coupled to the inflaton reduce the speed of sound in the effective theory of the adiabatic mode each time the background inflationary trajectory deviates from a geodesic. This can result in features in the primordial spectra. We compute the corresponding bispectrum and show that if a varying speed of sound induces features in the power spectrum, the change in the bispectrum is given by a simple formula involving the change in the power spectrum and its derivatives. In this manner, we provide a uniquely discriminable signature of a varying sound speed for the adiabatic mode during inflation that indicates the influence of heavy fields. We find that features in the bispectrum peak in the equilateral limit and, in particular, in the squeezed limit we find considerable enhancement entirely consistent with the single field consistency relation. From the perspective of the underlying effective theory, our results generalize to a wide variety of inflationary models where features are sourced by the time...

  6. Spectra as windows into exoplanet atmospheres. (United States)

    Burrows, Adam S


    Understanding a planet's atmosphere is a necessary condition for understanding not only the planet itself, but also its formation, structure, evolution, and habitability. This requirement puts a premium on obtaining spectra and developing credible interpretative tools with which to retrieve vital planetary information. However, for exoplanets, these twin goals are far from being realized. In this paper, I provide a personal perspective on exoplanet theory and remote sensing via photometry and low-resolution spectroscopy. Although not a review in any sense, this paper highlights the limitations in our knowledge of compositions, thermal profiles, and the effects of stellar irradiation, focusing on, but not restricted to, transiting giant planets. I suggest that the true function of the recent past of exoplanet atmospheric research has been not to constrain planet properties for all time, but to train a new generation of scientists who, by rapid trial and error, are fast establishing a solid future foundation for a robust science of exoplanets.

  7. Electron spectra from decay of fission products

    Energy Technology Data Exchange (ETDEWEB)

    Dickens, J K


    Electron spectra following decay of individual fission products (72 less than or equal to A less than or equal to 162) are obtained from the nuclear data given in the compilation using a listed and documented computer subroutine. Data are given for more than 500 radionuclides created during or after fission. The data include transition energies, absolute intensities, and shape parameters when known. An average beta-ray energy is given for fission products lacking experimental information on transition energies and intensities. For fission products having partial or incomplete decay information, the available data are utilized to provide best estimates of otherwise unknown decay schemes. This compilation is completely referenced and includes data available in the reviewed literature up to January 1982.

  8. Selective reconstruction of space-time spectra (United States)

    Voronin, E. N.


    The relationship between the active component of mutual resistance and radiation patterns of arbitrary receive-transmit antennas is simplified on the basis of the reciprocity theorem. The simplification does not violate the identity of the relationship, and has a useful application to the correction of the near-field holograms of arbitrary sources with the aim of the selective reconstruction of the space-time spectra of homogeneous or inhomogeneous waves. The version of the relationship obtained can also be extended to acoustic antennas. Numerical simulation results are presented concerning the reconstruction of the radiation pattern of a half-wave dipole on the basis of near-field sounding in a cylindrical shielded chamber.

  9. Measuring spectra using burst-mode LDA (United States)

    Velte, Clara; George, William; Tutkun, Murat; Frohnapfel, Bettina


    The phrase ``burst-mode LDA'' refers to an LDA which operates with at most one particle present in the measuring volume at a time. For the signal to be interpreted correctly to avoid velocity bias, one must apply residence time-weighing to all statistical analysis. In addition, for time-series analysis, even though the randomly arriving particles eliminate aliasing, the self-noise from the random arrivals must be removed or it will dominate the spectra and correlations. A flaw in the earlier theory [1],[2], the goal of which was to provide an unbiased and unaliased spectral estimator from the random samples, is identified and corrected. The new methodology is illustrated using recent experiments in a round jet and a turbulent boundary layer. 1. Buchhave, P. PhD Thesis, SUNY/Buffalo, 1979. 2. George, W.K. Proc. Marseille.-Balt. Dyn. Flow Conf. 1978,757-800.

  10. Parameterization of MARVELS Spectra Using Deep Learning (United States)

    Gilda, Sankalp; Ge, Jian; MARVELS


    Like many large-scale surveys, the Multi-Object APO Radial Velocity Exoplanet Large-area Survey (MARVELS) was designed to operate at a moderate spectral resolution ($\\sim$12,000) for efficiency in observing large samples, which makes the stellar parameterization difficult due to the high degree of blending of spectral features. Two extant solutions to deal with this issue are to utilize spectral synthesis, and to utilize spectral indices [Ghezzi et al. 2014]. While the former is a powerful and tested technique, it can often yield strongly coupled atmospheric parameters, and often requires high spectral resolution (Valenti & Piskunov 1996). The latter, though a promising technique utilizing measurements of equivalent widths of spectral indices, has only been employed with respect to FKG dwarfs and sub-giants and not red-giant branch stars, which constitute ~30% of MARVELS targets. In this work, we tackle this problem using a convolution neural network (CNN). In particular, we train a one-dimensional CNN on appropriately processed PHOENIX synthetic spectra using supervised training to automatically distinguish the features relevant for the determination of each of the three atmospheric parameters – T_eff, log(g), [Fe/H] – and use the knowledge thus gained by the network to parameterize 849 MARVELS giants. When tested on the synthetic spectra themselves, our estimates of the parameters were consistent to within 11 K, .02 dex, and .02 dex (in terms of mean absolute errors), respectively. For MARVELS dwarfs, the accuracies are 80K, .16 dex and .10 dex, respectively.

  11. Spectra and physical properties of Taurid meteoroids (United States)

    Matlovič, Pavol; Tóth, Juraj; Rudawska, Regina; Kornoš, Leonard


    Taurids are an extensive stream of particles produced by comet 2P/Encke, which can be observed mainly in October and November as a series of meteor showers rich in bright fireballs. Several near-Earth asteroids have also been linked with the meteoroid complex, and recently the orbits of two carbonaceous meteorites were proposed to be related to the stream, raising interesting questions about the origin of the complex and the composition of 2P/Encke. Our aim is to investigate the nature and diversity of Taurid meteoroids by studying their spectral, orbital, and physical properties determined from video meteor observations. Here we analyze 33 Taurid meteor spectra captured during the predicted outburst in November 2015 by stations in Slovakia and Chile, including 14 multi-station observations for which the orbital elements, material strength parameters, dynamic pressures, and mineralogical densities were determined. It was found that while orbits of the 2015 Taurids show similarities with several associated asteroids, the obtained spectral and physical characteristics point towards cometary origin with highly heterogeneous content. Observed spectra exhibited large dispersion of iron content and significant Na intensity in all cases. The determined material strengths are typically cometary in the KB classification, while PE criterion is on average close to values characteristic for carbonaceous bodies. The studied meteoroids were found to break up under low dynamic pressures of 0.02-0.10 MPa, and were characterized by low mineralogical densities of 1.3-2.5 g cm-3. The widest spectral classification of Taurid meteors to date is presented.

  12. Curved Radio Spectra of Weak Cluster Shocks (United States)

    Kang, Hyesung; Ryu, Dongsu


    In order to understand certain observed features of arc-like giant radio relics such as the rareness, uniform surface brightness, and curved integrated spectra, we explore a diffusive shock acceleration (DSA) model for radio relics in which a spherical shock impinges on a magnetized cloud containing fossil relativistic electrons. Toward this end, we perform DSA simulations of spherical shocks with the parameters relevant for the Sausage radio relic in cluster CIZA J2242.8+5301, and calculate the ensuing radio synchrotron emission from re-accelerated electrons. Three types of fossil electron populations are considered: a delta-function like population with the shock injection momentum, a power-law distribution, and a power law with an exponential cutoff. The surface brightness profile of the radio-emitting postshock region and the volume-integrated radio spectrum are calculated and compared with observations. We find that the observed width of the Sausage relic can be explained reasonably well by shocks with speed {u}{{s}}˜ 3× {10}3 {km} {{{s}}}-1 and sonic Mach number {M}{{s}}˜ 3. These shocks produce curved radio spectra that steepen gradually over (0.1-10){ν }{br} with a break frequency {ν }{br}˜ 1 GHz if the duration of electron acceleration is ˜60-80 Myr. However, the abrupt increase in the spectral index above ˜1.5 GHz observed in the Sausage relic seems to indicate that additional physical processes, other than radiative losses, operate for electrons with {γ }{{e}}≳ {10}4.


    Energy Technology Data Exchange (ETDEWEB)

    Hu Renyu; Seager, Sara [Department of Earth, Atmospheric and Planetary Sciences, Massachusetts Institute of Technology, Cambridge, MA 02139 (United States); Ehlmann, Bethany L., E-mail: [Division of Geological and Planetary Sciences, California Institute of Technology, Pasadena, CA 91125 (United States)


    We investigate spectra of airless rocky exoplanets with a theoretical framework that self-consistently treats reflection and thermal emission. We find that a silicate surface on an exoplanet is spectroscopically detectable via prominent Si-O features in the thermal emission bands of 7-13 {mu}m and 15-25 {mu}m. The variation of brightness temperature due to the silicate features can be up to 20 K for an airless Earth analog, and the silicate features are wide enough to be distinguished from atmospheric features with relatively high resolution spectra. The surface characterization thus provides a method to unambiguously identify a rocky exoplanet. Furthermore, identification of specific rocky surface types is possible with the planet's reflectance spectrum in near-infrared broad bands. A key parameter to observe is the difference between K-band and J-band geometric albedos (A{sub g}(K) - A{sub g}(J)): A{sub g}(K) - A{sub g}(J) > 0.2 indicates that more than half of the planet's surface has abundant mafic minerals, such as olivine and pyroxene, in other words primary crust from a magma ocean or high-temperature lavas; A{sub g}(K) - A{sub g}(J) < -0.09 indicates that more than half of the planet's surface is covered or partially covered by water ice or hydrated silicates, implying extant or past water on its surface. Also, surface water ice can be specifically distinguished by an H-band geometric albedo lower than the J-band geometric albedo. The surface features can be distinguished from possible atmospheric features with molecule identification of atmospheric species by transmission spectroscopy. We therefore propose that mid-infrared spectroscopy of exoplanets may detect rocky surfaces, and near-infrared spectrophotometry may identify ultramafic surfaces, hydrated surfaces, and water ice.

  14. X-ray spectra for mamography; Espectros de rayos X para mamografia

    Energy Technology Data Exchange (ETDEWEB)

    Vega C, H.R.; Manzanares A, E.; Ramirez G, J.; Hernandez V, R.; Hernandez D, V.M.; Salas L, M.A. [UAZ, A.P. 336, 98000 Zacatecas (Mexico)]. e-mail:


    By means of Monte Carlo methods the X-ray spectra that produce Mammography equipment have been obtained. The mammographs are widely used with the purpose of diagnosing the cancer of the mammary glands. Different makers and mammographs models are distinguished by the voltage capacity and the current, exist as well as in the target type and filter. The targets that are used are Mo, Rh and W and the filters are Mo, Rh, Al and Be. In this work the results obtained by means of the MCNP code of the X-ray spectra take place when an electron beam of 28 keV is made impact on Mo, Rh and W targets, as well as the spectra that result of filtering these X rays using different types of filters. The resulting spectra contain the continuous spectrum of the stopping radiation, as well as the X rays characteristic of the used target. The utility of estimating the spectra of X rays by means of Monte Carlo is that it can use to estimate the absorbed dose by the gland, as well as the absorbed dose by other organs. It also allows to calculate the detector response. (Author)


    Directory of Open Access Journals (Sweden)

    V. V. Zhulmina


    Full Text Available Vitiligo is a disease with unknown etiology, which is characterized by skin depigmentation areas due to melanocyte death. Lack of clear understanding of pathogenic disease processes justifies the difficulty of choosing efficient treatment methods. Repigmentation is slow and not always complete. One of the key indicators in practical dermatology is objective assessment of skin cover condition for further diagnostics, definition of therapy and dynamics of the disease.The purpose of this study is to assess skin reflection spectrum in depigmentation areas, marginal layer and visible healthy skin before and after treatment of patients with vitiligo.21 patients having vitiligo were under observation; the patients were treated in the hospital of skin and venereal diseases of the Siberian State Medical University. The authors applied noninvasive method of spectrophotometry for the first time in order to study skin reflection spectrum of patients with vitiligo. Noninvasive medical spectrophotometry is based on dependence factor of integral optical properties of biological tissues and fluids in the conditions of homeostasis and in case of pathology. In order to assess the efficiency of skin disease treatment the patients were exposed to skin spectrophotometry before the beginning of the treatment and after the treatment itself with further measurements of the reflection spectrum integral criteria. The measurements were made in depigmentation area, on the boundary with healthy skin and in remote from depigmentation area of healthy skin.Obtained results indicate the difference of skin reflection spectra in the areas under investigation. Moreover, positive dynamics of the treatment associated with the decrease in the value of reflection spectrum integral criteria in the diseased area. There were no statistically important differences of the integral criteria, calculated based on measurement results of reflection spectra on the boundary of depigmentation area

  16. Simulation of dielectric spectra of erythrocytes with various shapes

    Energy Technology Data Exchange (ETDEWEB)

    Asami, Koji, E-mail: [Institute for Chemical Research, Kyoto University, Uji, Kyoto 611-0011 (Japan)


    Dielectric spectra of erythrocyte suspensions were numerically simulated over a frequency range from 1 kHz to 100 MHz to study the effects of erythrocyte shape on the dielectric spectra. First, a biconcave-discoid model for normal erythrocytes or discocytes was compared with an equivalent oblate spheroid model. The two models showed similar dielectric spectra to each other, suggesting that the oblate spheroid model can be approximately used for discocytes. Second, dielectric spectra were simulated for discocytes deformed by osmotic cell swelling. The deformation resulted in the increase in relaxation intensity and the sharpening of spectrum shape. Finally, dielectric spectra were simulated for echinocytes, stomatocytes and sickle cells that are induced by chemical agents and diseases. The dielectric spectra of echinocytes and stomatocytes were similar to each other, being distinguishable from that of discocytes and quite different from that of sickle cells.

  17. [Raman spectra of fossil dinosaurs from different regions]. (United States)

    Yang, Qun; Wang, Yi-lin


    Raman microscopic spectra in the higher wave number region were obtained from 7 fossil dinosaurs specimens from different regions. The specimens of fossil dinosaurs are different parts of bone. The Raman spectra of fossil dinosaurs indicate the high similarity among peak positions of different fossil dinosaurs; but important differences exist in the spectral peak figures. In the wave number region of 1000-1800 cm(-1) the Raman spectra of the same bone part fossils from different regions are very similar, example similarities between spectra of Lufeing backbone head and Yua nmou backbone head; Lufeng limb bone and Wuding limb bone. There are relations between the same bone part spectra of different fossil dinosaurs. The characteristic does not relate to regions. Raman spectra of fossil dinosaurs cannot be used to distinguish fossil source, although the part of bone can be used as an indicator to narrow the range of possible geographical origins.

  18. Unmixing Space Object’s Moderate Resolution Spectra (United States)


    of spectra. While spectral unmixing techniques have been tested with space objects and spectrometric visible spectra, with spectral width smaller than...While spectral unmixing techniques have been tested with space objects and spectrometric visible spectra, with spectral width smaller than 0.4 nanometers...and will discuss, the pruning of the spectral library based on pairwise spectral angles as a means to promote incoherence. Candes, Romberg and Tao

  19. A method to enhance the resolution of broadened spectra

    Energy Technology Data Exchange (ETDEWEB)

    Cabral P, A.; Jimenez D, H.; Torres V, M.; Azorin N, J.; Gutierrez C, A.; Gonzalez M, P.R.; Lopez E, J. [ININ, 52045 Ocoyoacac, Estado de Mexico (Mexico); Fuentes Z, G.A.; Cordoba, A. [UAM-I, 09340 Mexico D.F. (Mexico)


    A deconvolution method to analyze line overlapping broadened spectra is presented. Two approximation expressions from which the user can remove, either a Lorentzian or a Gaussian line from observed spectra are utilized. Moessbauer spectra, EPR and Thermoluminescence spectroscopies are analyzed. It is shown that in each case, the de convolved spectrum may provide valuable data to get a much closer characterization of a substance. (Author)

  20. Infrared spectra of OCS-hydrogen complexes (United States)

    Tang, Jian; McKellar, A. R. W.


    Five distinct species of OCS-hydrogen van der Waals complexes (OCS-orthoH2,-paraH2,-paraD2,-orthoD2, and -HD) have been observed by infrared spectroscopy in the region of the OCS ν1 vibration (≈2062 cm-1) in a pulsed supersonic jet expansion using a tunable diode laser probe. The spectra are those of prolate asymmetric rotors, with observed a-type transitions (ΔK=0), but no b-type transitions (ΔK=±1). The fitted rotational parameters are consistent with structures having intermolecular separations in the range of 3.6-3.8 Å and angles of about 70° between the OCS axis and the hydrogen center of mass. The band origins are slightly red-shifted (-0.05 to -0.20 cm-1) relative to that of the free OCS molecule. The results are of interest due to recent observations of the same complexes trapped in ultracold helium droplets; there is a remarkably close correspondence of the vibrational band origins of the free and trapped species.

  1. Inflationary power spectra with quantum holonomy corrections

    CERN Document Server

    Mielczarek, Jakub


    In this paper we study slow-roll inflation with holonomy corrections from loop quantum cosmology. Both tensor and scalar power spectra of primordial perturbations are computed up to the first order in slow-roll parameters and $V/\\rho_{c}$, where $V$ is a potential of the scalar field and $\\rho_{c}$ is a critical energy density (expected to be of the order of the Planck energy density). Possible normalizations of modes at short scales are discussed. In case the normalization is performed with use of the Wronskian condition applied to adiabatic vacuum, the tensor and scalar spectral indices are not quantum corrected in the leading order. However, by choosing an alternative method of normalization one can obtain quantum corrections in the leading order. Furthermore, we show that the holonomy-corrected equation of motion for tensor modes can be derived from an effective background metric. This allows us to prove that the Wronskian normalization condition for the tensor modes preserves the classical form.

  2. A digital boxcar integrator for IMS spectra (United States)

    Cohen, Martin J.; Stimac, Robert M.; Wernlund, Roger F.; Parker, Donald C.


    When trying to detect or quantify a signal at or near the limit of detectability, it is invariably embeded in the noise. This statement is true for nearly all detectors of any physical phenomena and the limit of detectability, hopefully, occurs at very low signal-to-noise levels. This is particularly true of IMS (Ion Mobility Spectrometers) spectra due to the low vapor pressure of several chemical compounds of great interest and the small currents associated with the ionic detection process. Gated Integrators and Boxcar Integrators or Averagers are designed to recover fast, repetitive analog signals. In a typical application, a time 'Gate' or 'Window' is generated, characterized by a set delay from a trigger or gate pulse and a certain width. A Gated Integrator amplifies and integrates the signal that is present during the time the gate is open, ignoring noise and interference that may be present at other times. Boxcar Integration refers to the practice of averaging the output of the Gated Integrator over many sweeps of the detector. Since any signal present during the gate will add linearly, while noise will add in a 'random walk' fashion as the square root of the number of sweeps, averaging N sweeps will improve the 'Signal-to-Noise Ratio' by a factor of the square root of N.

  3. Lyman Limit Absorbers in GALEX Spectra (United States)

    Williger, Gerard M.; Haberzettl, Lutz G.; Ribaudo, Joseph; Kuchner, Marc J.; Burchett, Joseph; Clowes, Roger G.; Lauroesch, James T.; Mills, Brianna; Borden, Jeremy


    We describe the method and early results for crowdsourcing a search for low-redshift partial and complete Lyman Limit Systems (pLLSs and LLSs) in the GALEX spectral archive. LLSs have been found in large numbers at z>3 and traced to lower redshift through a relatively small number of QSO spectra from spaced-based telescopes. From a sample of 44 pLLSs and 11 LLSs at 0.1 = -0.32 +/- 0.07 and the low-metallicity portion centered at = -1.87 +/- 0.11.The GALEX spectral archive offers a vast dataset potentially containing hundreds of LLSs, which may be leveraged to search for such a bimodality and track its evolution within the unconstrained near-UV gap at 1search. We have therefore begun crowdsourcing a subset of the GALEX archive for LLSs and pLLSs via a Zooniverse project. Initially, undergraduate physics majors are performing a pilot project before releasing to citizen scientists in the public at large. We will then vet candidate systems and estimate column densities in a follow-up analysis. Upon assessing the accuracy of the physics majors’ identifications, the results will be used to devise a larger program with the help of the general public. The resulting data set would then provide the best available link between the HST-selected far-UV and ground-based pLLS+LLS samples and provide an ideal sample for consequent metallicity determinations.

  4. Extracting Quantitative Data from Lunar Soil Spectra (United States)

    Noble, S. K.; Pieters, C. M.; Hiroi, T.


    Using the modified Gaussian model (MGM) developed by Sunshine et al. [1] we compared the spectral properties of the Lunar Soil Characterization Consortium (LSCC) suite of lunar soils [2,3] with their petrologic and chemical compositions to obtain quantitative data. Our initial work on Apollo 17 soils [4] suggested that useful compositional data could be elicited from high quality soil spectra. We are now able to expand upon those results with the full suite of LSCC soils that allows us to explore a much wider range of compositions and maturity states. The model is shown to be sensitive to pyroxene abundance and can evaluate the relative portion of high-Ca and low-Ca pyroxenes in the soils. In addition, the dataset has provided unexpected insights into the nature and causes of absorption bands in lunar soils. For example, it was found that two distinct absorption bands are required in the 1.2 m region of the spectrum. Neither of these bands can be attributed to plagioclase or agglutinates, but both appear to be largely due to pyroxene.

  5. Resonance spectra of caged black holes

    Energy Technology Data Exchange (ETDEWEB)

    Hod, Shahar [The Ruppin Academic Center, Emeq Hefer (Israel); The Hadassah Institute, Jerusalem (Israel)


    Recent numerical studies of the coupled Einstein-Klein-Gordon system in a cavity have provided compelling evidence that confined scalar fields generically collapse to form black holes. Motivated by this intriguing discovery, we here use analytical tools in order to study the characteristic resonance spectra of the confined fields. These discrete resonant frequencies are expected to dominate the late-time dynamics of the coupled black-hole-field-cage system. We consider caged Reissner-Nordstroem black holes whose confining mirrors are placed in the near-horizon region x{sub m} ≡ (r{sub m} - r{sub +})/r{sub +} << τ ≡ (r{sub +} - r{sub -})/r{sub +} (here r{sub m} is the radius of the confining mirror and r{sub ±} are the radii of the black-hole horizons). We obtain a simple analytical expression for the fundamental quasinormal resonances of the coupled blackhole- field-cage system: ω{sub n} = -2πT{sub BH}.n [1 + O(x{sub m}{sup n}/τ{sup n})], where T{sub BH} is the temperature of the caged black hole and n = 1, 2, 3,.. is the resonance parameter. (orig.)

  6. Synthetic infrared spectra for correlation spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Sinclair, M.B.; Butler, M.A.; Ricco, A.J.; Kravitz, S.H.; Zubrzycki, W.J.; Warren, M.E.


    As a first step toward the development of a new remote sensing technique that the authors call holographic correlation spectroscopy, they demonstrate that diffractive optics can be used to synthesize the infrared spectra of real compounds. In particular, they have designed, fabricated, and characterized a diffractive element that successfully reproduces the major features f the spectrum of gaseous HF in the region between 3,600 cm{sup {minus}1} and 4,300 cm{sup {minus}1}. The reflection-mode diffractive optic consists of 4,096 lines, each 4.5 {micro}m wide, at 16 discrete depths relative to the substrate (from 0 to 1.2 {micro}m), and was fabricated on a silicon wafer using anisotropic reactive ion-beam etching in a four-mask-level process. The authors envision the use of diffractive elements of this type to replace the cumbersome reference cells of conventional correlation spectroscopy and thereby enable a new class of compact and versatile correlation spectrometers.

  7. System of pattern analysis of PIXE spectra

    Energy Technology Data Exchange (ETDEWEB)

    Murozono, K.; Iwasaki, S.; Inoue, J.; Ishii, K.; Kitamura, M. [Tohoku Univ., Sendai (Japan). Faculty of Engineering; Sera, K.; Futatsugawa, S.


    We have developed an analysis system based on the pattern analysis method. By testing the system, several difficulties of the present method have been identified. We found the following solutions for them: pre-selection of candidate elements in a sample and the use of a proper absorber. The pre-selection of the candidate elements will not be a serious drawback in the industrial PIXE, because it will be easy to pre-process the spectra for a few samples in the beginning of the mass processing of samples of the same kind. On the other hand, reduction of the efficiency due to the use of funny filter is significant only in the lower energy region, where we usually do not suffer from insufficient yields of lighter elements in common samples. The selection of the most suitable filter requires PIXE user to be deeply experienced. In particular, it is not easy to choose the best filter to suppress the yield of peak of an abundant element as the absorption edge filter. It will be important task to find a set of suitable combination of representative samples and corresponding filters. Furthermore, the peak profile model should be improved from the simple Gaussian approximation to more realistic ones with exponential tail, flat component below the peak and escape peaks, etc. It is also necessary to develop a theoretical approach for the background shape of the bremsstrahlung. (J.P.N.)

  8. An unbalanced spectra classification method based on entropy (United States)

    Liu, Zhong-bao; Zhao, Wen-juan


    How to solve the problem of distinguishing the minority spectra from the majority of the spectra is quite important in astronomy. In view of this, an unbalanced spectra classification method based on entropy (USCM) is proposed in this paper to deal with the unbalanced spectra classification problem. USCM greatly improves the performances of the traditional classifiers on distinguishing the minority spectra as it takes the data distribution into consideration in the process of classification. However, its time complexity is exponential with the training size, and therefore, it can only deal with the problem of small- and medium-scale classification. How to solve the large-scale classification problem is quite important to USCM. It can be easily obtained by mathematical computation that the dual form of USCM is equivalent to the minimum enclosing ball (MEB), and core vector machine (CVM) is introduced, USCM based on CVM is proposed to deal with the large-scale classification problem. Several comparative experiments on the 4 subclasses of K-type spectra, 3 subclasses of F-type spectra and 3 subclasses of G-type spectra from Sloan Digital Sky Survey (SDSS) verify USCM and USCM based on CVM perform better than kNN (k nearest neighbor) and SVM (support vector machine) in dealing with the problem of rare spectra mining respectively on the small- and medium-scale datasets and the large-scale datasets.

  9. Neutron flux spectra in the FFTF In-Reactor Thimble

    Energy Technology Data Exchange (ETDEWEB)

    Wootan, D.W.; Dobbin, K.D.; Schmittroth, F.A.; Roberts, J.H.


    Neutron spectra measured in the FFTF In-Reactor Thimble (IRT) by proton recoil proportional counters, proton recoil emulsions, and passive dosimeters have been evaluated and compared with each other and with three-dimensionl diffusion theory calculated spectra for the purpose of validating the passive dosimeter spectrum adjustment technique. The least squares data adjustment code, FERRET, was used to combine measured reaction rates, calculated spectra, and dosimeter cross sections, resulting in adjusted spectra and cross sections with uncertainties and correlations that properly account for uncertainties and correlations on the input parameters.

  10. TES/Aura L1B Spectra Limb V004 (United States)

    National Aeronautics and Space Administration — TES Level 1B Spectra data contain radiometric calibrated spectral radiances and their corresponding noise equivalent spectral radiances (NESR). The geolocation,...

  11. Transmission properties of barite mortar using X-ray spectra measured with Cd Te detector

    Energy Technology Data Exchange (ETDEWEB)

    Santos, J. C.; Mariano, L.; Costa, P. R. [Universidade de Sao Paulo, Instituto de Fisica, Rua do Matao Travessa R. 187, Cidade Universitaria, 05508-090 Sao Paulo (Brazil); Tomal, A., E-mail: [Universidade Federal de Goias, Instituto de Fisica, Campus Samambaia, 74001-970 Goiania (Brazil)


    Current methods for calculating X-ray shielding barriers do not take into account spectral distribution of the beam transmitted by the protective material. This consideration is important in dose estimations for radiation workers and general public in diagnostic radiology facilities. The aim of the present study was to estimate barite mortar attenuation curves using X-ray spectra weighted by a workload distribution. These curves were described in units of ambient dose equivalent (H (10)), since it is the radiation quantity adopted by IAEA for dose assessment in medical environment. Attenuation curves were determined using the optimized model for shielding evaluation presented by Costa and Caldas (2002). Workload distribution presented by Simpkin (1996), measured primary spectra and mass attenuation coefficients of barite mortar were used as input data in this model. X-ray beams in diagnostic energy range were generated by an industrial X-ray tube with 3 mm of aluminum additional filtration. Primary experimental spectra were measured by a Cd Te detector and corrected by the response function of detector by means of a stripping procedure. Air kerma measurements were performed using an ionization chamber for normalization purpose of the spectra. The corrected spectra presented good agreement with spectra generated by a semi-empirical model. The variation of the ambient dose equivalent as a function of barite mortar thickness was calculated. Using these data, it was estimated the optimized thickness of protective barrier needed for shielding a particular area in an X-ray imaging facility. The results obtained for primary protective barriers exhibit qualitative agreement with those presented in literature. (Author)

  12. Models and methods for quantitative analysis of surface-enhanced Raman spectra. (United States)

    Li, Shuo; Nyagilo, James O; Dave, Digant P; Gao, Jean


    The quantitative analysis of surface-enhanced Raman spectra using scattering nanoparticles has shown the potential and promising applications in in vivo molecular imaging. The diverse approaches have been used for quantitative analysis of Raman pectra information, which can be categorized as direct classical least squares models, full spectrum multivariate calibration models, selected multivariate calibration models, and latent variable regression (LVR) models. However, the working principle of these methods in the Raman spectra application remains poorly understood and a clear picture of the overall performance of each model is missing. Based on the characteristics of the Raman spectra, in this paper, we first provide the theoretical foundation of the aforementioned commonly used models and show why the LVR models are more suitable for quantitative analysis of the Raman spectra. Then, we demonstrate the fundamental connections and differences between different LVR methods, such as principal component regression, reduced-rank regression, partial least square regression (PLSR), canonical correlation regression, and robust canonical analysis, by comparing their objective functions and constraints.We further prove that PLSR is literally a blend of multivariate calibration and feature extraction model that relates concentrations of nanotags to spectrum intensity. These features (a.k.a. latent variables) satisfy two purposes: the best representation of the predictor matrix and correlation with the response matrix. These illustrations give a new understanding of the traditional PLSR and explain why PLSR exceeds other methods in quantitative analysis of the Raman spectra problem. In the end, all the methods are tested on the Raman spectra datasets with different evaluation criteria to evaluate their performance.

  13. Vibronic effects and destruction of exciton coherence in optical spectra of J-aggregates: A variational polaron transformation approach

    Energy Technology Data Exchange (ETDEWEB)

    Bloemsma, E.A.; Silvis, M.H.; Stradomska, A.; Knoester, J., E-mail:


    Using a symmetry adapted polaron transformation of the Holstein Hamiltonian, we study the interplay of electronic excitation-vibration couplings, resonance excitation transfer interactions, and temperature in the linear absorption spectra of molecular J-aggregates. Semi-analytical expressions for the spectra are derived and compared with results obtained from direct numerical diagonalization of the Hamiltonian in the two-particle basis set representation. At zero temperature, we show that our polaron transformation reproduces both the collective (exciton) and single-molecule (vibrational) optical response associated with the appropriate standard perturbation limits. Specifically, for the molecular dimer excellent agreement with the spectra from the two-particle approach for the entire range of model parameters is obtained. This is in marked contrast to commonly used polaron transformations. Upon increasing the temperature, the spectra show a transition from the collective to the individual molecular features, which results from the thermal destruction of the exciton coherence.

  14. Measurement of neutron energy spectra behind shielding of a 120 GeV/c hadron beam facility

    Energy Technology Data Exchange (ETDEWEB)

    Nakao, Noriaki [Stanford Linear Accelerator Center (SLAC), Menlo Park, CA 94022 (United States)]. E-mail:; Taniguchi, Shingo [Japan Synchrotron Radiation Research Institute (JASRI), Hyogo, 679-5198 (Japan); Rokni, Sayed H. [Stanford Linear Accelerator Center (SLAC), Menlo Park, CA 94022 (United States); Roesler, Stefan [CERN, CH-1211, Geneva 23 (Switzerland); Brugger, Markus [CERN, CH-1211, Geneva 23 (Switzerland); Hagiwara, Masayuki [Cyclotron Radioisotope Center (CYRIC), Tohoku University, Sendai, 980-8579 (Japan); Vincke, Heinz [Stanford Linear Accelerator Center (SLAC), Menlo Park, CA 94022 (United States); Khater, Hesham [Stanford Linear Accelerator Center (SLAC), Menlo Park, CA 94022 (United States); Prinz, Alyssa A. [Stanford Linear Accelerator Center (SLAC), Menlo Park, CA 94022 (United States)


    Neutron energy spectra were measured behind the lateral shield of the CERF (CERN-EU High Energy Reference Field) facility at CERN with a 120 GeV/c positive hadron beam (mainly a mixture of protons and pions) on a cylindrical copper target (7-cm diameterx50-cm long). NE213 organic liquid scintillator (12.7-cm diameterx12.7-cm long) was located at various longitudinal positions behind shields of 80- and 160-cm thick concrete and 40-cm thick iron. Neutron energy spectra in the energy range between 12 and 380 MeV were obtained by unfolding the measured pulse height spectra with the detector response functions which have been experimentally verified in the neutron energy range up to 380 MeV in separate experiments. The corresponding MARS15 Monte Carlo simulations generally gave good agreements with the experimental energy spectra.

  15. Explosive Yield Estimation using Fourier Amplitude Spectra of Velocity Histories (United States)

    Steedman, D. W.; Bradley, C. R.


    The Source Physics Experiment (SPE) is a series of explosive shots of various size detonated at varying depths in a borehole in jointed granite. The testbed includes an extensive array of accelerometers for measuring the shock environment close-in to the explosive source. One goal of SPE is to develop greater understanding of the explosion phenomenology in all regimes: from near-source, non-linear response to the far-field linear elastic region, and connecting the analyses from the respective regimes. For example, near-field analysis typically involves review of kinematic response (i.e., acceleration, velocity and displacement) in the time domain and looks at various indicators (e.g., peaks, pulse duration) to facilitate comparison among events. Review of far-field data more often is based on study of response in the frequency domain to facilitate comparison of event magnitudes. To try to "bridge the gap" between approaches, we have developed a scaling law for Fourier amplitude spectra of near-field velocity histories that successfully collapses data from a wide range of yields (100 kg to 5000 kg) and range to sensors in jointed granite. Moreover, we show that we can apply this scaling law to data from a new event to accurately estimate the explosive yield of that event. This approach presents a new way of working with near-field data that will be more compatible with traditional methods of analysis of seismic data and should serve to facilitate end-to-end event analysis. The goal is that this new approach to data analysis will eventually result in improved methods for discrimination of event type (i.e., nuclear or chemical explosion, or earthquake) and magnitude.

  16. Electronic spectra of structurally deformed lutein. (United States)

    Macernis, Mindaugas; Sulskus, Juozas; Duffy, Christopher D P; Ruban, Alexander V; Valkunas, Leonas


    Quantum chemical calculations have been employed for the investigation of the lowest excited electronic states of lutein, with particular reference to its function within light harvesting antenna complexes of higher plants. Through comparative analysis obtained by using different methods based on gas-phase calculations of the spectra, it was determined that variations in the lengths of the long C-C valence bonds and the dihedral angles of the polyene chain are the dominant factors in determining the spectral properties of Lut 1 and Lut 2 corresponding to the deformed lutein molecules taken from crystallographic data of the major pigment-protein complex of photosystem II. By MNDO-CAS-CI method, it was determined that the two singlet B(u) states of lutein (nominally 1B(u)(-)* and 1B(u)(+)) arise as a result of mixing of the canonical 1B(u)(-) and 1B(u)(+) states of the all-trans polyene due to the presence of the ending rings in lutein. The 1B(u)(-)* state of lutein is optically allowed, while the 1B(u)(-) of a pure all-trans polyene chain is optically forbidden. As demonstrated, the B(u) states are much more sensitive to minor distortions of the conjugated chain due to mixing of the canonical states, resulting in states of poorly defined particle-hole symmetry. Conversely, the A(g) states are relatively robust with respect to geometric distortion, and their respective inversion and particle-hole symmetries remain relatively well-defined.

  17. Specdata: Automated Analysis Software for Broadband Spectra (United States)

    Oliveira, Jasmine N.; Martin-Drumel, Marie-Aline; McCarthy, Michael C.


    With the advancement of chirped-pulse techniques, broadband rotational spectra with a few tens to several hundred GHz of spectral coverage are now routinely recorded. When studying multi-component mixtures that might result, for example, with the use of an electrical discharge, lines of new chemical species are often obscured by those of known compounds, and analysis can be laborious. To address this issue, we have developed SPECdata, an open source, interactive tool which is designed to simplify and greatly accelerate the spectral analysis and discovery. Our software tool combines both automated and manual components that free the user from computation, while giving him/her considerable flexibility to assign, manipulate, interpret and export their analysis. The automated - and key - component of the new software is a database query system that rapidly assigns transitions of known species in an experimental spectrum. For each experiment, the software identifies spectral features, and subsequently assigns them to known molecules within an in-house database (Pickett .cat files, list of frequencies...), or those catalogued in Splatalogue (using automatic on-line queries). With suggested assignments, the control is then handed over to the user who can choose to accept, decline or add additional species. Data visualization, statistical information, and interactive widgets assist the user in making decisions about their data. SPECdata has several other useful features intended to improve the user experience. Exporting a full report of the analysis, or a peak file in which assigned lines are removed are among several options. A user may also save their progress to continue at another time. Additional features of SPECdata help the user to maintain and expand their database for future use. A user-friendly interface allows one to search, upload, edit or update catalog or experiment entries.

  18. Database-Driven Analyses of Astronomical Spectra (United States)

    Cami, Jan


    species to the fullerene species C60 and C70 [4]. Given the large number and variety of molecules detected in space, molecular infrared spectroscopy can be used to study pretty much any astrophysical environment that is not too energetic to dissociate the molecules. At the lowest energies, it is interesting to note that molecules such as CN have been used to measure the temperature of the Cosmic Microwave Background (see e.g., Ref. 15). The great diagnostic potential of infrared molecular spectroscopy comes at a price though. Extracting the physical parameters from the observations requires expertise in knowing how various physical processes and instrumental characteristics play together in producing the observed spectra. In addition to the astronomical aspects, this often includes interpreting and understanding the limitations of laboratory data and quantum-chemical calculations; the study of the interaction of matter with radiation at microscopic scales (called radiative transfer, akin to ray tracing) and the effects of observing (e.g., smoothing and resampling) on the resulting spectra and possible instrumental effects (e.g., fringes). All this is not trivial. To make matters worse, observational spectra often contain many components, and might include spectral contributions stemming from very different physical conditions. Fully analyzing such observations is thus a time-consuming task that requires mastery of several techniques. And with ever-increasing rates of observational data acquisition, it seems clear that in the near future, some form of automation is required to handle the data stream. It is thus appealing to consider what part of such analyses could be done without too much human intervention. Two different aspects can be separated: the first step involves simply identifying the molecular species present in the observations. Once the molecular inventory is known, we can try to extract the physical parameters from the observed spectral properties. For both

  19. Infrared spectra of inorganic compounds (3800-45cm- 1)

    National Research Council Canada - National Science Library

    Nyquist, Richard A; Kagel, Ronald O; Kagel, Ron


    .... In contrast, relatively few infrared spectra of inorganic compounds are available for reference, and no present collection covers both the mid- and far-infrared regions from 3800 to 45 cm-1. The present work is intended to help fill this void by presenting a comprehensive compendium of reference spectra of inorganic compounds.

  20. Classification of Stellar Spectra with Fuzzy Minimum Within-Class ...

    Indian Academy of Sciences (India)

    Classification is one of the important tasks in astronomy, especially in spectra analysis. Support Vector Machine (SVM) is a typical classification method, which is widely used in spectra classification. Although it performs well in practice, its classification accuracies can not be greatly improved because of two limitations.

  1. The Vibrational Spectra of the Boron Halides and their Molecular ...

    African Journals Online (AJOL)

    Two conformers, an eclipsed and a staggered species, have been examined for each complex. In the case of the boron trifluoride-water complex, the spectra computed using the largest basis set have been compared with the spectra obtained experimentally in nitrogen, argon and neon matrices at cryogenic temperatures.

  2. ISO-SWS spectra of OH/IR stars

    NARCIS (Netherlands)

    Cami, J; De Jong, T; Justtannont, K; Yamamura, [No Value; Waters, LBFM


    We present the spectra of 5 OH/IR stars observed with the Short Wavelength Spectrometer (SWS) on board the Infrared Space Observatory (ISO). The spectra are dominated by dust features, both in the amorphous and crystalline state and illustrate the influence of the mass loss rate on the observed

  3. A new scaling algorithm for predicting vibrational spectra of ...

    Indian Academy of Sciences (India)


    FL = Λ. Keywords. Vibrational spectra; force constants; scaling algorithms; ab initio; DFT calculations. 1. Introduction. Theoretical prediction of vibrational spectra of polyatomic molecules has been the goal for a long time. 1–7. The recent advances in ab initio and density functional methods (DFT) met considerable success.

  4. Comparison and Evaluation of Clustering Algorithms for Tandem Mass Spectra. (United States)

    Rieder, Vera; Schork, Karin U; Kerschke, Laura; Blank-Landeshammer, Bernhard; Sickmann, Albert; Rahnenführer, Jörg


    In proteomics, liquid chromatography-tandem mass spectrometry (LC-MS/MS) is established for identifying peptides and proteins. Duplicated spectra, that is, multiple spectra of the same peptide, occur both in single MS/MS runs and in large spectral libraries. Clustering tandem mass spectra is used to find consensus spectra, with manifold applications. First, it speeds up database searches, as performed for instance by Mascot. Second, it helps to identify novel peptides across species. Third, it is used for quality control to detect wrongly annotated spectra. We compare different clustering algorithms based on the cosine distance between spectra. CAST, MS-Cluster, and PRIDE Cluster are popular algorithms to cluster tandem mass spectra. We add well-known algorithms for large data sets, hierarchical clustering, DBSCAN, and connected components of a graph, as well as the new method N-Cluster. All algorithms are evaluated on real data with varied parameter settings. Cluster results are compared with each other and with peptide annotations based on validation measures such as purity. Quality control, regarding the detection of wrongly (un)annotated spectra, is discussed for exemplary resulting clusters. N-Cluster proves to be highly competitive. All clustering results benefit from the so-called DISMS2 filter that integrates additional information, for example, on precursor mass.

  5. Comparing spectra and coherences for groups of unequal size

    NARCIS (Netherlands)

    Bokil, H.; Purpura, K.; Schoffelen, J.M.; Thomson, D.; Mitra, P.


    Spectra and coherences are standard measures of association within and between time series. These measures have several advantages over their time-domain counterparts, not the least of which is the ability to derive and estimate confidence intervals. However, comparing spectra and coherences between

  6. A database of synthetic molecular spectra for astrophysical applications (United States)

    Cami, J.; Markwick-Kemper, A. J.

    We present an online database of molecular template spectra for astrophysical purposes. The initial database contains over 100,000 individual template spectra for 42 molecules totalling 97 isotopomers, and we provide an interface to the calculation of more spectra tailored to users' individual needs. Normalized absorption spectra are calculated in the LTE limit and presented for a wide range of astrophysically relevant temperature and column density regimes. For the same parameters, pure emission spectra are also calculated. The template spectra can be retrieved at different instrumental resolving powers, and can be combined together with different abundances interactively. Users can request additional spectra to be calculated for other parameters, the results of which become part of the database. These template spectra will be useful for identification of molecular absorption and emission bands over a wide range of spectroscopic observations, and allow a first estimate of temperatures and column densities in the regions where the molecular bands are formed. We highlight the different applications for which we believe this database and service to be useful, and offer some examples of how the templates can be used in various astrophysical contexts, and in particular for the analyis of observations with ISO and Spitzer.


    Indian Academy of Sciences (India)

    THE Raman spectra of water, heavy water and ice have been studied in detail by a large number of workers though not always with concurrent results. An investigation has been made on their Raman spectra by the present author employing the Rasetti technique of utilising the A 2536-5 resonance radiation of the mercury ...

  8. Investigation of structure of noise component in molecular spectra (United States)

    Sibgatullin, M. E.; Galimullin, D. Z.; Kamalova, D. I.; Salakhov, M. Kh


    In the work the noise component of molecular spectra is investigated by use the Hurst index which is the quantitative parameter of memory effects. It was shown that the low- frequency noise component predominates. The Hurst index is from 0.6 to 0.7 for the studied FTIR spectra registered at different temperatures.

  9. Soil carbon estimation from eucalyptus grandis using canopy spectra

    African Journals Online (AJOL)

    Mapping soil fertility parameters, such as soil carbon (C), is fundamentally important for forest management and research related to forest growth and climate change. This study seeks to establish the link between Eucalyptus grandis canopy spectra and soil carbon using raw and continuum-removed spectra. Canopy-level ...

  10. Infra-red reflectance and emissivity spectra of nanodiamonds


    Maturilli, A.; Shiryaev, A. A.; Kulakova, I I; Helbert, J.


    Reflectance and emissivity spectra of nanodiamonds powder were measured in a dedicated setup at temperatures up to 873 K. The spectra are characterised by presence of sharp bands due to surface-bound functional groups. Thermal desorption of oxygen-containing groups lead to corresponding spectral changes. The maximal emissivity of nanodiamond powder reaches 0.985.

  11. Meson Spectra: Power Law Potential Model in the Dirac Equation ...

    African Journals Online (AJOL)

    A single mass-spectra potential model has been used to predict the spectra of both light and heavy mesons (including leptonic decay-widths) in the Dirac equation. In fact a power law potential has been proposed with effective power where is the mass of the constituent quarks (in GeV) of the mesons considered.

  12. Synthesis and infrared spectra of alkaline earth metal carbonates ...

    Indian Academy of Sciences (India)

    The metal carbonate, MCO3 (M = Ca, Sr and Ba), was synthesized by a novel method of reacting aqueous solution of each of Ca2+, Sr2+ and Ba2+ salts with urea at high temperature, ∼ 80°C. The reaction products were characterized through elemental analysis and infrared spectra. The infrared spectra of the products are ...

  13. A case study of mesoscale spectra of wind and temperature

    DEFF Research Database (Denmark)

    Larsén, Xiaoli Guo; Larsen, Søren Ejling; Badger, Merete


    The spectra of the zonal and meridional winds and temperature over the mesoscale range of length-scales (10−5......The spectra of the zonal and meridional winds and temperature over the mesoscale range of length-scales (10−5...

  14. An Analysis of Spectra in the Red Rectangle Nebula

    Indian Academy of Sciences (India)


    Jan 27, 2016 ... This paper presents an analysis of a series of spectra in the Red Rectangle nebula. Only the reddest part of the spectra can safely be attributed to light from the nebula, and indicates Rayleigh scattering by the gas, in conformity with the large angles of scattering involved and the proximity of the star. In the ...

  15. Investigation of Bremsstrahlung spectra of 6 MV medical linear accelerator

    CERN Document Server

    Zhang Song Bai; Bao Shang Lian; Zhao Hong Bin; Han Shu Kui


    The energy spectra of the Bremsstrahlung X-rays from the 6 MV medical linear accelerator are measured by attenuation analysis of the transmission data. An universal Monte-Carlo program EGS4 is also used to calculate the Bremsstrahlung spectra of the 6 MV medical linear accelerator. The measurement results are in good agreement with the calculation results

  16. Measurement of turbulence spectra using scanning pulsed wind lidars

    DEFF Research Database (Denmark)

    Sathe, Ameya; Mann, Jakob


    Turbulent velocity spectra, as measured by a scanning pulsed wind lidar (WindCube), are analyzed. The relationship between ordinary velocity spectra and lidar derived spectra is mathematically very complex, and deployment of the three-dimensional spectral velocity tensor is necessary. The resulting...... scanning lidar spectra depend on beam angles, line-of-sight averaging, sampling rate, and the full three-dimensional structure of the turbulence being measured, in a convoluted way. The model captures the attenuation and redistribution of the spectral energy at high and low wave numbers very well....... The model and measured spectra are in good agreement at two analyzed heights for the u and w components of the velocity field. An interference phenomenon is observed, both in the model and the measurements, when the diameter of the scanning circle divided by the mean wind speed is a multiple of the time...

  17. Irradiation effect on infrared spectra of LiF:OH crystals: Theoretical modeling (United States)

    Inerbaev, Talgat; Dauletbekova, Alma; Abdrakhmetova, Ainash


    First-principles simulations of LiF:OH crystal infrared absorption spectra were performed using density functional calculations with periodic boundary conditions to explain the yet unclear nature of experimentally observed irradiation-induced absorption bands in infrared spectra in frequency range 1900-2200 and 1000-1300 cm-1. To model the irradiation effect, various defect structures were explored. Simulations demonstrated that a new type of defect should be taken into consideration to explain the infrared spectra features. Specific new defect is formed by one fluorine atom displaced from the lattice site into the interstitial position due to irradiation. At the same time, hydrogen atom, produced by of hydroxyl group radiolysis decay, occupies position between fluorine atoms in anionic (Fa) and interstitial (Fi) positions forming covalently bonded negatively charged defect, referred to as F-H-F complex. Asymmetrical stretching oscillation of this defect complex is responsible for infrared absorption band near 2200 cm-1. Features in the infrared spectra observed near 1000 cm-1 originate from two types of vibrations: bending vibrations of proposed new defect complex and oscillations of hydrogen ions in the anionic positions. Defect formed by negatively charged hydrogen ion in interstitial position results infrared absorption band at 1288 cm-1. The experimentally observed decrease of the oscillation frequency near 2200 cm-1 under further irradiation is associated with increase of negative charge value on the proposed defect complex caused by F-centers creation.

  18. Effect of microwave power on EPR spectra of natural and synthetic dental biocompatible materials

    Directory of Open Access Journals (Sweden)

    Adamczyk Jakub


    Full Text Available Paramagnetic centers in the two exemplary synthetic and natural dental biocompatible materials applied in implantology were examined by the use of an X-band (9.3 GHz electron paramagnetic resonance (EPR spectroscopy. The EPR spectra were measured in the range of microwave power 2.2–70 mW. The aims of this work were to compare paramagnetic centers concentrations in different dental biocompatible materials and to determine the effect of microwave power on parameters of their EPR spectra. It is the very first and innovatory examination of paramagnetic centers in these materials. It was pointed out that paramagnetic centers existed in both natural (~1018 spin/g and synthetic (~1019 spin/g dental biocompatible materials, but the lower free radical concentration characterized the natural sample. Continuous microwave saturation of EPR spectra indicated that faster spin-lattice relaxation processes existed in synthetic dental biocompatible materials than in natural material. Linewidths (ΔBpp of the EPR spectra of the natural dental material slightly increased for the higher microwave powers. Such effect was not observed for the synthetic material. The broad EPR lines (ΔBpp: 2.4 mT, 3.9 mT, were measured for the natural and synthetic dental materials, respectively. Probably strong dipolar interactions between paramagnetic centers in the studied samples may be responsible for their line broadening. EPR spectroscopy is the useful experimental method in the examination of paramagnetic centers in dental biocompatible materials.

  19. An example of scaling MST Doppler spectra using median spectra, spectral smoothing, and velocity tracing (United States)

    Green, J. L.


    Although automatic, computer scaling methods appeared at the start of the MST (mesosphere stratosphere troposphere) radar technique, there is a continuing need for scaling algorithms that perform editing functions and increase the sensitivity of radar by post processing. The scaling method presented is an adaptation of the method of scaling MST Doppler spectra presented by Rastogi (1984). A brief overview of this method is as follows: a median spectrum is calculated from several sequential spectra; the median noise value is subtracted from this derived spectrum; the median spectrum is smoothed; the detection/nondetection decision is made by comparing the smoothed spectrum to the variance of the smoothed noise; and if a signal is detected, then the half-power points of the smoothed echo spectrum are used to place limits on the evaluation of the first two moments of the unsmoothed median spectrum. In all of the above steps, the algorithm is guided by tracing the expected velocity range upward from the lowest range as far as possible. The method is discussed in more detail.

  20. Comparison between simplified load spectra in accordance with Germanische Lloyd guidelines, and load spectra derived from time domain simulations

    Energy Technology Data Exchange (ETDEWEB)

    Rees, M. [Aerodyn Energiesysteme gmbH, Rendsburg (Germany)


    The Germanische Lloyd guideline allows calculations of load spectra in two fundamentally different ways. In the case of the so-called `simplified load spectra` the maximum amplitude of fluctuation of a load component is formed as {+-}75% of the average value of the purely aerodynamic loads of this component at rated wind conditions, together with an overlay of mass-related loads. The second method allowed in the GL guideline is the calculation of load spectra from simulation results in the time domain. For a number of average wind speeds the time-dependent characteristics of the load components are calculated taking account of the natural spatial turbulence of the wind. These are converted into load spectra using the rainflow method. In a parametric study the load spectra are calculated according to both methods and compared. The calculations are performed for turbines with rated powers of 100 kW to 2000 kW, with two and three blades, and also for stall-controlled and pitch-controlled turbines. The calculated load spectra are compared with each by means of 1 P fatigue equivalent load spectra. The influence of individual parameters is presented, as is the validity of the simplified load spectra. (au)

  1. PREFACE: Atomic Spectra and Oscillator Strengths (ASOS9) Atomic Spectra and Oscillator Strengths (ASOS9) (United States)

    Wahlgren, Glenn M.; Wiese, Wolfgang L.; Beiersdorfer, Peter


    For the first time since its inaugural meeting in Lund in 1983, the triennial international conference on Atomic Spectroscopy and Oscillator Strengths for Astrophysical and Laboratory Plasmas (ASOS) returned to Lund, Sweden. Lund has been a home to atomic spectroscopy since the time of Janne Rydberg, and included the pioneering work in laboratory and solar spectroscopy by Bengt Edlén, who presented the initial ASOS talk in 1983. The ninth ASOS was hosted by the Lund Observatory and Physics Department of Lund University, 7-10 August 2007, and was attended by 99 registrants. An encouraging sign for the field was the number of young researchers in attendance. This volume of Physica Scripta contains contributions from the invited presentations of the conference. For the first time, papers from the ASOS9 poster presentations have been made feely available online in a complementary volume of Journal of Physics: Conference Series. With these two volumes the character of ASOS9 is more evident, and together they serve as a review of the state of atomic spectroscopy for spectrum analysis and the determination of oscillator strengths and their applications. The goal of ASOS is to be a forum for atomic spectroscopy, where both the providers and the users of atomic data, which includes wavelengths, energy levels, lifetimes, oscillator strengths and line shape parameters, can meet to discuss recent advances in experimental and theoretical techniques and their application to understanding the physical processes that are responsible for producing observed spectra. The applications mainly originate from the fields of astrophysics and plasma physics, which includes fusion energy and lighting research. The oral presentations, all but one of which are presented in this volume, provided an extensive synopsis of techniques currently in use and those that are being planned. New to ASOS9 was the extent to which techniques such as cold, trapped atoms and molecules and frequency combs are

  2. State-by-state emission spectra fitting for non-equilibrium plasmas: OH spectra of surface barrier discharge at argon/water interface (United States)

    Voráč, Jan; Synek, Petr; Procházka, Vojtěch; Hoder, Tomáš


    Optical emission spectroscopy applied to non-equilibrium plasmas in molecular gases can give important information on basic plasma parameters, including the rotational and vibrational temperatures and densities of the investigated radiative states. In order to precisely understand the non-equilibrium of rotational-vibrational state distribution from the investigated spectra without limiting presumptions, a state-by-state temperature-independent fitting procedure is the ideal approach. In this paper, we present a novel software tool developed for this purpose, freely available for the scientific community. The introduced tool offers a convenient way to construct Boltzmann plots even from partially overlapping spectra, in a user-friendly environment. We apply the novel software to the challenging case of OH spectra in surface streamer discharges generated from the triple-line of the argon/water/dielectrics interface. After the barrier discharge is characterised by ICCD and electrical measurements, the spatially and phase resolved rotational temperatures from N2(C-B) and OH(A-X) spectra are determined and compared. The precise analysis shows that OH(A) states with quantum numbers ≤ft({{v}\\prime}=0,~9≤slant {{N}\\prime}≤slant 13\\right) are overpopulated with respect to the found two-Boltzmann distribution. We hypothesise that fast vibrational-energy transfer is responsible for this phenomenon, observed here for the first time. Finally, the vibrational temperature of the plasma and the relative populations of hot and cold OH(A) states are quantified spatially and phase resolved.

  3. Automated detection of satellite contamination in incoherent scatter radar spectra

    Directory of Open Access Journals (Sweden)

    J. Porteous


    Full Text Available Anomalous ion line spectra have been identified in many experiments. Such spectra are defined as deviations from the standard symmetric "double-humped" spectra derived from incoherent scatter radar echoes from the upper atmosphere. Some anomalous spectra – where there are sharp enhancements of power over restricted height ranges – have been attributed to satellite contamination in the beam path. Here we outline a method for detecting such contamination, and review in detail a few cases where the method enables the identification of anomalous spectra as satellite echoes, subsequently ascribed to specific orbital objects. The methods used here to identify such satellites provide a useful way of distinguishing anomalous spectra due to satellites from those of geophysical origin. Analysis of EISCAT Svalbard Radar data reveals that an average of 8 satellites per hour are found to cross the beam. Based on a relatively small sample of the data set, it appears that at least half of the occurrences of anomalous spectra are caused by satellite contamination rather than being of geophysical origin.Key words. Ionosphere (auroral ionosphere, instruments and techniques – Radio Science (signal processing

  4. Machine Learning Method for Pattern Recognition in Volcano Seismic Spectra (United States)

    Radic, V.; Unglert, K.; Jellinek, M.


    Variations in the spectral content of volcano seismicity related to changes in volcanic activity are commonly identified manually in spectrograms. However, long time series of monitoring data at volcano observatories require tools to facilitate automated and rapid processing. Techniques such as Self-Organizing Maps (SOM), Principal Component Analysis (PCA) and clustering methods can help to quickly and automatically identify important patterns related to impending eruptions. In this study we develop and evaluate an algorithm applied on a set of synthetic volcano seismic spectra as well as observed spectra from Kılauea Volcano, Hawai`i. Our goal is to retrieve a set of known spectral patterns that are associated with dominant phases of volcanic tremor before, during, and after periods of volcanic unrest. The algorithm is based on training a SOM on the spectra and then identifying local maxima and minima on the SOM 'topography'. The topography is derived from the first two PCA modes so that the maxima represent the SOM patterns that carry most of the variance in the spectra. Patterns identified in this way reproduce the known set of spectra. Our results show that, regardless of the level of white noise in the spectra, the algorithm can accurately reproduce the characteristic spectral patterns and their occurrence in time. The ability to rapidly classify spectra of volcano seismic data without prior knowledge of the character of the seismicity at a given volcanic system holds great potential for real time or near-real time applications, and thus ultimately for eruption forecasting.

  5. Analysis of the experimental positron lifetime spectra by neural networks

    Directory of Open Access Journals (Sweden)

    Avdić Senada


    Full Text Available This paper deals with the analysis of experimental positron lifetime spectra in polymer materials by using various algorithms of neural networks. A method based on the use of artificial neural networks for unfolding the mean lifetime and intensity of the spectral components of simulated positron lifetime spectra was previously suggested and tested on simulated data [Pžzsitetal, Applied Surface Science, 149 (1998, 97]. In this work, the applicability of the method to the analysis of experimental positron spectra has been verified in the case of spectra from polymer materials with three components. It has been demonstrated that the backpropagation neural network can determine the spectral parameters with a high accuracy and perform the decomposi-tion of lifetimes which differ by 10% or more. The backpropagation network has not been suitable for the identification of both the parameters and the number of spectral components. Therefore, a separate artificial neural network module has been designed to solve the classification problem. Module types based on self-organizing map and learning vector quantization algorithms have been tested. The learning vector quantization algorithm was found to have better performance and reliability. A complete artificial neural network analysis tool of positron lifetime spectra has been constructed to include a spectra classification module and parameter evaluation modules for spectra with a different number of components. In this way, both flexibility and high resolution can be achieved.

  6. Photoacoustic in-vivo spectra of recent stromatolites (United States)

    Schubert, W.; Giani, D.; Rongen, P.; Krumbein, W. E.; Schmidt, W.


    In-vivo photoacoustic spectra (PAS) of pure cultures of cyanobacteria and photosynthetic bacteria ( Chromatiaceae) which usually occur in stromatolitic microbial mats were measured. The PA spectra of the pure cultures were compared to PA spectra measured directly on different layers of microbial mats from Mellum (North Sea). The advantages of PAS of opaque, solid samples (e.g., sediment, rock), and of particle suspensions (e.g., light-scattering cell cultures with interference by sulfur globules) over conventional spectroscopy using classical in-vivo or extraction photometry are discussed.

  7. Energy spectra of cosmic rays in the knee region

    Energy Technology Data Exchange (ETDEWEB)

    Ulrich, H. E-mail:; Antonia, T.; Apel, W.D.; Badea, F.; Bekk, K.; Bercuci, A.; Bluemer, H.; Bozdog, H.; Brancus, I.M.; Buettner, C.; Chilingarian, A.; Daumiller, K.; Doll, P.; Engler, J.; Fessler, F.; Gils, H.J.; Glasstetter, R.; Haeusler, R.; Haungs, A.; Heck, D.; Hoerandel, J.R.; Iwan, A.; Kampert, K.-H.; Klages, H.O.; Maier, G.; Mathes, H.J.; Mayer, H.J.; Milke, J.; Mueller, M.; Obenland, R.; Oehlschlaeger, J.; Ostapchenko, S.; Petcu, M.; Rebel, H.; Risse, M.; Roth, M.; Schatz, G.; Schieler, H.; Scholz, J.; Thouw, T.; Weber, J.H.; Weindl, A.; Wentz, J.; Wochele, J.; Zabierowski, J


    The key observables of the KASCADE field array are the electron and muon number of extensive air showers. Using the size spectra of these measured quantities and their correlations with energy and primary mass it is possible to reconstruct the energy spectra of individual mass groups. The analysis relies on the application of unfolding methods. The resulting spectra of the light components show a knee-like feature. The positions of the individual knees suggest a dependence on the primary charge even if the statistical and systematical significance has to be improved.

  8. Stretched-exponential Doppler spectra in underwater acoustic communication channels. (United States)

    van Walree, P A; Jenserud, T; Otnes, R


    The theory of underwater sound interacting with the sea surface predicts a Gaussian-spread frequency spectrum in the case of a large Rayleigh parameter. However, recent channel soundings reveal more sharply peaked spectra with heavier tails. The measured Doppler spread increases with the frequency and differs between multipath arrivals. The overall Doppler spectrum of a broadband waveform is the sum of the spectra of all constituent paths and frequencies, and is phenomenologically described by a stretched or compressed exponential. The stretched exponential also fits well to the broadband spectrum of a single propagation path, and narrowband spectra summed over all paths.

  9. Influence of fission spectra uncertainties on calculated fast reactor parameters

    Energy Technology Data Exchange (ETDEWEB)

    Lucius, J.L.; Marable, J.H.


    The effect of fission spectra uncertainties on calculated fast reactor parameters is studied by (1) considering the sensitivities to fission spectrum parameters of four performance parameters in the fast reactor benchmark ZPR-6/7, (2) estimating the uncertainties in these calculated performance parameters due to uncertainties in the fission spectra, (3) reporting the change in ZPR-6/7 calculated performance parameters due to fission spectra changes going from ENDF/B-IV to proposed ENDF/B-VP, and (4) determining what fast benchmark integral experiments are trying to tell us about ENDF/B-IV fission spectrum parameters as variables in a least squares adjustment procedure.

  10. Photoemission spectra of charge density wave states in cuprates (United States)

    Tu, Wei-Lin; Chen, Peng-Jen; Lee, Ting-Kuo

    Angle-resolved photoemission spectroscopy(ARPES) experiments have reported many exotic properties of cuprates, such as Fermi arc at normal state, two gaps at superconducting state and particle-hole asymmetry at the antinodal direction. On the other hand, a number of inhomogeneous states or so-called charge density waves(CDW) states have also been discovered in cuprates by many experimental groups. The relation between these CDW states and ARPES spectra is unclear. With the help of Gutzwiller projected mean-field theory, we can reproduce the quasiparticle spectra in momentum space. The spectra show strong correspondence to the experimental data with afore-mentioned exotic features in it.

  11. Computer Processing Of Tunable-Diode-Laser Spectra (United States)

    May, Randy D.


    Tunable-diode-laser spectrometer measuring transmission spectrum of gas operates under control of computer, which also processes measurement data. Measurements in three channels processed into spectra. Computer controls current supplied to tunable diode laser, stepping it through small increments of wavelength while processing spectral measurements at each step. Program includes library of routines for general manipulation and plotting of spectra, least-squares fitting of direct-transmission and harmonic-absorption spectra, and deconvolution for determination of laser linewidth and for removal of instrumental broadening of spectral lines.

  12. Time series with mixed spectra theory and methods

    CERN Document Server

    Li, Ta-Hsin


    Time series with mixed spectra are characterized by hidden periodic components buried in random noise. Despite strong interest in the statistical and signal processing communities, no book offers a comprehensive and up-to-date treatment of the subject. Filling this void, Time Series with Mixed Spectra focuses on the methods and theory for the statistical analysis of time series with mixed spectra. It presents detailed theoretical and empirical analyses of important methods and algorithms. Using both simulated and real-world data to illustrate the analyses, the book discusses periodogram analys

  13. Sonoluminescence and acoustic emission spectra at different stages of cavitation zone development. (United States)

    Dezhkunov, N V; Francescutto, A; Serpe, L; Canaparo, R; Cravotto, G


    The way in which a cavitation zone develops in a focused pulsed ultrasound field is studied in this work. Sonoluminescence (SL), total hydrophone output and cavitation noise spectra have been recorded across a gradual, smooth increase in applied voltage. It is shown that the cavitation zone passes through a number of stages of evolution, according to increasing ultrasound intensity, decreasing pulse period and increasing ultrasound pulse duration. Sonoluminescence is absent in the first phase and the hydrophone output spectra consists of a main line with two or three harmonics whose intensity is much lower than that of the main (fundamental) line. The second stage sees the onset of SL whose intensity increases smoothly and is accompanied by the appearance of higher harmonics and subharmonics in the cavitation noise spectra. In some cases, the wide-band (WBN) component can be seen in noise spectra during the final part of the second stage. In the third stage, SL intensity increases significantly and often quite sharply, while WBN intensity increases in the same manner. This is accompanied by a synchronous increase in the absorption of ultrasound by the cavitation zone, which is manifested in a sharp decrease in the hydrophone output. In the fourth stage, both SL and WBN intensities tend to decrease despite the increased voltage applied to the transducer. Furthermore, the fundamental line tends to decrease in strength as well, despite the increasing ultrasound intensity. The obtained results clearly identify the different stages of cavitation zone development using cavitation noise spectra analyses. We then hypothesize that three of the above stages may be responsible for three known types of ultrasound action on biological cells: damping viability, reversible cell damage (sonoporation) and irreversible damage/cytotoxicity. Copyright © 2017 Elsevier B.V. All rights reserved.

  14. Plant phenolics and absorption features in vegetation reflectance spectra near 1.66 μm (United States)

    Kokaly, Raymond F.; Skidmore, Andrew K.


    Past laboratory and field studies have quantified phenolic substances in vegetative matter from reflectance measurements for understanding plant response to herbivores and insect predation. Past remote sensing studies on phenolics have evaluated crop quality and vegetation patterns caused by bedrock geology and associated variations in soil geochemistry. We examined spectra of pure phenolic compounds, common plant biochemical constituents, dry leaves, fresh leaves, and plant canopies for direct evidence of absorption features attributable to plant phenolics. Using spectral feature analysis with continuum removal, we observed that a narrow feature at 1.66 μm is persistent in spectra of manzanita, sumac, red maple, sugar maple, tea, and other species. This feature was consistent with absorption caused by aromatic Csbnd H bonds in the chemical structure of phenolic compounds and non-hydroxylated aromatics. Because of overlapping absorption by water, the feature was weaker in fresh leaf and canopy spectra compared to dry leaf measurements. Simple linear regressions of feature depth and feature area with polyphenol concentration in tea resulted in high correlations and low errors (% phenol by dry weight) at the dry leaf (r2 = 0.95, RMSE = 1.0%, n = 56), fresh leaf (r2 = 0.79, RMSE = 2.1%, n = 56), and canopy (r2 = 0.78, RMSE = 1.0%, n = 13) levels of measurement. Spectra of leaves, needles, and canopies of big sagebrush and evergreens exhibited a weak absorption feature centered near 1.63 μm, short ward of the phenolic compounds, possibly consistent with terpenes. This study demonstrates that subtle variation in vegetation spectra in the shortwave infrared can directly indicate biochemical constituents and be used to quantify them. Phenolics are of lesser abundance compared to the major plant constituents but, nonetheless, have important plant functions and ecological significance. Additional research is needed to advance our understanding of the spectral influences

  15. Improved quantitative analysis of spectra using a new method of obtaining derivative spectra based on a singular perturbation technique. (United States)

    Li, Zhigang; Wang, Qiaoyun; Lv, Jiangtao; Ma, Zhenhe; Yang, Linjuan


    Spectroscopy is often applied when a rapid quantitative analysis is required, but one challenge is the translation of raw spectra into a final analysis. Derivative spectra are often used as a preliminary preprocessing step to resolve overlapping signals, enhance signal properties, and suppress unwanted spectral features that arise due to non-ideal instrument and sample properties. In this study, to improve quantitative analysis of near-infrared spectra, derivatives of noisy raw spectral data need to be estimated with high accuracy. A new spectral estimator based on singular perturbation technique, called the singular perturbation spectra estimator (SPSE), is presented, and the stability analysis of the estimator is given. Theoretical analysis and simulation experimental results confirm that the derivatives can be estimated with high accuracy using this estimator. Furthermore, the effectiveness of the estimator for processing noisy infrared spectra is evaluated using the analysis of beer spectra. The derivative spectra of the beer and the marzipan are used to build the calibration model using partial least squares (PLS) modeling. The results show that the PLS based on the new estimator can achieve better performance compared with the Savitzky-Golay algorithm and can serve as an alternative choice for quantitative analytical applications.

  16. Linear discriminant analysis of brain tumour (1)H MR spectra: a comparison of classification using whole spectra versus metabolite quantification. (United States)

    Opstad, K S; Ladroue, C; Bell, B A; Griffiths, J R; Howe, F A


    (1)H MRS is an attractive choice for non-invasively diagnosing brain tumours. Many studies have been performed to create an objective decision support system, but there is not yet a consensus as to the best techniques of MRS acquisition or data processing to be used for optimum classification. In this study, we investigate whether LCModel analysis of short-TE (30 ms), single-voxel tumour spectra provide a better input for classification than the use of the original spectra. A total of 145 histologically diagnosed brain tumour spectra were acquired [14 astrocytoma grade II (AS2), 15 astrocytoma grade III (AS3), 42 glioblastoma (GBM), 41 metastases (MET) and 33 meningioma (MNG)], and linear discriminant analyses (LDA) were performed on the LCModel analysis of the spectra and the original spectra. The results consistently suggest improvement in classification when the LCModel concentrations are used. LDA of AS2, MNG and high-grade tumours (HG, comprising GBM and MET) correctly classified 94% using the LCModel dataset compared with 93% using the spectral dataset. The inclusion of AS3 reduced the accuracy to 82% and 78% for LCModel analysis and the original spectra, respectively, and further separating HG into GBM and MET gave 70% compared with 60%. Generally MNG spectra have profiles that are visually distinct from those of the other tumour types, but the classification accuracy was typically about 80%, with MNG with substantial lipid/macromolecule signals being classified as HG. Omission of the lipid/macromolecule concentrations in the LCModel dataset provided an improvement in classification of MNG (91% compared with 76%). In conclusion, there appears to be an advantage to performing pattern recognition on the quantitative analysis of tumour spectra rather than using the whole spectra. However, the results suggest that a two-step LDA process may help in classifying the five tumour groups to provide optimum classification of MNG with high lipid

  17. Microscopic study of low-lying yrast spectra and deformation ...

    Indian Academy of Sciences (India)

    Bogoliubov (HB) ansatz have been carried out for = 98–106 strontium isotopes. In this framework, the yrast spectra with ≥ 10+, (2) transition probabilities, quadrupole deformation parameter and occupation numbers for various shell model ...


    National Aeronautics and Space Administration — This data set contains low-resolution (R~150) near-infrared (0.7-2.5 microns) spectra of 90 main belt asteroids observed with the SpeX instrument on the NASA...


    National Aeronautics and Space Administration — This data volume contains radiometrically corrected point spectra of asteroid 951 as acquired by the Galileo spacecraft Near Infrared Mapping Spectrometer (NIMS) on...


    National Aeronautics and Space Administration — This dataset contains calibrated, 1.05- to 4.8-micron spectra of Earth acquired by the High Resolution Infrared Spectrometer (HRII) during the EPOCh and Cruise 2...

  1. Epoxi Inflight Calibrations - Hrii Raw Spectra V2.0 (United States)

    McLaughlin, S. A.; Carcich, B.; Sackett, S. E.; Klaasen, K. P.; Wellnitz, D. D.


    This dataset contains raw calibration spectra acquired by the High Resolution Infrared Spectrometer (HRII) from 04 October 2007 through 07 February 2011 during the EPOCh, 103P/Hartley 2 Encounter, and cruise phases of the EPOXI mission.

  2. Nonpolynomial approximation of background in X-ray spectra (United States)

    Kajfosz, J.; Kwiatek, W. M.


    A simple method for the calculation and subtraction of background from Si(Li) X-ray spectra prior to their least-squares fitting is described. Its properties are discussed and examples of its usage are shown.


    National Aeronautics and Space Administration — This data set contains reduced composite visual and near-infrared spectra of thirty M-type asteroids, observed over the years 2004-2008 and presented in Fornasier et...

  4. Electronic and vibrational circular dichroism spectra of (R)-(-)-apomorphine

    Energy Technology Data Exchange (ETDEWEB)

    Abbate, Sergio, E-mail: [Dipartimento di Scienze Biomediche e Biotecnologie, Universita di Brescia, Viale Europa 11, 25123 Brescia (Italy); CNISM, Consorzio Interuniversitario Scienze Fisiche della Materia, Via della Vasca Navale 84, 00146 Roma (Italy); Longhi, Giovanna; Lebon, France [Dipartimento di Scienze Biomediche e Biotecnologie, Universita di Brescia, Viale Europa 11, 25123 Brescia (Italy); CNISM, Consorzio Interuniversitario Scienze Fisiche della Materia, Via della Vasca Navale 84, 00146 Roma (Italy); Tommasini, Matteo [Dipartimento di Chimica, Materiali e Ingegneria Chimica ' G. Natta' , Politecnico di Milano, Piazza Leonardo da Vinci 32, 20133 Milano (Italy); Consorzio Interuniversitario per la Scienza e Tecnologia dei Materiali (INSTM), Unita di Ricerca del Politecnico di Milano (Dip. CMIC), Piazza Leonardo da Vinci 32, 20133 Milano (Italy)


    Highlights: Black-Right-Pointing-Pointer ECD and VCD Spectra of (R)-(-)-apomorphine measured in various solvents. Black-Right-Pointing-Pointer DFT calculations allow to study the protonation state and conformations. Black-Right-Pointing-Pointer Contributions from catechol OH vibrations to the VCD spectra is studied. -- Abstract: Apomorphine is a chiral drug molecule; notwithstanding its extraordinary importance, little attention has been paid to the characterization of its chiroptical properties. Here we report on its electronic circular dichroism (ECD) spectra, recorded in methanol and water, and vibrational circular dichroism (VCD) in methanol and dimethyl sulfoxide (DMSO) solutions. Density functional theory (DFT) calculations have allowed us to interpret the spectra and to evaluate the role of possible conformations, charge-states and interactions with counter ions.

  5. TES/Aura L1B Spectra Nadir V003 (United States)

    National Aeronautics and Space Administration — The L1B Nadir granule consists of radiometrically calibrated spectra & associated NESR, observed at 0.1 cm-1 resolution for an entire Global Survey &...

  6. Velocity Spectra in the Unstable Planetary Boundary Layer

    DEFF Research Database (Denmark)

    Højstrup, Jørgen


    Models for velocity spectra of all three components in the lower half of the unstable PBL are presented. The model spectra are written as a sum of two parts, nS(n) = A(fi, z/zi)w*2 + B(f, z/zi)u*02, a mixed layer part with a stability dependence, and a surface layer part without stability...... dependence and with negligible influence of z/zi in B in the surface layer; A is independent of z/zi for the horizontal components. The model agrees very well with data for variances, peak frequencies and spectra from the Kansas and Minnesota experiments. Requirements for models of spectra in the upper half...

  7. Seedling Canopy Reflectance Spectra, 1992-1993 (ACCP) (United States)

    National Aeronautics and Space Administration — ABSTRACT: The reflectance spectra of Douglas-fir and bigleaf maple seedling canopies were measured. Canopies varied in fertilizer treatment and leaf area density...

  8. Infrared spectra of inorganic compounds (3800-45cm- 1)

    National Research Council Canada - National Science Library

    Nyquist, Richard A; Kagel, Ronald O; Kagel, Ron


    ... availability of low- cost infrared spectrometers. For these reasons, over the last 30 years large numbers of standard spectra of organic compounds have been collected and catalogued, and are presently available for reference...

  9. Identification of Swell in Nearshore Surface Wave Energy Spectra

    Directory of Open Access Journals (Sweden)

    Paul A. Work


    Full Text Available An approach for routine identification of swell and sea in nominally fully developed, omnidirectional, surface water wave energy spectra measured in arbitrary water depth is developed, applied, and discussed. The methodology is an extension of earlier work with deepwater spectra and involves identifying the frequency at which wave steepness is maximized and relating this to the swell separation frequency. The TMA parameterized spectrum is employed to establish a relationship between the two frequencies so that the methodology can be used when wind data are unavailable. The methodology is developed for finite water depth and tested using a dataset that includes both acoustic Doppler current profiler and wave buoy data, recorded simultaneously at the same location. For cases where the sea and swell are clearly, visually distinguishable in the omnidirectional spectra, the new method accurately distinguishes between the two, but it can also be used to identify sea and swell in unimodal spectra.

  10. Comparison of exit time moment spectra for extrinsic metric balls

    DEFF Research Database (Denmark)

    Hurtado, Ana; Markvorsen, Steen; Palmer, Vicente


    We prove explicit upper and lower bounds for the $L^1$-moment spectra for the Brownian motion exit time from extrinsic metric balls of submanifolds $P^m$ in ambient Riemannian spaces $N^n$. We assume that $P$ and $N$ both have controlled radial curvatures (mean curvature and sectional curvature......, respectively) as viewed from a pole in $N$. The bounds for the exit moment spectra are given in terms of the corresponding spectra for geodesic metric balls in suitably warped product model spaces. The bounds are sharp in the sense that equalities are obtained in characteristic cases. As a corollary we also...... obtain new intrinsic comparison results for the exit time spectra for metric balls in the ambient manifolds $N^n$ themselves....


    National Aeronautics and Space Administration — This dataset includes average near-infrared (NIR) reflectance spectra for 68 main-belt asteroids that were observed at the NASA Infrared Telescope Facility (IRTF),...

  12. Application of wavelet transform in γ-ray spectra analysis (United States)

    Yu, GuoLiang; Gu, JianZhong; Hou, Long; Li, ZhenYu; Wang, YanZhao; Zhang, YiYun


    The frequency distribution of different ingredients in γ-ray spectra, e.g., photo-peak, fluctuations of counts and Compton region, is separately analyzed. After wavelet transform of γ-ray spectra, the wavelet coefficients of a photo-peak increase with transforming scales and these coefficients show direct proportion with intensity of peak at determinate scale. A novel algorithm based on wavelet transform is proposed and studied. The results indicate that most of the photo-peaks in multi-spectra can be determined accurately, the γ-rays energy and intensity of the peak can also be determined. This method has the prospect of being applied in on-line multi-spectra analysis in such fields as radioprotection and nuclear safety monitoring.

  13. Calculating standard captured γ spectra of formation elements

    National Research Council Canada - National Science Library

    Wu Wensheng Xiao Lizhi Zhang Lijuan Niu Wei


    ... and its oxide.To compare the standard spectra from the elements and oxides,we operated three simulations of sandstone,limestone and mixed formation of sandstone and limestone each with ten different porosities...


    National Aeronautics and Space Administration — This data set set contains version 1.0 of calibrated, 1.05- to 4.8-micron spectra of Earth acquired by the High Resolution Infrared Spectrometer (HRII) during the...

  15. EPOXI EARTH OBS - HRII RAW SPECTRA V1.0 (United States)

    National Aeronautics and Space Administration — This data set set contains version 1.0 of raw, 1.05- to 4.8-micron spectra of Earth acquired by the High Resolution Infrared Spectrometer (HRII) during the EPOCh...


    National Aeronautics and Space Administration — This data set contains raw calibration spectra acquired by the Deep Impact High Resolution Infrared Spectrometer from 04 October 2007 through 08 October 2008 for the...

  17. EPOXI MARS OBS - HRII RAW SPECTRA V1.0 (United States)

    National Aeronautics and Space Administration — This data set contains raw, 1.05- to 4.8-micron spectra of Mars acquired by the High Resolution Infrared Spectrometer (HRII) for the EPOCh project during the second...


    National Aeronautics and Space Administration — This dataset contains calibrated, 1.05- to 4.8-micron spectra of Mars acquired by the High Resolution Infrared Spectrometer (HRII) for the EPOCh project during the...


    National Aeronautics and Space Administration — This dataset contains raw calibration spectra acquired by the High Resolution Infrared Spectrometer (HRII) from 04 October 2007 through 07 February 2011 during the...

  20. Zn-VI quasiparticle gaps and optical spectra from many-body calculations (United States)

    Riefer, A.; Weber, N.; Mund, J.; Yakovlev, D. R.; Bayer, M.; Schindlmayr, Arno; Meier, C.; Schmidt, W. G.


    The electronic band structures of hexagonal ZnO and cubic ZnS, ZnSe, and ZnTe compounds are determined within hybrid-density-functional theory and quasiparticle calculations. It is found that the band-edge energies calculated on the {{G}0}{{W}0} (Zn chalcogenides) or GW (ZnO) level of theory agree well with experiment, while fully self-consistent QSGW calculations are required for the correct description of the Zn 3d bands. The quasiparticle band structures are used to calculate the linear response and second-harmonic-generation (SHG) spectra of the Zn-VI compounds. Excitonic effects in the optical absorption are accounted for within the Bethe-Salpeter approach. The calculated spectra are discussed in the context of previous experimental data and present SHG measurements for ZnO.

  1. Epoxi Mars Obs - Hrii Raw Spectra V1.0 (United States)

    McLaughlin, S. A.; Carcich, B.; Deming, D.; Livengood, T.; Klaasen, K. P.; Wellnitz, D. D.


    This data set contains raw, 1.05- to 4.8-micron spectra of Mars acquired by the High Resolution Infrared Spectrometer (HRII) for the EPOCh project during the second cruise phase of the EPOXI mission. One set of observations was acquired on 20-21 November 2009 to characterize Mars as an analog for extrasolar planets. The observing period lasted approximately 24 hours, and spectra were acquired twice per hour.

  2. Naturally enhanced ion-acoustic spectra and their interpretation

    DEFF Research Database (Denmark)

    Sedgemore-Schulthess, K.J.F.; St. Maurice, J.P.


    Incoherent scatter radars are designed to detect scatter from thermal fluctuations in the ionosphere. These fluctuations contain, among other things, features associated with ion-acoustic waves driven by random motions within the plasma. The resulting spectra are generally broad and noisy...... of literature documenting observations of naturally enhanced ion-acoustic spectra, observed mainly along the geomagnetic field direction, along with a discussion of the theories put forward to explain such phenomena....

  3. Multivariate analysis of light scattering spectra of liquid dairy products (United States)

    Khodasevich, M. A.


    Visible light scattering spectra from the surface layer of samples of commercial liquid dairy products are recorded with a colorimeter. The principal component method is used to analyze these spectra. Vectors representing the samples of dairy products in a multidimensional space of spectral counts are projected onto a three-dimensional subspace of principal components. The magnitudes of these projections are found to depend on the type of dairy product.

  4. Neutron spectra and dosimetric assessment around a neutron Howitzer container


    Barros, Silvia; Gallego Díaz, Eduardo F.; Lorente Fillol, Alfredo; Gonçalves, Isabel F.; Vaz, Pedro; Vega-Carrillo, Héctor René; Zankl, María


    The neutron Howitzer container at the Neutron Measurements Laboratory of the Nuclear Engineering Department of the Polytechnic University of Madrid (UPM), is equipped with a 241Am-Be neutron source of 74 GBq in its center. The container allows the source to be in either the irradiation or the storage position. To measure the neutron fluence rate spectra around the Howitzer container, measurements were performed using a Bonner spheres spectrometer and the spectra were unfolded using the NSDann...

  5. Interpretation of Tandem Mass Spectrometry (MSMS) Spectra for Peptide Analysis

    DEFF Research Database (Denmark)

    Hjernø, Karin; Højrup, Peter


    The aim of this chapter is to give a short introduction to peptide analysis by mass spectrometry (MS) and interpretation of fragment mass spectra. Through examples and guidelines we demonstrate how to understand and validate search results and how to perform de novo sequencing based on the often ...... very complex fragmentation pattern obtained by tandem mass spectrometry (also referred to as MSMS). The focus is on simple rules for interpretation of MSMS spectra of tryptic as well as non-tryptic peptides....

  6. Laboratory spectra of C60 and related molecular structures (United States)

    Janca, J.; Solc, M.; Vetesnik, M.


    The electronic spectra of fullerene structures in high frequency discharge are studied in the plasma chemistry laboratory of the Faculty of Science of Masaryk University in Brno. The ultraviolet and visual spectra are investigated in order to be compared with the diffuse interstellar bands and interpreted within the theory of quantum mechanics. The preliminary results of the study are presented here in the form of a poster.

  7. How to measure CMB polarization power spectra without losing information


    Tegmark, Max; de Oliveira-Costa, Angelica


    We present a method for measuring CMB polarization power spectra given incomplete sky coverage and test it with simulated examples such as Boomerang 2001 and MAP. By augmenting the quadratic estimator method with an additional step, we find that the E and B power spectra can be effectively disentangled on angular scales substantially smaller than the width of the sky patch in the narrowest direction. We find that the basic quadratic and maximum-likelihood methods display a unneccesary sensiti...

  8. Evaluation of burst-mode LDA spectra with implications (United States)

    Velte, Clara; George, William


    Burst-mode LDA spectra, as described in [1], are compared to spectra obtained from corresponding HWA measurements using the FFT in a round jet and cylinder wake experiment. The phrase ``burst-mode LDA'' refers to an LDA which operates with at most one particle present in the measuring volume at a time. Due to the random sampling and velocity bias of the LDA signal, the Direct Fourier Transform with accompanying weighting by the measured residence times was applied to obtain a correct interpretation of the spectral estimate. Further, the self-noise was removed as described in [2]. In addition, resulting spectra from common interpolation and uniform resampling techniques are compared to the above mentioned estimates. The burst-mode LDA spectra are seen to concur well with the HWA spectra up to the emergence of the noise floor, caused mainly by the intermittency of the LDA signal. The interpolated and resampled counterparts yield unphysical spectra, which are buried in frequency dependent noise and step noise, except at very high LDA data rates where they perform well up to a limited frequency.[4pt] [1] Buchhave, P. PhD Thesis, SUNY/Buffalo, 1979.[0pt] [2] Velte, C.M. PhD Thesis, DTU/Copenhagen, 2009.

  9. Cluster analysis on mass spectra of biogenic secondary organic aerosol (United States)

    Spindler, C.; Kiendler-Scharr, A.; Kleist, E.; Mensah, A.; Mentel, T.; Tillmann, R.; Wildt, J.


    Biogenic secondary organic aerosols (BSOA) are of high importance in the atmosphere. The formation of SOA from the volatile organic compound (VOC) emissions of selected trees was investigated in the JPAC (Jülich Plant Aerosol Chamber) facility. The VOC (mainly monoterpenes) were transferred into a reaction chamber where vapors were photo-chemically oxidized and formed BSOA. The aerosol was characterized by aerosol mass spectrometry (Aerodyne Quadrupol-AMS). Inside the AMS, flash-vaporization of the aerosol particles and electron impact ionization of the evaporated molecules cause a high fragmentation of the organic compounds. Here, we present a classification of the aerosol mass spectra via cluster analysis. Average mass spectra are produced by combination of related single mass spectra to so-called clusters. The mass spectra were similar due to the similarity of the precursor substances. However, we can show that there are differences in the BSOA mass spectra of different tree species. Furthermore we can distinguish the influence of the precursor chemistry and chemical aging. BSOA formed from plants exposed to stress can be distinguished from BSOA formed under non stressed conditions. Significance and limitations of the clustering method for very similar mass spectra will be demonstrated and discussed.

  10. LSD-based analysis of high-resolution stellar spectra (United States)

    Tsymbal, V.; Tkachenko, A.; Van, Reeth T.


    We present a generalization of the method of least-squares deconvolution (LSD), a powerful tool for extracting high S/N average line profiles from stellar spectra. The generalization of the method is effected by extending it towards the multiprofile LSD and by introducing the possibility to correct the line strengths from the initial mask. We illustrate the new approach by two examples: (a) the detection of astroseismic signatures from low S/N spectra of single stars, and (b) disentangling spectra of multiple stellar objects. The analysis is applied to spectra obtained with 2-m class telescopes in the course of spectroscopic ground-based support for space missions such as CoRoT and Kepler. Usually, rather high S/N is required, so smaller telescopes can only compete successfully with more advanced ones when one can apply a technique that enables a remarkable increase in the S/N of the spectra which they observe. Since the LSD profiles have a potential for reconstruction what is common in all the spectral profiles, it should have a particular practical application to faint stars observed with 2-m class telescopes and whose spectra show remarkable LPVs.

  11. Simulation of Photon energy Spectra Using MISC, SOURCES, MCNP and GADRAS

    Energy Technology Data Exchange (ETDEWEB)

    Tucker, Lucas P. [Los Alamos National Laboratory; Shores, Erik F. [Los Alamos National Laboratory; Myers, Steven C. [Los Alamos National Laboratory; Felsher, Paul D. [Los Alamos National Laboratory; Garner, Scott E. [Los Alamos National Laboratory; Solomon, Clell J. Jr. [Los Alamos National Laboratory


    The detector response functions included in the Gamma Detector Response and Analysis Software (GADRAS) are a valuable resource for simulating radioactive source emission spectra. Application of these response functions to the results of three-dimensional transport calculations is a useful modeling capability. Using a 26.2 kg shell of depleted uranium (DU) as a simple test problem, this work illustrates a method for manipulating current tally results from MCNP into the GAM file format necessary for a practical link to GADRAS detector response functions. MISC (MCNP Intrinsic Source Constructor) and SOURCES 4C were used to develop photon and neutron source terms for subsequent MCNP transport, and the resultant spectrum is shown to be in good agreement with that from GADRAS. A 1 kg DU sphere was also modeled with the method described here and showed similarly encouraging results.

  12. Evaluation of polybutadiene rubbers using FTIR spectra

    Energy Technology Data Exchange (ETDEWEB)

    Oliveira, L.N.; Schimidt, F., E-mail: [Instituto Federal de Educacao, Ciencia e Tecnologia de Goias (IFG), Goiania, GO (Brazil); Antonio, P.L.; Caldas, L.V.E. [Instituto de Pesquisas Energeticas e Nucleares (IPEN/CNEN-SP), Sao Paulo, SP (Brazil); Vieira, S.L. [Universidade Federal de Goias (UFG), Goiania, GO (Brazil). Instituto de Fisica


    Radiation dosimetry for medical and industrial purposes has increasingly evolved over the last few decades with the introduction of various new detectors. Depending on the properties exhibited for radiation dosimetry, some detectors present their applications in a specific area. From a physics point of view, an ideal dosimeter should be able to measure absorbed dose. In this work, synthetic materials based on polybutadiene rubbers (PBR) were proposed as a new class of radiation detectors. The influence of radiation dose on their properties has been investigated for application in radiation dosimetry. The rubber samples were exposed to absorbed doses from 10 Gy up to 250 Gy, using a {sup 60}Co Gamma Cell-220 system. Their responses were carried out with a Fourier Transform Infrared (FTIR) Spectrometer to investigate the presence of absorbance peaks. The results suggested the existence of a relationship between the absorbed doses and the absorbance peaks associated with stretching (1300-1200 cm{sup -1}), deformation (1450-1340 cm{sup -1}) and vibration (1500-1400 cm{sup -1}) processes in the material. (author)

  13. Generalized Graphs, Methods for Obtaining Graph Spectra. Application of Graph Spectra in Chemistry (United States)

    Shen, Mingzuo

    Various graphical methods in the literature for getting at some features of the MO energy level spectra of especially pi systems and some related three-dimensional molecules are studied in detail. These include the graphical methods of Sinanoglu (although its mathematical, quantum-physical foundations, e.g. Sinanoglu's structural-covariance theory, are not discussed in this thesis), the edge-deletion method of Jiang, the specialized method of Sheng for benzenoid graphs, pairing theorems, graph splitting methods of e.g. McClelland, and more general one of R. A. Davidson. Of these the Sinanoglu method is found to be the only one generally applicable to diverse types of molecules without the need to introduce additional and complicated rules for each new graph type. The Sinanoglu method however is intended to be only a qualitative tool (giving the number of bonding, nonbonding, and antibonding levels and their changes upon reaction or geometrical distortions, large or small, of the molecule). Thus the other methods, although highly specialized, could be of help in getting some further information on the spectra. In particular, the "negative graph" concept in Chapter 3 of this thesis would be found useful in ascertaining the energy gap between the lowest and highest MO levels. In case where the Sinanoglu method cannot distinguish between differing stabilities of two molecules with the same signature and number of elections, this energy gap will be particularly useful. In the thesis, many alternative and simpler derivations of the graph-theoretic methods of Jiang, Davidson and others mentioned above are given. Some methods are generalized further. In the last chapter of the thesis starting with S 5.3, the graphical method is applied extensively to various types of molecules thought to have through-space interactions. Especially the Sinanoglu method is used to obtain the signature (instead of using a computer) and qualitative stabilities of these molecules are discussed

  14. Analysis of the high resolution Mg XI X-ray spectra. Pt. 3. Non-thermal interpretation of some spectra

    Energy Technology Data Exchange (ETDEWEB)

    Siarkowski, M.; Sylwester, J. (Polska Akademia Nauk, Wroclaw. Centrum Badan Kosmicznych); Bromboszcs, G. (Wroclaw Univ. (Poland). Obserwatorium Astronomiczne); Korneev, V.V.; Mandelshtam, S.L.; Oparin, S.N.; Urnov, A.M.; Zhitnik, I.A. (AN SSSR, Moscow. Fizicheskij Inst.)


    In part III of the paper containing the analysis of the INTERCOSMOS 16 ADP spectra, it is shown that by assuming the existence of a small admixture (1%) of non-thermal electrons in the active-region plasma it is possible to improve the agreement between measured and calculated fluxes for some spectra. The analysis follows the suggestion contained in the paper by Karev et al. (1980).

  15. Infrared spectra of (HCOOH)(2) and (DCOOH)(2) in rare gas matrices: a comparative study with gas phase spectra. (United States)

    Ito, Fumiyuki


    Infrared absorption spectra of (HCOOH)(2) and (DCOOH)(2) in solid argon, krypton, and xenon matrices have been measured and each fundamental band has been assigned. Spectra in Ar and Kr matrices showed notable splitting in contrast to those in Xe, which suggests a difference in structure of the trapping sites. A comparison with the reported jet-cooled spectra has shown that vibrational structures of the spectra of (HCOOH)(2) and (DCOOH)(2) in the O-H stretching region are preserved in the matrices. On the other hand, the C-O stretching band of (HCOOH)(2) shows a drastic change upon matrix isolation, wherein the Fermi-triad feature observed in gas phase [F. Ito, Chem. Phys. Lett. 447, 202 (2007)] could not be identified. No substantial change of the vibrational structure has been found for matrix-isolated (DCOOH)(2). The differences of the vibrational structures in the matrix-isolation spectra and in the jet-cooled spectra have been qualitatively accounted for using the idea of anharmonic couplings among "matrix-shifted harmonic states."

  16. On signatures of clouds in exoplanetary transit spectra (United States)

    Pinhas, Arazi; Madhusudhan, Nikku


    Transmission spectra of exoplanetary atmospheres have been used to infer the presence of clouds/hazes. Such inferences are typically based on spectral slopes in the optical deviant from gaseous Rayleigh scattering or low-amplitude spectral features in the infrared. We investigate three observable metrics that could allow constraints on cloud properties from transmission spectra, namely the optical slope, the uniformity of this slope and condensate features in the infrared. We derive these metrics using model transmission spectra considering Mie extinction from a wide range of condensate species, particle sizes and scaleheights. First, we investigate possible degeneracies among the cloud properties for an observed slope. We find, for example, that spectra with very steep optical slopes suggest sulphide clouds (e.g. MnS, ZnS, Na2S) in the atmospheres. Secondly, (non)uniformities in optical slopes provide additional constraints on cloud properties, e.g. MnS, ZnS, TiO2 and Fe2O3 have significantly non-uniform slopes. Thirdly, infrared spectra provide an additional powerful probe into cloud properties, with SiO2, Fe2O3, Mg2SiO4 and MgSiO3 bearing strong infrared features observable with James Webb Space Telescope. We investigate observed spectra of eight hot Jupiters and discuss their implications. In particular, no single or composite condensate species considered here conforms to the steep and non-uniform optical slope observed for HD 189733b. Our work highlights the importance of the three above metrics to investigate cloud properties in exoplanetary atmospheres using high-precision transmission spectra and detailed cloud models. We make our Mie scattering data for condensates publicly available to the community.

  17. [The NIR spectra based variety discrimination for single soybean seed]. (United States)

    Zhu, Da-Zhou; Wang, Kun; Zhou, Guang-Hua; Hou, Rui-Feng; Wang, Cheng


    With the development of soybean producing and processing, the quality breeding becomes more and more important for soybean breeders. Traditional sampling detection methods for soybean quality need to destroy the seed, and does not satisfy the requirement of earlier generation materials sieving for breeding. Near infrared (NIR) spectroscopy has been widely used for soybean quality detection. However, all these applications were referred to mass samples, and they were not suitable for little or single seed detection in breeding procedure. In the present study, the acousto--optic tunable filter (AOTF) NIR spectroscopy was used to measure the single soybean seed. Two varieties of soybean were measured, which contained 60 KENJIANDOU43 seeds and 60 ZHONGHUANG13 seeds. The results showed that NIR spectra combined with soft independent modeling of class analogy (SIMCA) could accurately discriminate the soybean varieties. The classification accuracy for KENJIANDOU43 seeds and ZHONGHUANG13 was 100%. The spectra of single soybean seed were measured at different positions, and it showed that the seed shape has significant influence on the measurement of spectra, therefore, the key point for single seed measurement was how to accurately acquire the spectra and keep their representativeness. The spectra for soybeans with glossy surface had high repeatability, while the spectra of seeds with external defects had significant difference for several measurements. For the fast sieving of earlier generation materials in breeding, one could firstly eliminate the seeds with external defects, then apply NIR spectra for internal quality detection, and in this way the influence of seed shape and external defects could be reduced.

  18. Biaxial shear/tension failure criteria of spectra single fibers (United States)

    Sun, Jianzhuo

    An experimental study was conducted to develop the biaxial failure surface criteria of single Spectra 130d and 100d filaments in a torsion-tension environment. The cross-sectional profiles of single Spectra fibers were investigated using scanning electron microscopy and X-ray computed tomography. A pin-gripping method to fix the ends of a polyethylene single fiber was developed. Effects of pin diameter on failure stress for both Spectra 130d and 100d were characterized. It was found that the perturbed stress field effect can be neglected when the pin diameter is larger than 0.8 mm. Additionally, the effect of the sample's gage length on fiber tensile strength was investigated. The gage length of 5.5 mm was determined as an appropriate length for single fiber samples under stress-wave loading. A twisting apparatus was built for a single fiber to achieve specific degrees of shear strains. Quasi-static experiments were conducted using an MTS servo-hydraulic system to apply tensile loads on pre-twisted Spectra fibers. A tension Kolsky bar was employed to study the biaxial shear/tensile behavior of Spectra fibers at high strain rates. A decreasing trend of tensile strength, with increasing torsional strain, for Spectra fibers was observed. Furthermore, a torsional pendulum apparatus was developed to determine the torsional shear stresses in fibers at various levels of axial loading. The relationship between apparent shear stress and axial stress was discovered. Finally, a biaxial shear/tension failure criterion envelope of each of the Spectra fibers was established. Scanning electron microscopy images revealed the specific feature on the surface of twisted fibers and fracture surface of failure fibers.

  19. INTRIGOSS: A new Library of High Resolution Synthetic Spectra (United States)

    Franchini, Mariagrazia; Morossi, Carlo; Di Marcancantonio, Paolo; Chavez, Miguel; GES-Builders


    INTRIGOSS (INaf Trieste Grid Of Synthetic Spectra) is a new High Resolution (HiRes) synthetic spectral library designed for studying F, G, and K stars. The library is based on atmosphere models computed with specified individual element abundances via ATLAS12 code. Normalized SPectra (NSP) and surface Flux SPectra (FSP), in the 4800-5400 Å wavelength range, were computed by means of the SPECTRUM code. The synthetic spectra are computed with an atomic and bi-atomic molecular line list including "bona fide" Predicted Lines (PLs) built by tuning loggf to reproduce very high SNR Solar spectrum and the UVES-U580 spectra of five cool giants extracted from the Gaia-ESO survey (GES). The astrophysical gf-values were then assessed by using more than 2000 stars with homogenous and accurate atmosphere parameters and detailed chemical composition from GES. The validity and greater accuracy of INTRIGOSS NSPs and FSPs with respect to other available spectral libraries is discussed. INTRIGOSS will be available on the web and will be a valuable tool for both stellar atmospheric parameters and stellar population studies.

  20. First light with Trident: multi-platform synthetic quasar spectra (United States)

    Silvia, Devin W.; Hummels, Cameron B.; Smith, Britton


    Observational efforts to better understand the nature of the intergalactic and circumgalactic media have relied heavily on the information encoded in the absorption line systems of quasar spectra. Numerical simulations of large-scale structure and galaxy evolution are well-suited to explore the properties of those same media owing to the relative ease with which one can access physical quantities from complex, three-dimensional data. However, a difficulty arises when one tries to make direct “apple-to-apples” comparisons between observed spectra and simulated data. In an effort to provide a common language capable of linking theory and observation, we announce the release of Trident. Trident is a publicly available software tool that enables the creation of realistic synthetic absorption spectra from virtually all widely-used hydrodynamics simulation codes. Through user-controlled levels of spectral realism, direct comparisons between simulated and observed data become not only possible, but greatly simplified. We present the methods for extracting artificial quasar sightlines and generating spectra as well as early-stage applications of those spectra to intergalactic and circumgalactic absorption line studies.

  1. Effect of green light spectra on the reduction of retinal damage and stress in goldfish, Carassius auratus

    Energy Technology Data Exchange (ETDEWEB)

    Song, Jin Ah; Kim, Na Na; Choi, Young Jae; Choi, Cheol Young, E-mail:


    We investigated the effect of light spectra on retinal damage and stress in goldfish using green (530 nm) and red (620 nm) light emitting diodes (LEDs) at three intensities each (0.5, 1.0, and 1.5 W/m{sup 2}). We measured the change in the levels of plasma cortisol and H{sub 2}O{sub 2} and expression and levels of caspase-3. The apoptotic response of green and red LED spectra was assessed using the terminal transferase dUTP nick end labeling (TUNEL) assay. Stress indicator (cortisol and H{sub 2}O{sub 2}) and apoptosis-related genes (caspase-3) decreased in green light, but increased in red light with higher light intensities over time. The TUNEL assay revealed that more apoptotic cells were detected in outer nuclear layers after exposure to red LED over time with the increase in light intensity, than the other spectra. These results indicate that green light efficiently reduces retinal damage and stress, whereas red light induces it. Therefore, red light-induced retina damage may induce apoptosis in goldfish retina. -- Highlights: •Green light efficiently reduces retinal damage and stress. •Green spectra reduce caspase production and apoptosis. •Red light-induced retina damage may induce apoptosis in goldfish retina. •The retina of goldfish recognizes green spectra as a stable environment.

  2. The Analysis and Processing of Spectra with Splicing Abnormality in LAMOST Based on High Performance Computing Platform (United States)

    Meng, Fanlong; Pan, Jingchang; Yu, Jingjing


    Since the completion of LAMOST the observation had produced a large number of data, and officially released data. There are some poor quality spectra in the observation data and even the data released to the outside world. Splicing abnormal spectra is one kind of them. Splicing abnormality is poor continuity spectrum showed in the splicing wavelengths of the red and blue end. This problem can be caused by several factors, such as stability of instrument, observation condition, the response function, and so on. It has important effect on the research and analysis of spectra. It is of great significance to study the automatic identification of the splicing abnormal spectra. The method in this paper we first do the spectrum pretreatment, then the spectral was intercepted into red and blue in order to fit curves. For the two fitting curves, a series of wavelength points are selected to calculate the difference of these points. For the difference set, the statistical characteristics of the difference are analyzed, such as mean and standard deviation. Then we calculate the area of the two curves. Based on these values, we proposed an evaluation function. At the same time, we provided a method for detecting the splicing abnormal spectra based on the high performance computing platform. Through a lot of experiments, the efficiency was greatly improved compared to stand-alone.

  3. A generalized modal shock spectra method for spacecraft loads analysis. [internal loads in a spacecraft structure subjected to a dynamic launch environment (United States)

    Trubert, M.; Salama, M.


    Unlike an earlier shock spectra approach, generalization permits an accurate elastic interaction between the spacecraft and launch vehicle to obtain accurate bounds on the spacecraft response and structural loads. In addition, the modal response from a previous launch vehicle transient analysis with or without a dummy spacecraft - is exploited to define a modal impulse as a simple idealization of the actual forcing function. The idealized modal forcing function is then used to derive explicit expressions for an estimate of the bound on the spacecraft structural response and forces. Greater accuracy is achieved with the present method over the earlier shock spectra, while saving much computational effort over the transient analysis.

  4. Responsive hetero-organelle partition conferred fluorogenic sensing of mitochondrial depolarization† †Electronic supplementary information (ESI) available: Biodistribution of RC; cytotoxicity of RC-TPP; and analysis spectra of RC-TPP and RC. See DOI: 10.1039/c6sc04158b Click here for additional data file. (United States)

    Xue, Zhongwei; Zhao, Hu; Liu, Jian; Han, Jiahuai


    Malfunctioning organelles are often difficult to probe with classical organelle-homing sensors owing to disruption of physiological organelle-probe affinity. We herein report the use of a responsive hetero-organelle partition and signal activable probe (RC-TPP) for detecting mitochondrial depolarization, a pathologically relevant event featuring loss of the electrical potentials across the mitochondrial membrane (ΔΨ m). Partitioned in mitochondria to give blue fluorescence, RC-TPP relocates into lysosomes upon mitochondrial depolarization and exhibits red fluorescence triggered by lysosomal acidity, enabling determination of autophagy relevant mitochondrial depolarization and the chronological sequence of mitochondrial depolarization and lysosomal neutralization in distinct cell death signalling pathways. As an alternative to classic homo-organelle specific molecular systems, this hetero-organelle responsive approach provides a new perspective from which to study dysfunctional organelles. PMID:28451305

  5. On the Assessment of the Dynamic Response of Soils | Teferra ...

    African Journals Online (AJOL)

    The paper discusses two approaches for determining the dynamic response spectra of structures in which the effect of site conditions are taken into consideration. From the response spectra the estimation of maximum base shear is indicated. In light of the presented discussion, the earthquake loading as stipulaled in the ...

  6. Fluorescence spectra of blood and urine for cervical cancer detection (United States)

    Masilamani, Vadivel; AlSalhi, Mohamad Saleh; Vijmasi, Trinka; Govindarajan, Kanaganaj; Rathan Rai, Ram; Atif, Muhammad; Prasad, Saradh; Aldwayyan, Abdullah S.


    In the current study, the fluorescence emission spectra (FES) and Stokes shift spectra (SSS) of blood and urine samples of cervical cancer patients were obtained and compared to those of normal controls. Both spectra showed that the relative intensity of biomolecules such as porphyrin, collagen, Nicotinamide adenine dinucleotide, and flavin were quite out of proportion in cervical cancer patients. The biochemical mechanism for the elevation of these fluorophores is not yet definitive; nevertheless, these biomolecules could serve as tumor markers for diagnosis, screening, and follow-up of cervical cancers. To the best of our knowledge, this is the first report on FES and SSS of blood and urine of cervical cancer patients to give a sensitivity of 80% and specificity of 78%.

  7. Reflection spectra and magnetochemistry of iron oxides and natural surfaces (United States)

    Wasilewski, P.


    The magnetic properties and spectral characteristics of iron oxides are distinctive. Diagnostic features in reflectance spectra (0.5 to 2.4 micron) for alpha Fe2O3, gamma Fe2O3, and FeOOH include location of Fe3(+) absorption features, intensity ratios at various wavelengths, and the curve shape between 1.2 micron and 2.4 micron. The reflection spectrum of natural rock surfaces are seldom those of the bulk rock because of weathering effects. Coatings are found to be dominated by iron oxides and clay. A simple macroscopic model of rock spectra (based on concepts of stains and coatings) is considered adequate for interpretation of LANDSAT data. The magnetic properties of materials associated with specific spectral types and systematic changes in both spectra and magnetic properties are considered.

  8. Optical transmission spectra in quasiperiodic multilayered photonic structure

    Energy Technology Data Exchange (ETDEWEB)

    Medeiros, F F de [Departamento de Fisica, Universidade Federal do Rio Grande do Norte, 59072-970 Natal-RN (Brazil); Albuquerque, E L [Departamento de Fisica, Universidade Federal do Rio Grande do Norte, 59072-970 Natal-RN (Brazil); Vasconcelos, M S [Departamento de Ciencias Exatas, Centro Federal de Educacao Tecnologica do Maranhao, 65025-001 Sao LuIs-MA (Brazil)


    Optical transmission spectra in quasiperiodic multilayered photonic structures, composed of both positive (SiO{sub 2}) and negative refractive index materials, are calculated by using a theoretical model based on the transfer matrix approach for normal incidence geometry. The quasiperiodic structures are substitutional sequences, characterized by the nature of their Fourier spectrum, which can be dense pure point (e.g. Fibonacci sequence) or singular continuous (e.g. Thue-Morse and double-period sequences). The transmission spectra for the case where both refractive indices can be approximated by a different constant show a unique mirror symmetrical profile, with no counterpart for the positive refractive index case, as well as a striking self-similar behaviour related to the Fibonacci sequence. For a more realistic frequency-dependent refractive index, the transmission spectra are characterized by a rich transmission profile of Bragg peaks with no more self-similarity or mirror symmetry.

  9. On the fluctuation spectra of seismo-electromagnetic phenomena

    Directory of Open Access Journals (Sweden)

    M. Hayakawa


    Full Text Available In order to increase the credibility on the presence of electromagnetic phenomena associated with an earthquake, we have suggested the importance of the modulation (or fluctuation seen in the time-series data of any seismogenic effects. This paper reviews the fluctuation spectra of seismogenic phenomena in order to indicate the modulation mechanisms in the lithosphere, atmosphere and ionosphere/magnetosphere. Especially, the effect of Earth's tides in the lithosphere and the modulation in the atmosphere (acoustic and atmospheric gravity waves are discussed and this kind of fluctuation spectra would further provide essential information on the generation mechanisms of different seismogenic effects. Furthermore, the important role of the slope of fluctuation spectra is suggested in order to investigate the self-organized criticality before the lithospheric rupture and its associated effects in different regions such as the ionosphere.

  10. Vibrational spectra and DFT calculations of sonderianin diterpene (United States)

    Oliveira, I. M. M.; Santos, H. S.; Sena, D. M.; Cruz, B. G.; Teixeira, A. M. R.; Freire, P. T. C.; Braz-Filho, R.; Sousa, J. W.; Albuquerque, M. R. J. R.; Bandeira, P. N.; Bernardino, A. C. S. S.; Gusmão, G. O. M.; Bento, R. R. F.


    In the present study, the natural product sonderianin diterpene (C21H26O4), a diterpenoid isolated from Croton blanchetianus, with potential application in the drug industry, was characterized by nuclear magnetic resonance, infrared and Raman spectroscopy. Vibrational spectra were supported by Density Functional Theory calculations. Infrared and Raman spectra of sonderianin were recorded at ambient temperature in the regions from 400 cm-1 to 3600 cm-1 and from 40 cm-1 to 3500 cm-1, respectively. DFT calculations with the hybrid functional B3LYP and the basis set 6-31 G(d,p) were performed with the purpose of obtaining information on the structural and vibrational properties of this organic compound. A comparison with experimental spectra allowed us to assign all of the normal modes of the crystal. The assignment of the normal modes was carried out by means of potential energy distribution.

  11. Status of measurements of fission neutron spectra of Minor Actinides

    Energy Technology Data Exchange (ETDEWEB)

    Drapchinsky, L.; Shiryaev, B. [V.G. Khlopin Radium Inst., Saint Petersburg (Russian Federation)


    The report considers experimental and theoretical works on studying the energy spectra of prompt neutrons emitted in spontaneous fission and neutron induced fission of Minor Actinides. It is noted that neutron spectra investigations were done for only a small number of such nuclei, most measurements, except those of Cf-252, having been carried out long ago by obsolete methods and imperfectapparatus. The works have no detailed description of experiments, analysis of errors, detailed numerical information about results of experiments. A conclusion is made that the available data do not come up to modern requirements. It is necessary to make new measurements of fission prompt neutron spectra of transuranium nuclides important for the objectives of working out a conception of minor actinides transmutation by means of special reactors. (author)

  12. Information rates and power spectra of digital codes

    DEFF Research Database (Denmark)

    Justesen, Jørn


    is expressed in terms of the rate distortion function for a memoryless finite alphabet source and mean-square error distortion measure. A class of simple dc-free power spectra is considered in detail, and a method for constructing Markov sources with such spectra is derived. It is found that these sequences......The encoding of independent data symbols as a sequence of discrete amplitude, real variables with given power spectrum is considered. The maximum rate of such an encoding is determined by the achievable entropy of the discrete sequence with the given constraints. An upper bound to this entropy...... have greater entropies than most codes with similar spectra that have been suggested earlier, and that they often come close to the upper bound. When the constraint on the power spectrum is replaced by a constraint On the variance of the sum of the encoded symbols, a stronger upper bound to the rate...

  13. Random operators disorder effects on quantum spectra and dynamics

    CERN Document Server

    Aizenman, Michael


    This book provides an introduction to the mathematical theory of disorder effects on quantum spectra and dynamics. Topics covered range from the basic theory of spectra and dynamics of self-adjoint operators through Anderson localization-presented here via the fractional moment method, up to recent results on resonant delocalization. The subject's multifaceted presentation is organized into seventeen chapters, each focused on either a specific mathematical topic or on a demonstration of the theory's relevance to physics, e.g., its implications for the quantum Hall effect. The mathematical chapters include general relations of quantum spectra and dynamics, ergodicity and its implications, methods for establishing spectral and dynamical localization regimes, applications and properties of the Green function, its relation to the eigenfunction correlator, fractional moments of Herglotz-Pick functions, the phase diagram for tree graph operators, resonant delocalization, the spectral statistics conjecture, and rela...

  14. Computer simulation of RBS spectra from samples with surface roughness

    Energy Technology Data Exchange (ETDEWEB)

    Malinský, P., E-mail: [Nuclear Physics Institute of the Academy of Sciences of the Czech Republic, v. v. i., 250 68 Rez (Czech Republic); Department of Physics, Faculty of Science, J. E. Purkinje University, Ceske mladeze 8, 400 96 Usti nad Labem (Czech Republic); Hnatowicz, V., E-mail: [Nuclear Physics Institute of the Academy of Sciences of the Czech Republic, v. v. i., 250 68 Rez (Czech Republic); Macková, A., E-mail: [Nuclear Physics Institute of the Academy of Sciences of the Czech Republic, v. v. i., 250 68 Rez (Czech Republic); Department of Physics, Faculty of Science, J. E. Purkinje University, Ceske mladeze 8, 400 96 Usti nad Labem (Czech Republic)


    A fast code for the simulation of common RBS spectra including surface roughness effects has been written and tested on virtual samples comprising either a rough layer deposited on a smooth substrate or smooth layer deposited on a rough substrate and simulated at different geometries. The sample surface or interface relief has been described by a polyline and the simulated RBS spectrum has been obtained as the sum of many particular spectra from randomly chosen particle trajectories. The code includes several procedures generating virtual samples with random and regular (periodical) roughness. The shape of the RBS spectra has been found to change strongly with increasing sample roughness and an increasing angle of the incoming ion beam.

  15. Using Gaussian Processes to Construct Flexible Models of Stellar Spectra (United States)

    Czekala, Ian


    The use of spectra is fundamental to astrophysical fields ranging from exoplanets to stars to galaxies. In spite of this ubiquity, or perhaps because of it, there are a plethora of use cases that do not yet have physics-based forward models that can fit high signal-to-noise data to within the observational noise. These inadequacies result in subtle but systematic residuals not captured by any model, which complicates and biases parameter inference. Fortunately, the now-prevalent collection and archiving of large spectral datasets also provides an opening for empirical, data-driven approaches. We introduce one example of a time-series dataset of high-resolution stellar spectra, as is commonly delivered by planet-search radial velocity instruments like TRES, HIRES, and HARPS. Measurements of radial velocity variations of stars and their companions are essential for stellar and exoplanetary study; these measurements provide access to the fundamental physical properties that dictate all phases of stellar evolution and facilitate the quantitative study of planetary systems. In observations of a (spatially unresolved) spectroscopic binary star, one only ever records the composite sum of the spectra from the primary and secondary stars, complicating photospheric analysis of each individual star. Our technique “disentangles” the composite spectra by treating each underlying stellar spectrum as a Gaussian process, whose posterior predictive distribution is inferred simultaneously with the orbital parameters. To demonstrate the potential of this technique, we deploy it on red-optical time-series spectra of the mid-M-dwarf eclipsing binary LP661-13, which was recently discovered by the MEarth project. We successfully reconstruct the primary and secondary stellar spectra and report orbital parameters with improved precision compared to traditional radial velocity analysis techniques.

  16. Visual adaptation and the amplitude spectra of radiological images. (United States)

    Kompaniez-Dunigan, Elysse; Abbey, Craig K; Boone, John M; Webster, Michael A


    We examined how visual sensitivity and perception are affected by adaptation to the characteristic amplitude spectra of X-ray mammography images. Because of the transmissive nature of X-ray photons, these images have relatively more low-frequency variability than natural images, a difference that is captured by a steeper slope of the amplitude spectrum (~ - 1.5) compared to the ~ 1/f (slope of - 1) spectra common to natural scenes. Radiologists inspecting these images are therefore exposed to a different balance of spectral components, and we measured how this exposure might alter spatial vision. Observers (who were not radiologists) were adapted to images of normal mammograms or the same images sharpened by filtering the amplitude spectra to shallower slopes. Prior adaptation to the original mammograms significantly biased judgments of image focus relative to the sharpened images, demonstrating that the images are sufficient to induce substantial after-effects. The adaptation also induced strong losses in threshold contrast sensitivity that were selective for lower spatial frequencies, though these losses were very similar to the threshold changes induced by the sharpened images. Visual search for targets (Gaussian blobs) added to the images was also not differentially affected by adaptation to the original or sharper images. These results complement our previous studies examining how observers adapt to the textural properties or phase spectra of mammograms. Like the phase spectrum, adaptation to the amplitude spectrum of mammograms alters spatial sensitivity and visual judgments about the images. However, unlike the phase spectrum, adaptation to the amplitude spectra did not confer a selective performance advantage relative to more natural spectra.

  17. Excitation spectra of liquid iron up to superhigh temperatures (United States)

    Fomin, Yu D.; Ryzhov, V. N.; Tsiok, E. N.; Brazhkin, V. V.


    Investigation of excitation spectra of liquids is one of the hot test topics nowadays. In particular, recent experimental works showed that liquid metals can demonstrate transverse excitations and positive sound dispersion. However, the theoretical description of these experimental observations is still missing. Here we report a molecular dynamics study of excitation spectra of liquid iron. We compare the results with available experimental data to justify the method. After that we perform calculations for high temperatures to find the location of the Frenkel line introduced in our previous works.

  18. Chromatic signatures of broadband optical spectra for liquor discrimination (United States)

    Jones, G. R.; Deakin, A. G.; Spencer, J. W.


    Methods based upon chromatic analysis are described for quantifying broadband optical absorption spectra in discriminating between different types of liquors. The absorption spectra are quantified by three chromaticity coordinates, which can be represented by two points, one on each of two chromatic diagrams. Various types of liquors may then be distinguished on such chromatic maps and groups of similar samples conveniently identified. Examples of the deployment of the approach are given for distinguishing between and classifying various types, brands and mixtures of alcoholic beverages and for identifying an authentic brand. The method provides a high level of traceability and is not restricted to a particular type of optical spectrum.

  19. Effect of pyridine on infrared absorption spectra of copper phthalocyanine. (United States)

    Singh, Sukhwinder; Tripathi, S K; Saini, G S S


    Infrared absorption spectra of copper phthalocyanine in KBr pellet and pyridine solution in 400-1625 and 2900-3200 cm(-1)regions are reported. In the IR spectra of solid sample, presence of weak bands, which are forbidden according to the selection rules of D4h point group, is explained on the basis of distortion in the copper phthalocyanine molecule caused by the crystal packing effects. Observation of a new band at 1511 cm(-1) and change in intensity of some other bands in pyridine are interpreted on the basis of coordination of the solvent molecule with the central copper ion.

  20. Relating reflectance spectra space to Munsell color appearance space. (United States)

    Romney, A Kimball


    The goal is to construct a simple model relating the conceptually defined Munsell color space to a physical representation of the relationship among the reflectance spectra obtained from the color chips comprising the Munsell color atlas. In the model both the Munsell conceptual system and the transformed reflectance spectra are shown to be well represented in Euclidean space, and the two spaces are related by a simple linear transformation. A practical implication is that the method allows one to compare the location of an empirical reflectance spectrum with the aiming point in the conceptual structure.

  1. Classification and radiative-transfer modeling of meteorite spectra (United States)

    Pentikäinen, H.; Penttilä, A.; Peltoniemi, J.; Muinonen, K.


    The interpretation of asteroid spectra is closely tied to surface structure and composition. Asteroid surfaces are usually assumed to be covered with a regolith, which is a mixture of mineral grains ranging from micrometers to centimeters in size. The inverse problem of deducing the characteristics of the grains from the scattering of light (e.g., using photometric and polarimetric observations) is difficult. Meteorite spectroscopy can be a valuable alternative source of information considering that unweathered meteoritic ''falls'' are almost pristine samples of their parent bodies. Reflectance spectra of 18 different meteorite samples were measured with the Finnish Geodetic Institute Field Goniospectrometer (FIGIFIGO) covering a wavelength range of 450--2250 nm [1,2]. The measurements expand the database of reflectance spectra obtained by Paton et al. [3] and Gaffey [4]. Principal Component Analysis (PCA) performed on the spectra indicates a separation of the undifferentiated ordinary chondrites and the differentiated achondrites. The principal components also suggest a discrimination between the spectra of ordinary chondrites with petrologic grades 5 and 6. The distinction is not present when the data are supplemented with the spectra from the two other data sets obtained with differing measuring techniques. To further investigate the different classifications, the PCA is implemented with selected spectral features contrary to the previous analyses, which encompassed the complete spectra. Single-scattering albedos for meteoritic fundamental scatterers were derived with a Monte Carlo radiative-transfer model [1]. In the derivation, realistic scattering phase functions were utilized. The functions were obtained by fitting triple Henyey-Greenstein functions to the measured scattering phase functions of olivine powder for two different size distributions [5,6]. The simulated reflectances for different scattering phase functions were matched to the measured meteorite

  2. Model for Cumulative Solar Heavy Ion Energy and LET Spectra (United States)

    Xapsos, Mike; Barth, Janet; Stauffer, Craig; Jordan, Tom; Mewaldt, Richard


    A probabilistic model of cumulative solar heavy ion energy and lineary energy transfer (LET) spectra is developed for spacecraft design applications. Spectra are given as a function of confidence level, mission time period during solar maximum and shielding thickness. It is shown that long-term solar heavy ion fluxes exceed galactic cosmic ray fluxes during solar maximum for shielding levels of interest. Cumulative solar heavy ion fluences should therefore be accounted for in single event effects rate calculations and in the planning of space missions.

  3. High-resolution pyrimidine- and ribose-specific 4D HCCH-COSY spectra of RNA using the filter diagonalization method

    Energy Technology Data Exchange (ETDEWEB)

    Douglas, Justin T.; Latham, Michael P.; Armstrong, Geoffrey S. [University of Colorado, Department of Chemistry and Biochemistry, 215 UCB (United States); Bendiak, Brad [University of Colorado Health Sciences Center, Department of Cell and Developmental Biology and Biomolecular Structure Program (United States); Pardi, Arthur [University of Colorado, Department of Chemistry and Biochemistry, 215 UCB (United States)], E-mail:


    The NMR spectra of nucleic acids suffer from severe peak overlap, which complicates resonance assignments. 4D NMR experiments can overcome much of the degeneracy in 2D and 3D spectra; however, the linear increase in acquisition time with each new dimension makes it impractical to acquire high-resolution 4D spectra using standard Fourier transform (FT) techniques. The filter diagonalization method (FDM) is a numerically efficient algorithm that fits the entire multi-dimensional time-domain data to a set of multi-dimensional oscillators. Selective 4D constant-time HCCH-COSY experiments that correlate the H5-C5-C6-H6 base spin systems of pyrimidines or the H1'-C1'-C2'-H2' spin systems of ribose sugars were acquired on the {sup 13}C-labeled iron responsive element (IRE) RNA. FDM-processing of these 4D experiments recorded with only 8 complex points in the indirect dimensions showed superior spectral resolution than FT-processed spectra. Practical aspects of obtaining optimal FDM-processed spectra are discussed. The results here demonstrate that FDM-processing can be used to obtain high-resolution 4D spectra on a medium sized RNA in a fraction of the acquisition time normally required for high-resolution, high-dimensional spectra.

  4. Scaling of turbulence spectra measured in strong shear flow near the Earth’s surface (United States)

    Mikkelsen, T.; Larsen, S. E.; Jørgensen, H. E.; Astrup, P.; Larsén, X. G.


    Within the lowest kilometer of the Earth’s atmosphere, in the so-called atmospheric boundary layer, winds are often gusty and turbulent. Nearest to the ground, the turbulence is predominately generated by mechanical wall-bounded wind shear, whereas at higher altitudes turbulent mixing of heat and moisture also play a role. The variance (square of the standard deviation) of the fluctuation around the mean wind speed is a measure of the kinetic energy content of the turbulence. This kinetic energy can be resolved into the spectral distributions, or spectra, as functions of eddy size, wavenumber, or frequency. Spectra are derived from Fourier transforms of wind records as functions of space or time corresponding to wavenumber and frequency spectra, respectively. Atmospheric spectra often exhibit different subranges that can be distinguished and scaled by the physical parameters responsible for: (1) their generation; (2) the cascade of energy across the spectrum from large- to small-scale; and (3) the eventual decay of turbulence into heat owing to viscosity effects on the Kolmogorov microscale, in which the eddy size is only a fraction of a millimeter. This paper addresses atmospheric turbulence spectra in the lowest part of the atmospheric boundary layer—the so-called surface layer—where the wind shear is strong owing to the nonslip condition at the ground. Theoretical results dating back to Tchen’s early work in 1953 ‘on the spectrum of energy in turbulent shear flow’ led Tchen to predict a shear production subrange with a distinct inverse-linear power law for turbulence in a strongly sheared high-Reynolds number wall-bounded flow, as is encountered in the lowest sheared part of the atmospheric boundary layer, also known as the eddy surface layer. This paper presents observations of spectra measured in a meteorological mast at Høvsøre, Denmark, that support Tchen’s prediction of a shear production subrange following a distinct power law of degree

  5. Full-spectrum analysis of natural gamma-ray spectra

    NARCIS (Netherlands)

    Hendriks, Peter; Limburg, J; de Meijer, RJ


    In this paper, a new system to measure natural gamma -radiation in situ will be presented. This system combines a high-efficiency EGO scintillation detector with full-spectrum data analysis (FSA). This technique uses the (nearly) full spectral shape and the so-called 'standard spectra' to calculate

  6. Simultaneous acquisition of three NMR spectra in a single ...

    Indian Academy of Sciences (India)

    form (GFT) NMR spectroscopy, parallel data acquisition and non-uniform sampling. The following spectra are acquired ... experiments take minutes to hours to acquire, whereas. 3D experiments, which can take up to a few days, ... ing of 902 peaks reported to be present in the blood serum. The chemical shift values were ...

  7. Calculation of prompt neutron spectra for curium isotopes

    Energy Technology Data Exchange (ETDEWEB)

    Ohsawa, Takaaki [Kinki Univ., Higashi-Osaka, Osaka (Japan). Atomic Energy Research Inst.


    With the aim of checking the existing evaluations contained in JENDL-3.2 and providing new evaluations based on a methodology proposed by the author, a series of calculations of prompt neutron spectra have been undertaken for curium isotopes. Some of the evaluations in JENDL-3.2 was found to be unphysically hard and should be revised. (author)

  8. Models for the active site in galactose oxidase: Structure, spectra ...

    Indian Academy of Sciences (India)

    Models for the active site in galactose oxidase: Structure, spectra and redox of copper(II) complexes of certain phenolate ligands. Mathrubootham Vaidyanathan ... All the present complexes exhibit several electronic and EPR spectral features which are also similar to the enzyme. Further, to establish the structural and ...

  9. Synthesis, structure, redox and spectra of green iridium complexes ...

    Indian Academy of Sciences (India)


    3. *For correspondence. Synthesis, structure, redox and spectra of green iridium complexes of tridentate azo-aromatic ligands. MANASHI PANDA,a CHAYAN DAS,a CHEN-HSIUNG HUNGb and. SREEBRATA ... Mn(II)7 and Fe(II)8 but also produces stable anionic ..... the EPR of the oxidized complexes were not suc- cessful ...

  10. Improved baseline in 29Si NMR spectra of water glasses. (United States)

    Schraml, Jan; Sandor, Peter; Korec, Stefan; Krump, Martin; Foller, Bronislav


    It is shown by experiments that replacing one-pulse sequence by RIDE (ring down elimination) pulse sequence may dramatically improve the baseline of (29)Si NMR spectra and eliminate the signal from the probe. Copyright © 2013 John Wiley & Sons, Ltd.

  11. Density functional theory study of vibrational spectra, and ...

    Indian Academy of Sciences (India)

    The FTIR and FT Raman spectra of dacarbazine were recorded in the regions 4000-400 and 3500-100 cm-1, respectively. The optimized geometry, wavenumber, polarizability and several thermodynamic properties of dacarbazine were studied using ab initio Hartree-Fock, MP2 and DFT methods. A complete vibrational ...

  12. Spatial inhomogeneity in spectra and exciton dynamics in porphyrin ...

    Indian Academy of Sciences (India)


    Aug 26, 2016 ... ... Journal of Chemical Sciences; Volume 128; Issue 11. Spatial inhomogeneity in spectra and exciton dynamics in porphyrin micro-rods and micro-brushes: Confocal microscopy. SHYAMTANU CHATTORAJ KANKAN BHATTACHARYYA. Regular Article Volume 128 Issue 11 November 2016 pp 1717-1724 ...

  13. Infrared spectra of zinc doped lead borate glasses

    Indian Academy of Sciences (India)


    Abstract. The infrared spectra of zinc-doped lead borate glasses (10–30 mol% ZnO) were measured over a continuous spectral range (400–4000 cm–1) in an attempt to study their structure systematically. No boroxol ring formation was observed in the structure of these glasses. The formation of Zn in tetrahedral ...

  14. The effects of attenuation and site on the spectra of ...

    Indian Academy of Sciences (India)

    ... we obtain high Qp and Qs zone, which corresponds to the dense and high velocity rocks of the region. The varying corner frequencies for these spectra are inferred to be characteristics of site. Comparisons of disparity in spectral content with reference to hard rock site conclude that lithology of the northwest part of Jubilee ...

  15. Density functional theory study of vibrational spectra, and ...

    Indian Academy of Sciences (India)


    315. *For correspondence. Density functional theory study of vibrational spectra, and assignment of fundamental modes of ... FTIR; FT-Raman; density functional theory; dacarbazine. 1. Introduction. Dacarbazine, used as antineoplastic in ...... molecules (London: Chapman and Hall) vol 2. 18. Wiberg K B and Sharke A 1973 ...

  16. Estimation of burst-mode LDA power spectra

    DEFF Research Database (Denmark)

    Velte, Clara Marika; George, William K.; Buchhave, Preben


    The estimation of power spectra from LDA data provides signal processing challenges for fluid dynamicists for several reasons: acquisition is dictated by randomly arriving particles, the registered particle velocities tend to be biased toward higher values, and the signal is highly intermittent...

  17. Electronic spectra of anions intercalated in layered double hydroxides

    Indian Academy of Sciences (India)

    The spectra were recorded from 200–800 nm at a scan rate of 0·83 nm s. −1 . Where overlapping bands are observed, these are deconvoluted into. Gaussian components using Peakfit (2007) version 4·12 software (Peakfit SeaSolve Software). UV–Vis spectrum of the precursor Zn–Al–NO3 LDH was recorded to ensure that.

  18. Spreadsheet-Based Program for Simulating Atomic Emission Spectra (United States)

    Flannigan, David J.


    A simple Excel spreadsheet-based program for simulating atomic emission spectra from the properties of neutral atoms (e.g., energies and statistical weights of the electronic states, electronic partition functions, transition probabilities, etc.) is described. The contents of the spreadsheet (i.e., input parameters, formulas for calculating…


    Indian Academy of Sciences (India)

    INTRODUCTION. THE Raman effect in boric acid and its derivatives and the glasses associated with them has been studied ... The Raman spectrum of borax (Na B.O. 10HO) has been observed by Nielsen (vide ... The Raman spectra were recorded with a Hilger medium quartz Spectro- graph having a dispersion of 140 cm.

  20. Analysis of electron energy-loss spectra and images

    NARCIS (Netherlands)

    C.W.J. Sorber (Lianne)


    textabstractSeveral methods are proposed for the elemental analysis of biological material with the use of electron energy-loss spectroscopy (EELS) and electron spectroscopic imaging (ESI) in a Zeiss EM902. For spectra, the Simplex-method was tested and compared to Egerton's 2- area method, the

  1. Medium-resolution isaac newton telescope library of empirical spectra

    NARCIS (Netherlands)

    Sanchez-Blazquez, P.; Peletier, R. F.; Jimenez-Vicente, J.; Cardiel, N.; Cenarro, A. J.; Falcon-Barroso, J.; Gorgas, J.; Selam, S.; Vazdekis, A.


    A new stellar library developed for stellar population synthesis modelling is presented. The library consists of 985 stars spanning a large range in atmospheric parameters. The spectra were obtained at the 2.5-m Isaac Newton Telescope and cover the range lambda lambda 3525-7500 angstrom at 2.3

  2. CO laser photoacoustic spectra and vibrational modes of heroin ...

    Indian Academy of Sciences (India)

    Abstract. Heroin, morphine and narcotine are very large molecules having 50, 40 and 53 atoms respectively. Moderately high resolution photoacoustic (PA) spectra have been recorded in 9.6 µm and 10.6 µm regions of CO2 laser. It is very difficult to assign the modes of vibrations for PA bands by comparison with ...

  3. The Effect of Phonon Relaxation Process on Absorption Spectra ...

    African Journals Online (AJOL)

    In this work we study the effect of phonon relaxation process on the absorption spectra using the Green's function technique. The Green's function technique which is widely used in many particle problems is used to solve the Kubo formula which describes the optical absorption process. Finally the configurational diagram is ...

  4. Impedance Spectra of Activating/Passivating Solid Oxide Electrodes

    DEFF Research Database (Denmark)

    Mogensen, Mogens Bjerg; Sun, Xiufu; Koch, Søren


    Fuel Cells (SOFC) and Electrolyser Cells (SOEC) exist. Not all of them are irreversible, especially not over short periods. A reversible degradation is termed “passivation” and the reverse is then “activation”. These processes may exhibit themselves in the Electrochemical Impedance Spectra (EIS...

  5. Investigation on tip enhanced Raman spectra of graphene. (United States)

    Li, Xinjuan; Liu, Yanqi; Zeng, Zhuo; Wang, Peijie; Fang, Yan; Zhang, Lisheng


    Tip-enhanced Raman scattering (TERS) is a promising analytical approach for some two-dimensional materials and offers the possibility to correlate imaging and chemical data. Tip-enhanced Raman spectra of graphene are discussed in some details, including substrate, gap between tip-apex and sample surface as well as Ag-nanowire. The TERS spectra give special emphasis to the possibility of TERS tip to induce a large number of defects only while got the tip attached to sample surface. Then the dependence of the TERS spectra of graphene and gap between the probe tip and sample surface was studied, and distribution features of electromagnetic (EM) field around tip were also simulated by finite-difference time-domain (FDTD). The Raman signal enhancement of graphene was further discussed with respect to experimental data. Furthermore, the Ag-nanowire as a nano-antenna could significantly enhance the weak Raman signal of D-band of monolayer graphene is shown, and the TERS spectra of graphene with regard to different regions of Ag-nanowires (endpoints, body) were obtained toward investigating into the distribution of electromagnetic field. Copyright © 2017. Published by Elsevier B.V.

  6. Electronic spectra from TDDFT and machine learning in chemical space

    Energy Technology Data Exchange (ETDEWEB)

    Ramakrishnan, Raghunathan [Institute of Physical Chemistry and National Center for Computational Design and Discovery of Novel Materials, Department of Chemistry, University of Basel, Klingelbergstrasse 80, CH-4056 Basel (Switzerland); Hartmann, Mia; Tapavicza, Enrico, E-mail: [Department of Chemistry and Biochemistry, California State University, 1250 Bellflower Boulevard, Long Beach, California 90840 (United States); Lilienfeld, O. Anatole von, E-mail: [Institute of Physical Chemistry and National Center for Computational Design and Discovery of Novel Materials, Department of Chemistry, University of Basel, Klingelbergstrasse 80, CH-4056 Basel (Switzerland); Argonne Leadership Computing Facility, Argonne National Laboratory, 9700 S. Cass Avenue, Lemont, Illinois 60439 (United States)


    Due to its favorable computational efficiency, time-dependent (TD) density functional theory (DFT) enables the prediction of electronic spectra in a high-throughput manner across chemical space. Its predictions, however, can be quite inaccurate. We resolve this issue with machine learning models trained on deviations of reference second-order approximate coupled-cluster (CC2) singles and doubles spectra from TDDFT counterparts, or even from DFT gap. We applied this approach to low-lying singlet-singlet vertical electronic spectra of over 20 000 synthetically feasible small organic molecules with up to eight CONF atoms. The prediction errors decay monotonously as a function of training set size. For a training set of 10 000 molecules, CC2 excitation energies can be reproduced to within ±0.1 eV for the remaining molecules. Analysis of our spectral database via chromophore counting suggests that even higher accuracies can be achieved. Based on the evidence collected, we discuss open challenges associated with data-driven modeling of high-lying spectra and transition intensities.

  7. laser photoacoustic spectra and vibrational modes of heroin ...

    Indian Academy of Sciences (India)

    Heroin, morphine and narcotine are very large molecules having 50, 40 and 53 atoms respectively. Moderately high resolution photoacoustic (PA) spectra have been recorded in 9.6 m and 10.6 m regions of CO2 laser. It is very difficult to assign the modes of vibrations for PA bands by comparison with conventional low ...

  8. Simultaneous acquisition of three NMR spectra in a single ...

    Indian Academy of Sciences (India)

    While the GFT spectrum has been shown previously to provide good resolution, the editing of spin systems based on their CH multiplicities further resolves the ambiguities for resonance assignments. The experiment is demonstrated on a mixture of 21 metabolites commonly observed in metabolomics. The spectra were ...

  9. Structure and infrared spectra of hydrocarbon interstellar dust analogs. (United States)

    Molpeceres, Germán; Timón, Vicente; Jiménez-Redondo, Miguel; Escribano, Rafael; Maté, Belén; Tanarro, Isabel; Herrero, Víctor J


    A theoretical study of the structure and mid infrared (IR) spectra of interstellar hydrocarbon dust analogs is presented, based on DFT calculations of amorphous solids. The basic molecular structures for these solids are taken from two competing literature models. The first model considers small aromatic units linked by aliphatic chains. The second one assumes a polyaromatic core with hydrogen and methyl substituents at the edges. The calculated spectra are in reasonably good agreement with those of aliphatic-rich and graphitic-rich samples of hydrogenated amorphous carbon (HAC) generated in our laboratory. The theoretical analysis allows the assignment of the main vibrations in the HAC spectra and shows that there is a large degree of mode mixing. The calculated spectra show a marked dependence on the density of the model solids, which evinces the strong influence of the environment on the strengths of the vibrational modes. The present results indicate that the current procedure of estimating the hydrogen and graphitic content of HAC samples through the decomposition of IR features into vibrational modes of individual functional groups is problematic owing to the mentioned mode mixing and to the difficulty of assigning reliable and unique band strengths to the various molecular vibrations. Current band strengths from the literature might overestimate polyaromatic structures. Comparison with astronomical observations suggests that the average structure of carbonaceous dust in the diffuse interstellar medium lies probably in between those of the two models considered, though closer to the more aliphatic structure.

  10. Imaging Emission Spectra with Handheld and Cellphone Cameras (United States)

    Sitar, David


    As point-and-shoot digital camera technology advances it is becoming easier to image spectra in a laboratory setting on a shoestring budget and get immediate results. With this in mind, I wanted to test three cameras to see how their results would differ. Two undergraduate physics students and I used one handheld 7.1 megapixel (MP) digital Cannon…

  11. Electronic Spectra of the Jet-Cooled Acetaminophen (United States)

    Lee, Seung Jun; Min, Ahreum; Kim, Yusic; Choi, Myong Yong; Chang, Jinyoung; Lee, Sang Hak; Kim, Seong Keun


    Resonant two-photon ionization (R2PI), laser induced fluorescence (LIF) and UV-UV double resonance spectra of the jet-cooled acetaminophen, widely used as a pain reliever and fever reducer, were obtained in the gas phase. Conformational characterizations for acetaminophen will be presented with an aid of spectroscopic techniques and DFT B3LYP calculations.

  12. A comparative study of the spectra recorded at RRCAT synchrotron ...

    Indian Academy of Sciences (India)

    The aim of the present work is to make a comparative study of the EXAFS spectra recorded at the BL-8 dispersive EXAFS beamline at 2 GeV Indus-2 synchrotron source at RRCAT, Indore (India) with those recorded at other synchrotron EXAFS beamlines, viz., X-19A at NSLS, BNL (USA), EXAFS wiggler beamline 4-1 at the ...

  13. Label-free peptide profiling of Orbitrap™ full mass spectra

    NARCIS (Netherlands)

    M.K. Titulaer (Mark); D. de Costa (Dominique); C. Stingl (Christoph); L.J.M. Dekker (Lennard); P.A.E. Sillevis Smitt (Peter); T.M. Luider (Theo)


    textabstractBackground. We developed a new version of the open source software package Peptrix that can yet compare large numbers of Orbitrap™ LC-MS data. The peptide profiling results for Peptrix on MS1 spectra were compared with those obtained from a small selection of open source and commercial

  14. Polarized Power Spectra from HERA-19 Commissioning Data: Instrument Stability (United States)

    Fox Fortino, Austin; Chichura, Paul; Igarashi, Amy; Kohn, Saul; Aguirre, James; HERA Collaboration


    The Epoch of Reionization (EoR) is a key period in the universe’s history, containing the formation of the first galaxies and large scale structures. Foreground emission is the limiting factor in detecting the 21 cm emission from the Epoch of Reionization (EoR). The HERA-19 low frequency radio interferometer aims to reduce the obfuscation from the foreground emission with its dish shaped antennae. We generate polarized 2D (cylindrically averaged) power spectra from seven days of observation from the HERA-19 2016 observation season in each of the four Stokes parameters I, Q, U, and V. These power spectra serve as a potent diagnostic tool that allow us to understand the instrument stability by comparison between nominally redundant baselines, and between observations of nominally the same astrophysical sky on successive days. The power spectra are expected to vary among nominally redundant measurements due to ionosphere fluctuations and thermal changes in the electronics and instrument beam patterns, as well as other factors. In this work we investigate the stability over time of these polarized power spectra, and use them to quantify the variation due to these effects.

  15. Flux and polarisation spectra of water clouds on exoplanets

    NARCIS (Netherlands)

    Karalidi, T.; Stam, D.M.; Hovenier, J.W.


    Context. A crucial factor for a planet’s habitability is its climate. Clouds play an important role in planetary climates. Detecting and characterising clouds on an exoplanet is therefore crucial when addressing this planet’s habitability. Aims. We present calculated flux and polarisation spectra of

  16. Demonstrations of Optical Spectra with a Video Camera (United States)

    Kraftmakher, Yaakov


    The use of a video camera may markedly improve demonstrations of optical spectra. First, the output electrical signal from the camera, which provides full information about a picture to be transmitted, can be used for observing the radiant power spectrum on the screen of a common oscilloscope. Second, increasing the magnification by the camera…

  17. A database for the parameters of Auger differential spectra

    Energy Technology Data Exchange (ETDEWEB)

    Godowski, P.J. [Institute of Experimental Physics, University of Wroclaw, Wroclaw (Poland)


    The organization and structure of elaborated database of differential Auger spectra is presented. The first page of this set, available in complete form from the author, is demonstrated. The advantages page of taking into account the data set, in analytical work using Auger spectroscopy, are indicated. (author) 17 refs, 1 tab

  18. Prediction of pork quality attributes from near infrared reflectance spectra

    NARCIS (Netherlands)

    Geesink, G.H.; Schreutelkamp, F.H.; Frankhuizen, R.; Vedder, H.W.; Faber, N.M.; Kranen, R.W.; Gerritzen, M.A.


    Near infrared spectroscopy (NIRS) is one of the most promising techniques for large-scale meat quality evaluation. We investigated the potential of NIRS-based models to predict drip loss and shear force of pork samples. Near infrared reflectance spectra (1000¿2500 nm), water-holding capacity, shear

  19. Molecular dynamics in cytochrome c oxidase Moessbauer spectra deconvolution

    Energy Technology Data Exchange (ETDEWEB)

    Bossis, Fabrizio [Department of Medical Biochemistry, Medical Biology and Medical Physics (DIBIFIM), University of Bari ' Aldo Moro' , Bari (Italy); Palese, Luigi L., E-mail: [Department of Medical Biochemistry, Medical Biology and Medical Physics (DIBIFIM), University of Bari ' Aldo Moro' , Bari (Italy)


    Research highlights: {yields} Cytochrome c oxidase molecular dynamics serve to predict Moessbauer lineshape widths. {yields} Half height widths are used in modeling of Lorentzian doublets. {yields} Such spectral deconvolutions are useful in detecting the enzyme intermediates. -- Abstract: In this work low temperature molecular dynamics simulations of cytochrome c oxidase are used to predict an experimentally observable, namely Moessbauer spectra width. Predicted lineshapes are used to model Lorentzian doublets, with which published cytochrome c oxidase Moessbauer spectra were simulated. Molecular dynamics imposed constraints to spectral lineshapes permit to obtain useful information, like the presence of multiple chemical species in the binuclear center of cytochrome c oxidase. Moreover, a benchmark of quality for molecular dynamic simulations can be obtained. Despite the overwhelming importance of dynamics in electron-proton transfer systems, limited work has been devoted to unravel how much realistic are molecular dynamics simulations results. In this work, molecular dynamics based predictions are found to be in good agreement with published experimental spectra, showing that we can confidently rely on actual simulations. Molecular dynamics based deconvolution of Moessbauer spectra will lead to a renewed interest for application of this approach in bioenergetics.

  20. AWARD PAPER: XANES spectra of transition metal compounds

    Energy Technology Data Exchange (ETDEWEB)

    Groot, Frank M F de [Inorganic Chemistry and Catalysis, Utrecht University, Sorbonnelaan 16, 3584 CA Utrecht (Netherlands)


    An overview is given of the interactions that determine the XANES spectral shapes of transition metal compounds. The interactions are divided into ground state effects, final state effects and transition effects. The metal L edges, metal K edges and ligand K edges are analysed with respect to these interactions. The importance of XANES is partly due to its wide versatility in measurement conditions. XANES spectra can be measured using a number of sample environments, ranging from vacuum to ambient pressures for soft x-rays and up to extreme conditions with hard X-rays. These in-situ XANES spectra can be measured with a spatial resolution of 10 to 30 nm. XANES spectral shapes can be used as resonant channels in resonant photoemission, resonant x-ray emission or resonant diffraction experiments. This gives rise to a large number of resonant techniques that also allow the detection of site, valence, spin and symmetry selective XANES spectra and/or XANES spectra revealing information with a resolution better than its lifetime broadening.

  1. Infrared spectra, Raman laser, XRD, DSC/TGA and SEM ...

    Indian Academy of Sciences (India)

    Home; Journals; Bulletin of Materials Science; Volume 34; Issue 4. Infrared spectra, Raman laser, XRD, DSC/TGA and SEM investigations on the preparations of selenium metal, (Sb2O3, Ga2O3, SnO and HgO) oxides and lead carbonate with pure grade using acetamide precursors. Moamen S Refat Khaled M Elsabawy.


    Electron spin resonance (e.s.r.) spectra of NO adsorbed on the 4 zeolites Linde 4A, 5A, 13X , and hydrogen mordenite were measured at 77K. No e.s.r...the quadrupole moment with the corresponding electric field gradients, the non-axial component of the latter is estimated for the surface fields of the zeolites . (Author)

  3. Vibrational spectra and normal coordinate analysis on structure of ...

    Indian Academy of Sciences (India)

    journal of. December 2008 physics pp. 1291–1300. Vibrational spectra and normal coordinate analysis on structure of chlorambucil and thioguanine. S GUNASEKARAN1, S KUMARESAN2,∗, ... methoprexate are most effective in the treatment of leukemia [5–10] in children. Thioguanine interferes with the conversion of ...

  4. The deconvolution of complex spectra by artificial immune system (United States)

    Galiakhmetova, D. I.; Sibgatullin, M. E.; Galimullin, D. Z.; Kamalova, D. I.


    An application of the artificial immune system method for decomposition of complex spectra is presented. The results of decomposition of the model contour consisting of three components, Gaussian contours, are demonstrated. The method of artificial immune system is an optimization method, which is based on the behaviour of the immune system and refers to modern methods of search for the engine optimization.

  5. The art of fitting p-mode spectra (United States)

    Appourchaux, T.; Gizon, L.

    We describe how to extract the p-mode parameters from complex Fourier spectra using maximum likelihood estimators. We expect our description to be quite general and didactic. We discuss problems such as the choice of the optimal filters and the construction of the leakage and covariance matrices. The LOI/SOHO Team makes use of these methods.

  6. Calculation of {beta}-ray spectra. Odd-odd nuclei

    Energy Technology Data Exchange (ETDEWEB)

    Tachibana, Takahiro [Waseda Univ., Tokyo (Japan). Advanced Research Center for Science and Engineering


    In order to study {beta}-ray of atomic nucleus, it is natural to consider {beta}-ray data fundamental and important. In a recent experiment, Rudstam measured {beta}-ray spectra from short term nuclear fission product species in 1990. It is an important check point in theoretical study on {beta}-ray to investigate if these experimental data can be reproduced by any theoretical calculation. As there are several spectrum studies of {beta}-ray through decay heat for its various properties due to the general theory of the {beta}-decay, little descriptions can be found. In even such studies, spectra under high excitation state of daughter species difficult to measure and apt to short experimental results were treated with combination spectra composed of experimental and calculated values such as substitution of a part of the general theory with calculated value. In this paper, the {beta} spectra supposed by only the general theory was reported without using such data combination in order to confirm effectiveness of the theory. In particular, this report was described mainly on the results using recent modification of odd-odd nucleus species. (G.K.)

  7. Investigations of the electron paramagnetic resonance spectra of ...

    Indian Academy of Sciences (India)


    Nov 27, 2015 ... The EPR spectra for VO2+ in CaO–Al2O3–SiO2 system are calculated using complete diagonalization method (CDM) and perturbation theory method (PTM). The calculated results are in good agreement with the observed values. By comparing the calculated results by CDM and PTM in a wide range of ...

  8. Surface hopping modeling of two-dimensional spectra

    NARCIS (Netherlands)

    Tempelaar, Roel; Vegte, Cornelis P. van der; Knoester, Jasper; Jansen, Thomas L.C.


    Recently, two-dimensional (2D) electronic spectroscopy has become an important tool to unravel the excited state properties of complex molecular assemblies, such as biological light harvesting systems. In this work, we propose a method for simulating 2D electronic spectra based on a surface hopping

  9. Planck 2013 results. XV. CMB power spectra and likelihood

    CERN Document Server

    Ade, P.A.R.; Armitage-Caplan, C.; Arnaud, M.; Ashdown, M.; Atrio-Barandela, F.; Aumont, J.; Baccigalupi, C.; Banday, A.J.; Barreiro, R.B.; Bartlett, J.G.; Battaner, E.; Benabed, K.; Benoit, A.; Benoit-Levy, A.; Bernard, J.P.; Bersanelli, M.; Bielewicz, P.; Bobin, J.; Bock, J.J.; Bonaldi, A.; Bonavera, L.; Bond, J.R.; Borrill, J.; Bouchet, F.R.; Boulanger, F.; Bridges, M.; Bucher, M.; Burigana, C.; Butler, R.C.; Calabrese, E.; Cardoso, J.F.; Catalano, A.; Challinor, A.; Chamballu, A.; Chiang, L.Y.; Chiang, H.C.; Christensen, P.R.; Church, S.; Clements, D.L.; Colombi, S.; Colombo, L.P.L.; Combet, C.; Couchot, F.; Coulais, A.; Crill, B.P.; Curto, A.; Cuttaia, F.; Danese, L.; Davies, R.D.; Davis, R.J.; de Bernardis, P.; de Rosa, A.; de Zotti, G.; Delabrouille, J.; Delouis, J.M.; Desert, F.X.; Dickinson, C.; Diego, J.M.; Dole, H.; Donzelli, S.; Dore, O.; Douspis, M.; Dunkley, J.; Dupac, X.; Efstathiou, G.; Elsner, F.; Ensslin, T.A.; Eriksen, H.K.; Finelli, F.; Forni, O.; Frailis, M.; Fraisse, A.A.; Franceschi, E.; Gaier, T.C.; Galeotta, S.; Galli, S.; Ganga, K.; Giard, M.; Giardino, G.; Giraud-Heraud, Y.; Gjerlow, E.; Gonzalez-Nuevo, J.; Gorski, K.M.; Gratton, S.; Gregorio, A.; Gruppuso, A.; Gudmundsson, J.E.; Hansen, F.K.; Hanson, D.; Harrison, D.; Helou, G.; Henrot-Versille, S.; Hernandez-Monteagudo, C.; Herranz, D.; Hildebrandt, S.R.; Hivon, E.; Hobson, M.; Holmes, W.A.; Hornstrup, A.; Hovest, W.; Huffenberger, K.M.; Hurier, G.; Jaffe, T.R.; Jaffe, A.H.; Jewell, J.; Jones, W.C.; Juvela, M.; Keihanen, E.; Keskitalo, R.; Kiiveri, K.; Kisner, T.S.; Kneissl, R.; Knoche, J.; Knox, L.; Kunz, M.; Kurki-Suonio, H.; Lagache, G.; Lahteenmaki, A.; Lamarre, J.M.; Lasenby, A.; Lattanzi, M.; Laureijs, R.J.; Lawrence, C.R.; Le Jeune, M.; Leach, S.; Leahy, J.P.; Leonardi, R.; Leon-Tavares, J.; Lesgourgues, J.; Liguori, M.; Lilje, P.B.; Lindholm, V.; Linden-Vornle, M.; Lopez-Caniego, M.; Lubin, P.M.; Macias-Perez, J.F.; Maffei, B.; Maino, D.; Mandolesi, N.; Marinucci, D.; Maris, M.; Marshall, D.J.; Martin, P.G.; Martinez-Gonzalez, E.; Masi, S.; Matarrese, S.; Matthai, F.; Mazzotta, P.; Meinhold, P.R.; Melchiorri, A.; Mendes, L.; Menegoni, E.; Mennella, A.; Migliaccio, M.; Millea, M.; Mitra, S.; Miville-Deschenes, M.A.; Molinari, D.; Moneti, A.; Montier, L.; Morgante, G.; Mortlock, D.; Moss, A.; Munshi, D.; Naselsky, P.; Nati, F.; Natoli, P.; Netterfield, C.B.; Norgaard-Nielsen, H.U.; Noviello, F.; Novikov, D.; Novikov, I.; O'Dwyer, I.J.; Orieux, F.; Osborne, S.; Oxborrow, C.A.; Paci, F.; Pagano, L.; Pajot, F.; Paladini, R.; Paoletti, D.; Partridge, B.; Pasian, F.; Patanchon, G.; Paykari, P.; Perdereau, O.; Perotto, L.; Perrotta, F.; Piacentini, F.; Piat, M.; Pierpaoli, E.; Pietrobon, D.; Plaszczynski, S.; Pointecouteau, E.; Polenta, G.; Ponthieu, N.; Popa, L.; Poutanen, T.; Pratt, G.W.; Prezeau, G.; Prunet, S.; Puget, J.L.; Rachen, J.P.; Rahlin, A.; Rebolo, R.; Reinecke, M.; Remazeilles, M.; Renault, C.; Ricciardi, S.; Riller, T.; Ringeval, C.; Ristorcelli, I.; Rocha, G.; Rosset, C.; Roudier, G.; Rowan-Robinson, M.; Rubino-Martin, J.A.; Rusholme, B.; Sandri, M.; Sanselme, L.; Santos, D.; Savini, G.; Scott, D.; Seiffert, M.D.; Shellard, E.P.S.; Spencer, L.D.; Starck, J.L.; Stolyarov, V.; Stompor, R.; Sudiwala, R.; Sureau, F.; Sutton, D.; Suur-Uski, A.S.; Sygnet, J.F.; Tauber, J.A.; Tavagnacco, D.; Terenzi, L.; Toffolatti, L.; Tomasi, M.; Tristram, M.; Tucci, M.; Tuovinen, J.; Turler, M.; Valenziano, L.; Valiviita, J.; Van Tent, B.; Varis, J.; Vielva, P.; Villa, F.; Vittorio, N.; Wade, L.A.; Wandelt, B.D.; Wehus, I.K.; White, M.; White, S.D.M.; Yvon, D.; Zacchei, A.; Zonca, A.


    We present the Planck likelihood, a complete statistical description of the two-point correlation function of the CMB temperature fluctuations. We use this likelihood to derive the Planck CMB power spectrum over three decades in l, covering 2 = 50, we employ a correlated Gaussian likelihood approximation based on angular cross-spectra derived from the 100, 143 and 217 GHz channels. We validate our likelihood through an extensive suite of consistency tests, and assess the impact of residual foreground and instrumental uncertainties on cosmological parameters. We find good internal agreement among the high-l cross-spectra with residuals of a few uK^2 at l <= 1000. We compare our results with foreground-cleaned CMB maps, and with cross-spectra derived from the 70 GHz Planck map, and find broad agreement in terms of spectrum residuals and cosmological parameters. The best-fit LCDM cosmology is in excellent agreement with preliminary Planck polarisation spectra. The standard LCDM cosmology is well constrained b...

  10. Intraspecific Trait Variation and Coordination: Root and Leaf Economics Spectra in Coffee across Environmental Gradients. (United States)

    Isaac, Marney E; Martin, Adam R; de Melo Virginio Filho, Elias; Rapidel, Bruno; Roupsard, Olivier; Van den Meersche, Karel


    Hypotheses on the existence of a universal "Root Economics Spectrum" (RES) have received arguably the least attention of all trait spectra, despite the key role root trait variation plays in resource acquisition potential. There is growing interest in quantifying intraspecific trait variation (ITV) in plants, but there are few studies evaluating (i) the existence of an intraspecific RES within a plant species, or (ii) how a RES may be coordinated with other trait spectra within species, such as a leaf economics spectrum (LES). Using Coffea arabica (Rubiaceae) as a model species, we measured seven morphological and chemical traits of intact lateral roots, which were paired with information on four key LES traits. Field collections were completed across four nested levels of biological organization. The intraspecific trait coefficient of variation (cv) ranged from 25 to 87% with root diameter and specific root tip density showing the lowest and highest cv, respectively. Between 27 and 68% of root ITV was explained by site identity alone for five of the seven traits measured. A single principal component explained 56.2% of root trait covariation, with plants falling along a RES from resource acquiring to conserving traits. Multiple factor analysis revealed significant orthogonal relationships between root and leaf spectra. RES traits were strongly orthogonal with respect to LES traits, suggesting these traits vary independently from one another in response to environmental cues. This study provides among the first evidence that plants from the same species differentiate from one another along an intraspecific RES. We find that in one of the world's most widely cultivated crops, an intraspecific RES is orthogonal to an intraspecific LES, indicating that above and belowground responses of plants to managed (or natural) environmental gradients are likely to occur independently from one another.

  11. Intraspecific Trait Variation and Coordination: Root and Leaf Economics Spectra in Coffee across Environmental Gradients

    Directory of Open Access Journals (Sweden)

    Marney E. Isaac


    Full Text Available Hypotheses on the existence of a universal “Root Economics Spectrum” (RES have received arguably the least attention of all trait spectra, despite the key role root trait variation plays in resource acquisition potential. There is growing interest in quantifying intraspecific trait variation (ITV in plants, but there are few studies evaluating (i the existence of an intraspecific RES within a plant species, or (ii how a RES may be coordinated with other trait spectra within species, such as a leaf economics spectrum (LES. Using Coffea arabica (Rubiaceae as a model species, we measured seven morphological and chemical traits of intact lateral roots, which were paired with information on four key LES traits. Field collections were completed across four nested levels of biological organization. The intraspecific trait coefficient of variation (cv ranged from 25 to 87% with root diameter and specific root tip density showing the lowest and highest cv, respectively. Between 27 and 68% of root ITV was explained by site identity alone for five of the seven traits measured. A single principal component explained 56.2% of root trait covariation, with plants falling along a RES from resource acquiring to conserving traits. Multiple factor analysis revealed significant orthogonal relationships between root and leaf spectra. RES traits were strongly orthogonal with respect to LES traits, suggesting these traits vary independently from one another in response to environmental cues. This study provides among the first evidence that plants from the same species differentiate from one another along an intraspecific RES. We find that in one of the world’s most widely cultivated crops, an intraspecific RES is orthogonal to an intraspecific LES, indicating that above and belowground responses of plants to managed (or natural environmental gradients are likely to occur independently from one another.

  12. Can We Infer Ocean Dynamics from Altimeter Wavenumber Spectra? (United States)

    Richman, James; Shriver, Jay; Arbic, Brian


    The wavenumber spectra of sea surface height (SSH) and kinetic energy (KE) have been used to infer the dynamics of the ocean. When quasi-geostrophic dynamics (QG) or surface quasi-geostrophic (SQG) turbulence dominate and an inertial subrange exists, a steep SSH wavenumber spectrum is expected with k-5 for QG turbulence and a flatter k-11/3 for SQG turbulence. However, inspection of the spectral slopes in the mesoscale band of 70 to 250 km shows that the altimeter wavenumber slopes typically are much flatter than the QG or SQG predictions over most of the ocean. Comparison of the altimeter wavenumber spectra with the spectra estimated from the output of an eddy resolving global ocean circulation model (the Hybrid Coordinate Ocean Model, HYCOM, at 1/25 resolution), which is forced by high frequency winds and includes the astronomical forcing of the sun and the moon, suggests that the flatter slopes of the altimeter may arise from three possible sources, the presence of internal waves, the lack of an inertial subrange in the 70 to 250 km band and noise or submesoscales at small scales. When the wavenumber spectra of SSH and KE are estimated near the internal tide generating regions, the resulting spectra are much flatter than the expectations of QG or SQG theory. If the height and velocity variability are separated into low frequency (periods greater than 2 days) and high frequency (periods less than a day), then a different pattern emerges with a relatively flat wavenumber spectrum at high frequency and a steeper wavenumber spectrum at low frequency. The stationary internal tides can be removed from the altimeter spectrum, which steepens the spectral slopes in the energetic internal wave regions. Away from generating regions where the internal waves

  13. Fractal spectra in generalized Fibonacci one-dimensional magnonic quasicrystals

    Energy Technology Data Exchange (ETDEWEB)

    Costa, C.H.O. [Departamento de Fisica Teorica e Experimental, Universidade Federal do Rio grande do Norte, 59072-970 Natal-RN (Brazil); Vasconcelos, M.S., E-mail: [Escola de Ciencias e Tecnologia, Universidade Federal do Rio grande do Norte, 59072-970 Natal-RN (Brazil); Barbosa, P.H.R.; Barbosa Filho, F.F. [Departamento de Fisica, Universidade Federal do Piaui, 64049-550 Teresina-Pi (Brazil)


    In this work we carry out a theoretical analysis of the spectra of magnons in quasiperiodic magnonic crystals arranged in accordance with generalized Fibonacci sequences in the exchange regime, by using a model based on a transfer-matrix method together random-phase approximation (RPA). The generalized Fibonacci sequences are characterized by an irrational parameter {sigma}(p,q), which rules the physical properties of the system. We discussed the magnonic fractal spectra for first three generalizations, i.e., silver, bronze and nickel mean. By varying the generation number, we have found that the fragmentation process of allowed bands makes possible the emergence of new allowed magnonic bulk bands in spectra regions that were magnonic band gaps before, such as which occurs in doped semiconductor devices. This interesting property arises in one-dimensional magnonic quasicrystals fabricated in accordance to quasiperiodic sequences, without the need to introduce some deferent atomic layer or defect in the system. We also make a qualitative and quantitative investigations on these magnonic spectra by analyzing the distribution and magnitude of allowed bulk bands in function of the generalized Fibonacci number F{sub n} and as well as how they scale as a function of the number of generations of the sequences, respectively. - Highlights: Black-Right-Pointing-Pointer Quasiperiodic magnonic crystals are arranged in accordance with the generalized Fibonacci sequence. Black-Right-Pointing-Pointer Heisenberg model in exchange regime is applied. Black-Right-Pointing-Pointer We use a theoretical model based on a transfer-matrix method together random-phase approximation. Black-Right-Pointing-Pointer Fractal spectra are characterized. Black-Right-Pointing-Pointer We analyze the distribution of allowed bulk bands in function of the generalized Fibonacci number.

  14. Infrared reflectance spectra: Effects of particle size, provenance and preparation

    Energy Technology Data Exchange (ETDEWEB)

    Su, Yin-Fong; Myers, Tanya L.; Brauer, Carolyn S.; Blake, Thomas A.; Forland, Brenda M.; Szecsody, James E.; Johnson, Timothy J.


    We have recently developed methods for making more accurate infrared total and diffuse directional - hemispherical reflectance measurements using an integrating sphere. We have found that reflectance spectra of solids, especially powders, are influenced by a number of factors including the sample preparation method, the particle size and morphology, as well as the sample origin. On a quantitative basis we have investigated some of these parameters and the effects they have on reflectance spectra, particularly in the longwave infrared. In the IR the spectral features may be observed as either maxima or minima: In general, upward-going peaks in the reflectance spectrum result from strong surface scattering, i.e. rays that are reflected from the surface without bulk penetration, whereas downward-going peaks are due to either absorption or volume scattering, i.e. rays that have penetrated or refracted into the sample interior and are not reflected. The light signals reflected from solids usually encompass all such effects, but with strong dependencies on particle size and preparation. This paper measures the reflectance spectra in the 1.3 – 16 micron range for various bulk materials that have a combination of strong and weak absorption bands in order to observe the effects on the spectral features: Bulk materials were ground with a mortar and pestle and sieved to separate the samples into various size fractions between 5 and 500 microns. The median particle size is demonstrated to have large effects on the reflectance spectra. For certain minerals we also observe significant spectral change depending on the geologic origin of the sample. All three such effects (particle size, preparation and provenance) result in substantial change in the reflectance spectra for solid materials; successful identification algorithms will require sufficient flexibility to account for these parameters.

  15. Machine learning molecular dynamics for the simulation of infrared spectra. (United States)

    Gastegger, Michael; Behler, Jörg; Marquetand, Philipp


    Machine learning has emerged as an invaluable tool in many research areas. In the present work, we harness this power to predict highly accurate molecular infrared spectra with unprecedented computational efficiency. To account for vibrational anharmonic and dynamical effects - typically neglected by conventional quantum chemistry approaches - we base our machine learning strategy on ab initio molecular dynamics simulations. While these simulations are usually extremely time consuming even for small molecules, we overcome these limitations by leveraging the power of a variety of machine learning techniques, not only accelerating simulations by several orders of magnitude, but also greatly extending the size of systems that can be treated. To this end, we develop a molecular dipole moment model based on environment dependent neural network charges and combine it with the neural network potential approach of Behler and Parrinello. Contrary to the prevalent big data philosophy, we are able to obtain very accurate machine learning models for the prediction of infrared spectra based on only a few hundreds of electronic structure reference points. This is made possible through the use of molecular forces during neural network potential training and the introduction of a fully automated sampling scheme. We demonstrate the power of our machine learning approach by applying it to model the infrared spectra of a methanol molecule, n -alkanes containing up to 200 atoms and the protonated alanine tripeptide, which at the same time represents the first application of machine learning techniques to simulate the dynamics of a peptide. In all of these case studies we find an excellent agreement between the infrared spectra predicted via machine learning models and the respective theoretical and experimental spectra.

  16. Uncertainty analysis for absorption and first-derivative EPR spectra (United States)

    Tseitlin, Mark; Eaton, Sandra S.; Eaton, Gareth R.


    Electron paramagnetic resonance (EPR) experimental techniques produce absorption or first-derivative spectra. Uncertainty analysis provides the basis for comparison of spectra obtained by different methods. In this study it was used to derive analytical equations to relate uncertainties for integrated intensity and line widths obtained from absorption or first-derivative spectra to the signal-to-noise ratio (SNR), with the assumption of white noise. Predicted uncertainties for integrated intensities and line widths are in good agreement with Monte Carlo calculations for Lorentzian and Gaussian lineshapes. Conservative low-pass filtering changes the noise spectrum, which can be modeled in the Monte Carlo simulations. When noise is close to white, the analytical equations provide useful estimates of uncertainties. For example, for a Lorentzian line with white noise, the uncertainty in the number of spins obtained from the first-derivative spectrum is 2.6 times greater than from the absorption spectrum at the same SNR. Uncertainties in line widths obtained from absorption and first-derivative spectra are similar. The impact of integration or differentiation on SNR and on uncertainties in fitting parameters was analyzed. Although integration of the first-derivative spectrum improves the apparent smoothness of the spectrum, it also changes the frequency distribution of the noise. If the lineshape of the signal is known, the integrated intensity can be determined more accurately by fitting the first-derivative spectrum than by first integrating and then fitting the absorption spectrum. Uncertainties in integrated intensities and line widths are less when the parameters are determined from the original data than from spectra that have been either integrated or differentiated. PMID:25774102

  17. Uncertainty analysis for absorption and first-derivative EPR spectra. (United States)

    Tseitlin, Mark; Eaton, Sandra S; Eaton, Gareth R


    Electron paramagnetic resonance (EPR) experimental techniques produce absorption or first-derivative spectra. Uncertainty analysis provides the basis for comparison of spectra obtained by different methods. In this study it was used to derive analytical equations to relate uncertainties for integrated intensity and line widths obtained from absorption or first-derivative spectra to the signal-to-noise ratio (SNR), with the assumption of white noise. Predicted uncertainties for integrated intensities and line widths are in good agreement with Monte Carlo calculations for Lorentzian and Gaussian lineshapes. Conservative low-pass filtering changes the noise spectrum, which can be modeled in the Monte Carlo simulations. When noise is close to white, the analytical equations provide useful estimates of uncertainties. For example, for a Lorentzian line with white noise, the uncertainty in the number of spins obtained from the first-derivative spectrum is 2.6 times greater than from the absorption spectrum at the same SNR. Uncertainties in line widths obtained from absorption and first-derivative spectra are similar. The impact of integration or differentiation on SNR and on uncertainties in fitting parameters was analyzed. Although integration of the first-derivative spectrum improves the apparent smoothness of the spectrum, it also changes the frequency distribution of the noise. If the lineshape of the signal is known, the integrated intensity can be determined more accurately by fitting the first-derivative spectrum than by first integrating and then fitting the absorption spectrum. Uncertainties in integrated intensities and line widths are less when the parameters are determined from the original data than from spectra that have been either integrated or differentiated.

  18. The FTS atomic spectrum tool (FAST) for rapid analysis of line spectra (United States)

    Ruffoni, M. P.


    them to calculated data (such as from the Kurucz database [1]), predicted line parameters, and/or previously known experimental results. With additional information on the spectral response of the spectrometer, obtained from a calibrated standard light source, FT spectra may be intensity calibrated. In turn, this permits the user to calculate atomic branching fractions and oscillator strengths, and their respective uncertainties. Running time: Open ended. Defined by the user. References: [1] R.L. Kurucz (2007). URL

  19. Plant phenolics and absorption features in vegetation reflectance spectra near 1.66 μm (United States)

    Kokaly, Raymond F.; Skidmore, Andrew K


    Past laboratory and field studies have quantified phenolic substances in vegetative matter from reflectance measurements for understanding plant response to herbivores and insect predation. Past remote sensing studies on phenolics have evaluated crop quality and vegetation patterns caused by bedrock geology and associated variations in soil geochemistry. We examined spectra of pure phenolic compounds, common plant biochemical constituents, dry leaves, fresh leaves, and plant canopies for direct evidence of absorption features attributable to plant phenolics. Using spectral feature analysis with continuum removal, we observed that a narrow feature at 1.66 μm is persistent in spectra of manzanita, sumac, red maple, sugar maple, tea, and other species. This feature was consistent with absorption caused by aromatic C-H bonds in the chemical structure of phenolic compounds and non-hydroxylated aromatics. Because of overlapping absorption by water, the feature was weaker in fresh leaf and canopy spectra compared to dry leaf measurements. Simple linear regressions of feature depth and feature area with polyphenol concentration in tea resulted in high correlations and low errors (% phenol by dry weight) at the dry leaf (r2 = 0.95, RMSE = 1.0%, n = 56), fresh leaf (r2 = 0.79, RMSE = 2.1%, n = 56), and canopy (r2 = 0.78, RMSE = 1.0%, n = 13) levels of measurement. Spectra of leaves, needles, and canopies of big sagebrush and evergreens exhibited a weak absorption feature centered near 1.63 μm, short ward of the phenolic compounds, possibly consistent with terpenes. This study demonstrates that subtle variation in vegetation spectra in the shortwave infrared can directly indicate biochemical constituents and be used to quantify them. Phenolics are of lesser abundance compared to the major plant constituents but, nonetheless, have important plant functions and ecological significance. Additional research is needed to advance our understanding of the

  20. Predicting the physical properties of tablets from ATR-FTIR spectra using partial least squares regression. (United States)

    Taylor, Michael; Elhissi, Abdelbary M A


    The formulation of a new tablet is a time-consuming activity involving the preparation and testing of many different formulations with the aim of identifying one with the desired properties. In complex formulations it may not be clear which excipient is responsible for eliciting a particular property. To investigate partial least squares (PLS) regression analysis of ATR-FTIR spectra of tablets as a predictive and investigative tool in the formulation of novel tablet formulations. Magnesium stearate, lactose, acetylsalicylic acid and Ac-Di-Sol. ATR-FTIR spectra of a simple aspirin tablet formulation with varying amounts of the lubricant magnesium stearate were obtained. PLS models were built using the spectral data as the multivariate variable and various physical properties of the tablets as the univariate variables. PLS models that allowed good predications to be made for samples not included in the training set were obtained for tablet hardness and disintegration time. It was clear from PLS model regression coefficients that magnesium stearate was responsible for the variation in the tablets' physical properties. PLS regression in combination with ATR-FTIR spectroscopy has been shown to be a useful approach for the prediction of the physical properties of tablets.

  1. Recommendations for the presentation of infrared absorption spectra in data collections condensed phases

    CERN Document Server

    Becker, E D


    Recommendations for the Presentation of Infrared Absorption Spectra in Data Collections-A. Condensed Phases presents the recommendations related to the infrared spectra of condensed phase materials that are proposed for permanent retention in data collections. These recommendations are based on two reports published by the Coblentz Society. This book emphasizes the three levels of quality evaluation for infrared spectra as designated by the Coblentz Society, including critically defined physical data, research quality analytical spectra, and approved analytical spectra. This text discusses the

  2. Accurate high-harmonic spectra from time-dependent two-particle reduced density matrix theory

    CERN Document Server

    Lackner, Fabian; Sato, Takeshi; Ishikawa, Kenichi L; Burgdörfer, Joachim


    The accurate description of the non-linear response of many-electron systems to strong-laser fields remains a major challenge. Methods that bypass the unfavorable exponential scaling with particle number are required to address larger systems. In this paper we present a fully three-dimensional implementation of the time-dependent two-particle reduced density matrix (TD-2RDM) method for many-electron atoms. We benchmark this approach by a comparison with multi-configurational time-dependent Hartree-Fock (MCTDHF) results for the harmonic spectra of beryllium and neon. We show that the TD-2RDM is very well-suited to describe the non-linear atomic response and to reveal the influence of electron-correlation effects.

  3. FT-Raman spectra of cellulose and lignocellulose materials : “self-absorption” phenomenon and its implications for quantitative work (United States)

    Umesh Agarwal; Nancy Kawai


    The phenomenon of “self-absorption” was found to exist in the FT-Raman spectra of cellulose and thermomechanical pulp (TMP), but not in the spectrum of milled wood lignin. For cellulose and TMP, the effect was responsible for reducing the intensity of the Raman bands in the C-H stretch region. Several factors including sampling position, sample thickness, and moisture...

  4. Human confort response to random motions with a dominant rolling motion (United States)

    Stone, R. W., Jr.


    Subjective ride comfort response ratings were measured on a visual motion simulator with rolling velocity inputs with various power spectra shapes and magnitudes. The results show only little influence of spectra shape on comfort response. The effects of magnitude on comfort response indicate the applicability of psychophysical precepts for comfort modeling.

  5. Relationship between molecular structure and Raman spectra of quinolines (United States)

    Frosch, Torsten; Popp, Jürgen


    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. Retrieval of Remote Sensing Images with Pattern Spectra Descriptors

    Directory of Open Access Journals (Sweden)

    Petra Bosilj


    Full Text Available The rapidly increasing volume of visual Earth Observation data calls for effective content based image retrieval solutions, specifically tailored for their high spatial resolution and heterogeneous content. In this paper, we address this issue with a novel local implementation of the well-known morphological descriptors called pattern spectra. They are computationally efficient histogram-like structures describing the global distribution of arbitrarily defined attributes of connected image components. Besides employing pattern spectra for the first time in this context, our main contribution lies in their dense calculation, at a local scale, thus enabling their combination with sophisticated visual vocabulary strategies. The Merced Landuse/Landcover dataset has been used for comparing the proposed strategy against alternative global and local content description methods, where the introduced approach is shown to yield promising performances.

  7. Spreadsheet based analysis of Mössbauer spectra (United States)

    Gunnlaugsson, H. P.


    Using spreadsheet programs to analyse spectral data opens up new possibilities in data analysis. The spreadsheet program contains all the functionality needed for graphical support, fitting and post processing of the results. Unconventional restrictions between fitting parameters can be set up freely, and simultaneous analysis i.e. analysis of many spectra simultaneously in terms of model parameters is straightforward. The free program package Vinda - used for analysing Mössbauer spectra - is described. The package contains support for reading data, calibration, and common functions of particular importance for Mössbauer spectroscopy ( f-factors, second order Doppler shift etc.). Methods to create spectral series and support for error analysis is included. Different types of fitting models are included, ranging from simple Lorentzian models to complex distribution models.

  8. Epoxi Earth Obs - Hrii Raw Spectra V1.0 (United States)

    McLaughlin, S. A.; Carcich, B.; Deming, D.; Klaasen, K. P.; Wellnitz, D. D.


    This data set set contains version 1.0 of raw, 1.05- to 4.8-micron spectra of Earth acquired by the High Resolution Infrared Spectrometer (HRII) during the EPOCh phase of the EPOXI mission. Three sets of observations were acquired on 18-19 March, 28-29 May, and 4-5 June 2008 to characterize Earth as an analog for extrasolar planets. Each observing period lasted approximately 24 hours, and spectra were acquired twice per hour. During the observing period in May, the Moon transited across Earth as seen from the spacecraft. Additional Earth observations are planned for the mission, and these data will be added to a future version of this data set.

  9. Epoxi Earth Obs - Hrii Calibrated Spectra V1.0 (United States)

    McLaughlin, S. A.; Carcich, B.; Deming, D.; Klaasen, K. P.; Wellnitz, D. D.


    This data set set contains version 1.0 of calibrated, 1.05- to 4.8-micron spectra of Earth acquired by the High Resolution Infrared Spectrometer (HRII) during the EPOCh phase of the EPOXI mission. Three sets of observations were acquired on 18-19 March, 28-29 May, and 4-5 June 2008 to characterize Earth as an analog for extrasolar planets. Each observing period lasted approximately 24 hours, and spectra were acquired twice per hour. During the observing period in May, the Moon transited across Earth as seen from the spacecraft. Additional Earth observations are planned for the mission, and these data will be added to a future version of this data set.

  10. Neutron spectra due (13)N production in a PET cyclotron. (United States)

    Benavente, J A; Vega-Carrillo, H R; Lacerda, M A S; Fonseca, T C F; Faria, F P; da Silva, T A


    Monte Carlo and experimental methods have been used to characterize the neutron radiation field around PET (Positron Emission Tomography) cyclotrons. In this work, the Monte Carlo code MCNPX was used to estimate the neutron spectra, the neutron fluence rates and the ambient dose equivalent (H*(10)) in seven locations around a PET cyclotron during (13)N production. In order to validate these calculations, H*(10) was measured in three sites and were compared with the calculated doses. All the spectra have two peaks, one above 0.1MeV due to the evaporation neutrons and another in the thermal region due to the room-return effects. Despite the relatively large difference between the measured and calculated H*(10) for one point, the agreement was considered good, compared with that obtained for (18)F production in a previous work. Copyright © 2015 Elsevier Ltd. All rights reserved.

  11. Statistical detection of the hidden distortions in diffusive spectra

    CERN Document Server

    Nigmatullin, R R; Smith, G; Butler, P


    The detection of an unknown substance in small concentration represents an important problem in spectroscopy. Usually this detection is based on the recognition of specific 'labels' i.e. the visual appearance of new resonance lines that appear in the spectrograms analysed. But if the concentration of the unknown substance is small and visual indications (e.g. resonance peaks in diffusive spectra) are absent then the detection of the unknown substance constitutes a problem. We suggest a new methodology for the statistical detection of an unknown substance, based on the transformation of fluctuations obtained from initial spectrograms into ordered quantized histograms (QHs). The QHs obtained help to detect, statistically, the presence of unknown substances using the characteristics of conventional quantum spectra adopted from quantum mechanics. The averaging of the QHs helps to calculate the ordered 'fluctuation fork' (FF), which provides a specific 'noise ruler' for the detection and quantification of the trac...

  12. A deterministic method to calculate the radiation spectra of nuclides. (United States)

    Stepanek, J


    Recently, the computer program IMRDEC has been developed to determine the radiation spectra due to a single atomic-subshell ionisation of a stable atom by a particle, or due to the atomic deexcitation or decay of nuclides. The data needed to describe the deexcitation or decay scheme are obtained from the Evaluated Nuclear Structure Data File (ENSDF) maintained at Brookhaven National Laboratory; this results in the simplest possible input specification. The atomic data as well as the atomic relaxation probabilities are taken from the Evaluated Atomic Data Library (EADL) from Lawrence Livermore National Laboratory. The program IMRDEC calculates the radiation spectra (inclusively the atomic relaxation cascades) deterministically rather than by the Monte Carlo method; this results in much shorter calculational time per nuclide. Since many assumptions still have to be made in determining the atomic relaxation probabilities and in calculating the atomic relaxation, the deterministic method seems to be a small source of inaccuracy.

  13. Relativistic Effects on Reflection X-ray Spectra of AGN

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Khee-Gan; /University Coll. London; Fuerst, Steven V.; /KIPAC, Menlo Park; Brandwardi-Raymond, Graziella; Wu, Kinwah; Crowley, Oliver; /University Coll. London


    We have calculated the reflection component of the X-ray spectra of active galactic nuclei (AGN) and shown that they can be significantly modified by the relativistic motion of the accretion flow and various gravitational effects of the central black hole. The absorption edges in the reflection spectra suffer severe energy shifts and smearing. The degree of distortion depends on the system parameters, and the dependence is stronger for some parameters such as the inner radius of the accretion disk and the disk viewing inclination angles. The relativistic effects are significant and are observable. Improper treatment of the reflection component of the X-ray continuum in spectral fittings will give rise to spurious line-like features, which will mimic the fluorescent emission lines and mask the relativistic signatures of the lines.

  14. Stratospheric HBr mixing ratio obtained from far infrared emission spectra (United States)

    Park, J. H.; Carli, B.; Barbis, A.


    Emission features of HBr isotopes have been identified in high-resolution FIR emission spectra obtained with a balloon-borne Fourier-transform spectrometer in the spring of 1979 at 32 deg N latitude. When six single-scan spectra at a zenith angle of 93.2 deg were averaged, two features of HBr isotopes at 50.054 and 50.069/cm were obtained with a signal-to-noise ratio of 2.5. The volume mixing ratio retrieved from the average spectrum is 2.0 x 10 to the -11th, which is assumed to be constant above 28 km, with an uncertainty of 35 percent. This stratospheric amount of HBr is about the same as the current level of tropospheric organic bromine compounds, 25 pptv. Thus HBr could be the major stratospheric bromine species.

  15. High-energy X-ray spectra of five sources. (United States)

    Ricker, G. R.; Mcclintock, J. E.; Gerassimenko, M.; Lewin , W. H. G.


    On October 15-16, 1970, we carried out balloon X-ray observations from Australia at energies above 15 keV. We present the high-energy X-ray spectra of three sources discovered by us, GX 301-2, GX 304-1, and GX 1 + 4. The data suggest that these high-energy sources correspond to the sources 2U 1223-62, 2U 1258-61, and 2U 1728-24 respectively. We also present the spectra for two additional sources, GX 5-1 (2U 1757-25) and GX 3 + 1 (2U 1744-26). The average intensity of the highly variable source GX 301-2 was observed to be as great as Tau X-1 in the energy range 15-50 keV.

  16. Energy spectra of electrons and positrons produced in supernova remnants (United States)

    Berezhko, E. G.; Ksenofontov, L. T.


    We study the production of cosmic rays (CRs) in supernova remnants (SNRs), including the production of electron and positron CR components. This combines for the first time nuclear collisions inside CR sources and in the diffuse interstellar medium leading to the creation of electrons and positrons, as well as their reacceleration, with the injection and subsequent acceleration of suprathermal protons and electrons from the postshock thermal pool. Selfconsistent CR spectra are calculated on the basis of the nonlinear kinetic model. It is shown that reacceleration of positrons created in SNR and ISM produces a considerable effect at energies above 10 GeV, making its energy spectrum substantially flatter than the spectrum created in ISM. Calculated electron and positron spectra are in the satisfactory agreement with the existing measurements.

  17. BET, thermal degradation, and FTIR spectras of triazine polyamine polymers

    Directory of Open Access Journals (Sweden)

    Mustafa Can


    Full Text Available Here we show effect of the polyamine polymer chain length to BET isotherms. According to IUPAC classification [1], all three polymers are fitting type 1 physical adsorption isotherm with H3 hysteresis (except for EDA having H2 hysteresis. Moreover, TG and TGA analysis of polymers triazine-ethylenediamine (EDA and triazine-triethylenetetramine (TETA are provided. Due to the similarities of the structure, main decomposition temperatures are close to each other (between 593 K and 873 K. In order to understand change of FTIR spectra with adsorption and stripping Au(III, fresh, Au(III adsorbed and recycled spectras of polymers measured. For further discussions about the effect of chain length to adsorption of Au(III onto triazine polyamine polymer particles “Au (III Uptake by Triazine Polyamine Polymers: Mechanism, Kinetic and Equilibrium Studies” Can et al. [2] (article in press.

  18. Origin and implications of zero degeneracy in networks spectra. (United States)

    Yadav, Alok; Jalan, Sarika


    The spectra of many real world networks exhibit properties which are different from those of random networks generated using various models. One such property is the existence of a very high degeneracy at the zero eigenvalue. In this work, we provide all the possible reasons behind the occurrence of the zero degeneracy in the network spectra, namely, the complete and partial duplications, as well as their implications. The power-law degree sequence and the preferential attachment are the properties which enhances the occurrence of such duplications and hence leading to the zero degeneracy. A comparison of the zero degeneracy in protein-protein interaction networks of six different species and in their corresponding model networks indicates importance of the degree sequences and the power-law exponent for the occurrence of zero degeneracy.

  19. Compositional stratigraphy of crustal material from near-infrared spectra (United States)

    Pieters, Carle M.


    An Earth-based telescopic program to acquire near-infrared spectra of freshly exposed lunar material now contains data for 17 large impact craters with central peaks. Noritic, gabbroic, anorthositic and troctolitic rock types can be distinguished for areas within these large craters from characteristic absorptions in individual spectra of their walls and central peaks. Norites dominate the upper lunar crust while the deeper crustal zones also contain significant amounts of gabbros and anorthosites. Data for material associated with large craters indicate that not only is the lunar crust highly heterogeneous across the nearside, but that the compositional stratigraphy of the lunar crust is nonuniform. Crustal complexity should be expected for other planetary bodies, which should be studied using high spatial and spectral resolution data in and around large impact craters.

  20. Active and sterile neutrino mass effects on beta decay spectra

    Energy Technology Data Exchange (ETDEWEB)

    Boillos, Juan Manuel; Moya de Guerra, Elvira [Departamento de Fisica Atomica, Molecular y Nuclear, Facultad de Ciencias Fisicas, U. Complutense de Madrid, Av. Complutense s/n, E-28040, Madrid (Spain); Moreno, Oscar [Departamento de Fisica Atomica, Molecular y Nuclear, Facultad de Ciencias Fisicas, U. Complutense de Madrid, Av. Complutense s/n, E-28040, Madrid (Spain)


    We study the spectra of the emitted charged leptons in charge current weak nuclear processes to analyze the effect of neutrino masses. Standard active neutrinos are studied here, with masses of the order of 1 eV or lower, as well as sterile neutrinos with masses of a few keV. The latter are warm dark matter (WDM) candidates hypothetically produced or captured as small mixtures with the active neutrinos. We compute differential decay or capture rates spectra in weak charged processes of different nuclei ({sup 3}H, {sup 187}Re, {sup 107}Pd, {sup 163}Ho, etc) using different masses of both active and sterile neutrinos and different values of the mixing parameter.

  1. A Generalized Approach to Model the Spectra and Radiation Dose Rate of Solar Particle Events on the Surface of Mars (United States)

    Guo, Jingnan; Zeitlin, Cary; Wimmer-Schweingruber, Robert F.; McDole, Thoren; Kühl, Patrick; Appel, Jan C.; Matthiä, Daniel; Krauss, Johannes; Köhler, Jan


    For future human missions to Mars, it is important to study the surface radiation environment during extreme and elevated conditions. In the long term, it is mainly galactic cosmic rays (GCRs) modulated by solar activity that contribute to the radiation on the surface of Mars, but intense solar energetic particle (SEP) events may induce acute health effects. Such events may enhance the radiation level significantly and should be detected as immediately as possible to prevent severe damage to humans and equipment. However, the energetic particle environment on the Martian surface is significantly different from that in deep space due to the influence of the Martian atmosphere. Depending on the intensity and shape of the original solar particle spectra, as well as particle types, the surface spectra may induce entirely different radiation effects. In order to give immediate and accurate alerts while avoiding unnecessary ones, it is important to model and well understand the atmospheric effect on the incoming SEPs, including both protons and helium ions. In this paper, we have developed a generalized approach to quickly model the surface response of any given incoming proton/helium ion spectra and have applied it to a set of historical large solar events, thus providing insights into the possible variety of surface radiation environments that may be induced during SEP events. Based on the statistical study of more than 30 significant solar events, we have obtained an empirical model for estimating the surface dose rate directly from the intensities of a power-law SEP spectra.

  2. Development of a Spectra Fabric PASGT-Type Personnel Helmet (United States)


    provision of law, no person shall be subject to any penalty for failing to comply with a collection of information if it does not display a currently valid...various resin systems and identified suitable resin systems for Spectra fabrics, and in January 1989 developed a new resin system ( polyurethane ...BALLISTIC PROTECTION RESINS MELAMINES POLYURETHANE COMPOSITE MATERIALS PREPEG PROJECTILES VINYL PLASTICS TEST AND EVALUATION FABRICS VINYL ESTER

  3. Optical spectra of UX Ari with BOOTES-2 (United States)

    Caballero-Garcia, M. D.; Castro-Tirado, A.; Jelinek, M.


    Following the detection and subsequent monitoring of the new outburst from the RS CVn UX Ari by SWIFT and MAXI (ATEL#5907, #6315 , #6319 ), the 0.6m TELMA robotic telescope at the BOOTES-2 astronomical station Malaga (Spain), obtained optical 4000-9000 A spectra starting at 2014-07-19, 01:32:24.382 UT and ending at 04:25:55.652 UT.

  4. Emission spectra of pyrotechnic mixtures of heat flux simulators (United States)

    Azharonok, V. V.; Kratsko, L. E.; Chubryk, N. I.; Goncharik, S. V.; Miatselskaya, N. S.; Yakshonak, P. P.; Hamayunau, V. I.


    Comprehensive optical spectroscopic studies of the combustion process of solid-state pyrotechnic mixtures based on Mg and Sr(NO3)2 have been carried out. Emission spectra of the mixtures in the ultraviolet, visible, and infrared wavelength regions have been studied under various atmospheric conditions taking into account radiation transfer in air along an optical path of observation up to 5 km long.

  5. Dynamical local connector approximation for electron addition and removal spectra


    Vanzini, Marco; Reining, Lucia; Gatti, Matteo


    Realistic calculations of electron addition and removal spectra rely most often on Green's functions and complex, non-local self-energies. We introduce a shortcut to obtain the spectral function directly from a local and frequency-dependent, yet real, potential. We calculate this potential in the homogeneous electron gas (HEG), and we design a connector which prescribes the use of the HEG results to calculate spectral functions of real materials. Benchmark results for several solids demonstra...

  6. Automated stellar spectra parameterisation for Gaia-RVS

    Directory of Open Access Journals (Sweden)

    Wyse R.F.G.


    Full Text Available Degeneracies in the stellar atmospheric parameters can pollute large spectroscopic surveys, introducing possible biases in the derived distances, kinematics and chemical abundances. We focus at the wavelength range shared by RAVE, the RVS of Gaia and the ESO-FLAMES/GIRAFFE spectrograph setups LR8 and HR21. Based on the algorithms DEGAS and MATISSE, trained on a grid of synthetic spectra, we propose a pipeline in order to derive the atmospheric parameters.

  7. Random matrix theory and the spectra of overlap fermions

    Energy Technology Data Exchange (ETDEWEB)

    Shcheredin, S.; Bietenholz, W.; Chiarappa, T.; Jansen, K.; Nagai, K.-I


    The application of Random Matrix Theory to the Dirac operator of QCD yields predictions for the probability distributions of the lowest eigenvalues. We measured Dirac operator spectra using massless overlap fermions in quenched QCD at topological charge {nu} = 0, {+-} 1 and {+-}2, and found agreement with those predictions -- at least for the first non-zero eigenvalue -- if the volume exceeds about (1.2 fm){sup 4}.

  8. Higher order Nevanlinna functions and the inverse three spectra problem

    Directory of Open Access Journals (Sweden)

    Olga Boyko


    Full Text Available The three spectra problem of recovering the Sturm-Liouville equation by the spectrum of the Dirichlet-Dirichlet boundary value problem on \\([0,a]\\, the Dirichlet-Dirichlet problem on \\([0,a/2]\\ and the Neumann-Dirichlet problem on \\([a/2,a]\\ is considered. Sufficient conditions of solvability and of uniqueness of the solution to such a problem are found.

  9. Fermi-edge singularity in photoluminescence spectra of modulation ...

    Indian Academy of Sciences (India)


    As/GaAs (Brown et al 1997) and AlxGa1–xAs/InyGa1–y. As/GaAs ... experimental observations on FES (Brown et al 1997; van der .... and Jones 1988). The subband structures of these modula-. Figure. 3. Temperature dependent evolution of PL spectra in sample 2. Figure 4. Evolution of FES with temperature in sample 1.

  10. Mass Spectra and Ion Collision Cross Sections of Hemoglobin (United States)

    Kang, Yang; Terrier, Peran; Douglas, D. J.


    Mass spectra of commercially obtained hemoglobin (Hb) show higher levels of monomer and dimer ions, heme-deficient dimer ions, and apo-monomer ions than hemoglobin freshly prepared from blood. This has previously been attributed to oxidation of commercial Hb. Further, it has been reported that that dimer ions from commercial bovine Hb have lower collision cross sections than low charge state monomer ions. To investigate these effects further, we have recorded mass spectra of fresh human Hb, commercial human and bovine Hb, fresh human Hb oxidized with H2O2, lyophilized fresh human Hb, fresh human Hb both lyophilized and chemically oxidized, and commercial human Hb oxidized with H2O2. Masses of α-monomer ions of all hemoglobins agree with the masses expected from the sequences within 3 Da or better. Mass spectra of the β chains of commercial Hb and oxidized fresh human Hb show a peak or shoulder on the high mass side, consistent with oxidation of the protein. Both commercial proteins and oxidized fresh human Hb produce heme-deficient dimers with masses 32 Da greater than expected and higher levels of monomer and dimer ions than fresh Hb. Lyophilization or oxidation of Hb both produce higher levels of monomer and dimer ions in mass spectra. Fresh human Hb, commercial human Hb, commercial bovine Hb, and oxidized commercial human Hb all give dimer ions with cross sections greater than monomer ions. Thus, neither oxidation of Hb or the difference in sequence between human and bovine Hb make substantial differences to cross sections of ions.

  11. Manifestation of the Fermi resonance in surface polariton spectra (United States)

    Puchkovskaya, G. A.; Strizhevskiy, V. L.; Frolkov, Y. A.; Chepilko, N. M.; Krivodonova, L. A.


    The method of disturbed full internal reflection (DFIR) is used to detect and interpret the resonance splitting of the surface polariton. The effect in the spectra of oscillatory SP which are reflected by the DFIR method in Otto geometry was experimentally recorded. It is concluded that the resonance splitting of the dispersion branch of SP may serve as an effective method for detecting weak oscillations and for measuring their parameters.

  12. Influence of hydrogen on hydrogenated cadmium telluride optical spectra

    Energy Technology Data Exchange (ETDEWEB)

    Pociask, M.; Polit, J.; Sheregii, E.; Cebulski, J. [Institute of Physics, University of Rzeszow (Poland); Kisiel, A. [Institute of Physics, Jagiellonian University, Krakow (Poland); Mycielski, A. [Institute of Physics, PAS, Warszawa (Poland); Morgiel, J. [Polish Academy of Sciences, Institute of Metallurgy and Materials Sciences, Krakow (Poland); Piccinini, M. [INFN-Laboratori Nazionali di Frascati (Italy); Dipartimento Scienze Geologiche, Universita Roma Tre, Rome (Italy); Marcelli, A.; Robouch, B.; Guidi, M.C. [INFN-Laboratori Nazionali di Frascati (Italy); Savchyn, V. [Ivan Franko Lviv National University (Ukraine); Izhnin, I.I. [Institute for Materials SRC ' ' Carat' ' , Lviv (Ukraine); Zajdel, P. [Institute of Fizyki, University of Silesia, 4 Uniwersytecka Str., 40-007 Katowice (Poland); Nucara, A. [Universita' di Roma La Sapienza, P. le Aldo Moro 1, Rome (Italy)


    The presence of oxygen impurity in semiconducting materials affects the electrical properties of crystals and significantly limits their application. To remove oxygen impurity, ultra-pure hydrogen is used while growing Te-containing crystals such as CdTe, CdZnTe, and ZnTe. The hydrogenation of CdTe crystals is a technological process that purifies the basic material from oxygen, mainly cadmium and tellurium oxide compounds incorporated in CdTe crystalline lattice. In the present work we analyses the deformations induced by hydrogen and oxygen atoms in CdTe crystals looking at their influence on the near fundamental band (NFB), middle infrared (MIR) and far infrared (FIR) reflectivity spectra as well as on cathodoluminescence (CL) spectra. Comparison of the hydrogenated CdTe phonon structure profiles confirms the presence of hydrogen atoms bounded inside the lattice. The possible localization of hydrogen and oxygen ions within the tetrahedron coordinated lattice is discussed in the framework of a model that shows a good agreement with recent NFB, MIR and FIR experiments carried out on hydrogenated CdTe crystals. Measured reflection spectra in the wavelength range 190-1400 nm (NFB) indicate the appearance in CdTe(H{sub M}) and CdTe(H{sub L}) of additional maxima at 966 nm related to the electron transitions from level about 0.2 eV above the valence band. The CL spectra confirmed existence of this electron level. We present a possible H{sub 2} alignment similar to the single H model i.e., over the face (at about 0.38 Aa). For this model the angle from the central atom to the H atoms is equal to 64 which is also close to the bonding angle of CdH{sub 2} (copyright 2009 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  13. Properties of interface phonon spectra in complicated cylindrical nanosystem

    Directory of Open Access Journals (Sweden)



    Full Text Available The spectra of two types of interface phonons (top and side optical are studied within the framework of dielectric continuum model for combined nanoheterosystems consisting of semiconductor cylindrical quantum dots inside the cylindrical quantum wire placed into dielectric or semiconductor medium. The dependencies of both types of interface phonon energies on the quasiwave numbers and geometric parameters of nanosystem are calculated and analysed.

  14. High-resolution x-ray photoemission spectra of silver

    DEFF Research Database (Denmark)

    Barrie, A.; Christensen, N. E.


    An electron spectrometer fitted with an x-ray monochromator for Al Kα1,2 radiation (1486.6 eV) has been used to record high-resolution x-ray photoelectron spectra for the 4d valence band as well as the 3d spin doublet in silver. The core-level spectrum has a line shape that can be described...

  15. Photoelectron spectra and biological activity of cinnamic acid derivatives revisited (United States)

    Novak, Igor; Klasinc, Leo; McGlynn, Sean P.


    The electronic structures of several derivatives of cinnamic acid have been studied by UV photoelectron spectroscopy (UPS) and Green's function quantum chemical calculations. The spectra reveal the presence of dimers in the gas phase for p-coumaric and ferulic acids. The electronic structure analysis has been related to the biological properties of these compounds through the analysis of some structure-activity relationships (SAR).

  16. Spreadsheet analysis of gamma spectra for nuclear material measurements

    Energy Technology Data Exchange (ETDEWEB)

    Mosby, W.R.; Pace, D.M.


    A widely available commercial spreadsheet package for personal computers is used to calculate gamma spectra peak areas using both region of interest and peak fitting methods. The gamma peak areas obtained are used for uranium enrichment assays and for isotopic analyses of mixtures of transuranics. The use of spreadsheet software with an internal processing language allows automation of routine analysis procedures increasing ease of use and reducing processing errors while providing great flexibility in addressing unusual measurement problems. 4 refs., 9 figs.

  17. Observing the Spectra of MEarth and TRAPPIST Planets with JWST (United States)

    Morley, Caroline; Kreidberg, Laura; Rustamkulov, Zafar; Robinson, Tyler D.; Fortney, Jonathan J.


    During the past two years, nine planets close to Earth in radius have been discovered around nearby M dwarfs cooler than 3300 K. These planets include the 7 planets in the TRAPPIST-1 system and two planets discovered by the MEarth survey, GJ 1132b and LHS 1140b (Dittmann et al. 2017; Berta-Thompson et al. 2015; Gillon et al. 2017). These planets are the smallest planets discovered to date that will be amenable to atmospheric characterization with JWST. They span equilibrium temperatures from ˜130 K to >500 K, and radii from 0.7 to 1.43 Earth radii. Some of these planets orbit as distances potentially amenable to surface liquid water, though the actual surface temperatures will depend strongly on the albedo of the planet and the thickness and composition of its atmosphere. The stars they orbit also vary in activity levels, from the quiet LHS 1140b host star to the more active TRAPPIST-1 host star. This set of planets will form the testbed for our first chance to study the diversity of atmospheres around Earth-sized planets. Here, we will present model spectra of these 9 planets, varying the composition and the surface pressure of the atmosphere. We base our elemental compositions on three outcomes of planetary atmosphere evolution in our own solar system: Earth, Titan, and Venus. We calculate the molecular compositions in chemical equilibrium. We present both thermal emission spectra and transmission spectra for each of these objects, and make predictions for the observability of these spectra with different instrument modes with JWST.

  18. Forecasting the Impact of Stellar Activity on Transiting Exoplanet Spectra


    Zellem, Robert T.; Swain, Mark R.; Roudier, Gael; Shkolnik, Evgenya L.; Creech-Eakman, Michelle J.; Ciardi, David R.; Line, Michael R.; Iyer, Aishwarya R.; Bryden, Geoffrey; Llama, Joe; Fahy, Kristen A.


    Exoplanet host star activity, in the form of unocculted starspots or faculae, alters the observed transmission and emission spectra of the exoplanet. This effect can be exacerbated when combining data from different epochs if the stellar photosphere varies between observations due to activity. Here, we present a method to characterize and correct for relative changes due to stellar activity by exploiting multi-epoch (⩾2 visits/transits) observations to place them in a consistent reference fra...

  19. Reconstruction of neutron spectra through neural networks; Reconstruccion de espectros de neutrones mediante redes neuronales

    Energy Technology Data Exchange (ETDEWEB)

    Vega C, H.R.; Hernandez D, V.M.; Manzanares A, E. [Cuerpo Academico de Radiobiologia, Estudios Nucleares, Universidad Autonoma de Zacatecas, A.P. 336, 98000 Zacatecas (Mexico)] e-mail: [and others


    A neural network has been used to reconstruct the neutron spectra starting from the counting rates of the detectors of the Bonner sphere spectrophotometric system. A group of 56 neutron spectra was selected to calculate the counting rates that would produce in a Bonner sphere system, with these data and the spectra it was trained the neural network. To prove the performance of the net, 12 spectra were used, 6 were taken of the group used for the training, 3 were obtained of mathematical functions and those other 3 correspond to real spectra. When comparing the original spectra of those reconstructed by the net we find that our net has a poor performance when reconstructing monoenergetic spectra, this attributes it to those characteristic of the spectra used for the training of the neural network, however for the other groups of spectra the results of the net are appropriate with the prospective ones. (Author)

  20. Fluorescence spectra of benign and malignant prostate tissues (United States)

    AlSalhi, M. S.; Masilamani, V.; Atif, M.; Farhat, K.; Rabah, D.; Turki, M. R. Al


    In this study, fluorescence emission spectrum (FES), Stokes' shift spectrum (SSS), and reflectance spectrum (RS) of benign (N = 12) and malignant prostate tissues (N = 8) were investigated to discriminate the two types of tissues. The FES was done with the excitation at 325 nm only; SSS with Δλ = 70 and Δλ = 0, the latter being equivalent to reflectance spectra. Of the three modes of spectra, SSS with Δλ = 70 nm showed the best discrimination. There were four important bands, one at 280 nm (due to tryptophan); 320 nm (due to elastin & tryptophan); 355 and 385 (due to NADH) and 440 nm (due to flavin). From the relative intensities of these bands, three ratios were evaluated. Similarly another two ratios were obtained from reflectance spectra and one more from FES. Thus, there are 6 ratio parameters which represent the relative concentration of tryptophan, elastin, nicotinamide adenine dinucleotide (NADH), and flavin. A statistical analysis showed that benign and malignant tissues could be classified with accuracy greater than 90%. This report is only for in vitro analysis; but employing optical fiber, this can be extended to in vivo analysis too, so that benign tumor could be distinguished without surgery.

  1. Electronic Properties of Random Polymers: Modelling Optical Spectra of Melanins (United States)

    Bochenek, Kinga; Gudowska-Nowak, Ewa


    Melanins are a group of complex pigments of biological origin, widely spread in all species from fungi to man. Among diverse types of melanins, the human melanins, eumelanins, are brown or black nitrogen-containing pigments, mostly known for their photoprotective properties in human skin. We have undertaken theoretical studies aimed to understand absorption spectra of eumelanins and their chemical precursors. The structure of the biopigment is poorly defined, although it is believed to be composed of cross-linked heteropolymers based on indolequinones. As a basic model of the eumelanin structure, we have chosen pentamers containing hydroquinones (HQ) and/or 5,6-indolequinones (IQ) and/or semiquinones (SQ) often listed as structural melanin monomers. The eumelanin oligomers have been constructed as random compositions of basic monomers and optimized for the energy of bonding. Absorption spectra of model assemblies have been calculated within the semiempirical intermediate neglect of differential overlap (INDO) approximation. Model spectrum of eumelanin has been further obtained by sum of independent spectra of singular polymers. By comparison with experimental data it is shown that the INDO/CI method manages to reproduce well characteristic properties of experimental spectrum of synthetic eumelanins.

  2. Pascal's triangle and the simulation of backscattering spectra (United States)

    Bozoian, Michael


    Applying a well-known yield equation to a stack of very thin sublayers allows accurate simulations of homogeneous, thick-target, backscattering spectra. Explicit expressions, accurate to at least third degree in the areal density for the ion energy immediately before scattering and for the detected ion energy, are found. These expressions are in terms of binomial expansions of a quantity equaling the product of the areal density multiplied by a function of stopping cross section derivatives and areal density. One iterative parameter, taken as the near-surface yield, is required to properly normalize the simulation with respect to the experimental spectrum. Several thick target spectra, produced by bombarding helium ions with energies ranging over several MeV, are simulated using both Ziegler's 1977 [J.F. Ziegler, Helium Stopping Powers and Ranges in All Elements (Pergamon, New York, 1977)] and 1985 [J.F. Ziegler, J.P. Biersack and U. Littmark, The Stopping and Range of Ions in Solids (Pergamon, New York, 1985)] stopping compilations to ascertain the impact of these differing stopping cross sections on predictions of backscattering spectra.

  3. Computer enhancement of ESR spectra of magnetite nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Dobosz, B.; Krzyminiewski, R. [Medical Physics Division, Faculty of Physics, Adam Mickiewicz University, Umultowska 85, 61-614 Poznan (Poland); Koralewski, M. [Optics Laboratory, Faculty of Physics, Adam Mickiewicz University, Umultowska 85, 61-614 Poznan (Poland); Hałupka-Bryl, M. [Medical Physics Division, Faculty of Physics, Adam Mickiewicz University, Umultowska 85, 61-614 Poznan (Poland); The PhD Program in Nanoscience and Nanotechnology, The Nanobiomedical Centre, Umultowska 85, 61-614 Poznan (Poland)


    We present ESR measurements of non-interacting magnetic nanoparticle systems. Temperature and orientational dependence of ESR spectra were measured for Fe{sub 3}O{sub 4} nanoparticle coated by dextran or oleic acid, frozen in different magnetic field. Several parameters describing magnetic properties such as g-factor, line width, the anisotropy constant were calculated and discussed. The ESR spectra of investigated nanoparticles were also subjected to Computer Resolution Enhancement Method (CREM). This procedure allows to separate a narrow line on the background of the broad line, which presence in this type of materials was recognized in the recent literature and have been further discussed in the paper. CREM is a valuable tool for monitoring of changes on the surface of magnetic core of nanoparticles. - Highlights: • CREM – a new tool for monitoring of changes on the surface of magnetic core of nanoparticles. • CREM allows to separate a narrow line on the background of the broad line. • Temperature and orientational dependence of ESR spectra of Fe{sub 3}O{sub 4} nanoparticles were measured. • Parameters describing magnetic properties were calculated and discussed.

  4. Synthetic spectra of simulated terrestrial atmospheres containing possible biomarker gases (United States)

    Schindler, T. L.; Kasting, J. F.


    NASA's proposed Terrestrial Planet Finder, a space-based interferometer, will eventually allow spectroscopic analyses of the atmospheres of extrasolar planets. Such analyses would provide information about the existence of life on these planets. One strategy in the search for life is to look for evidence of O3 (and hence O2) in a planet's atmosphere; another is to look for gases that might be present in an atmosphere analogous to that of the inhabited early Earth. In order to investigate these possibilities, we have calculated synthetic spectra for several hypothetical terrestrial-type atmospheres. The model atmospheres represent four different scenarios. The first two, representing inhabited terrestrial planets, are an Earth-like atmosphere containing variable amounts of oxygen and an early Earth-type atmosphere containing methane. In addition, two cases representing Mars-like and early Venus-like atmospheres were evaluated, to provide possible "false positive" spectra. The calculated spectra suggest that ozone could be detected by an instrument like Terrestrial Planet Finder if the O2 concentration in the planet's atmosphere is > or = 200 ppm, or 10(-3) times the present atmospheric level. Methane should be observable on an early-Earth type planet if it is present in concentrations of 100 ppm or more. Methane has both biogenic and abiogenic sources, but concentrations exceeding 1000 ppm, or 0.1% by volume, would be difficult to produce from abiogenic sources alone. High methane concentrations in a planet's atmosphere are therefore another potential indicator for extraterrestrial life.

  5. a Symmetry Based Study of Positron Annihilation Spectra (United States)

    Adam, Gh.; Adam, S.

    We describe a method for off-line analysis of spectra measured by two-dimensional angular correlation of annihilation radiation ({2D}-{ACAR}) positron spectroscopy. The method takes into account, at all its stages, two salient data features: the piecewise constant discretization of the {2D} physical momentum distribution into square pixels, performed by the setup, and the occurrence of a characteristic {2D} projected symmetry of the positron-electron pair momentum distribution. Several validating criteria are derived which secure significantly increased reliability of the output. The method is tested on {2D}-{ACAR} spectra measured on (R)Ba2Cu3O7-δ (R123; R= Y, Dy) single crystals. It resolves ridge Fermi surfaces ({FS}) up to 3rd Umklapp components on both kinds of R123 spectra. Moreover, on a c-axis-projected Y123 spectrum, measured at 300 K, it resolves a small but clear signature of the pillbox {FS} at the S point of the first Brillouin zone as well.

  6. Sub-millimetre wave absorption spectra of artificial RNA molecules

    CERN Document Server

    Globus, T; Woolard, D; Gelmont, B


    We demonstrate submillimetre-wave Fourier transform spectroscopy as a novel technique for biological molecule characterization. Transmission measurements are reported at frequencies 10-25 cm sup - sup 1 for single- and double-stranded RNA molecules of known base-pair sequences: homopolymers poly[A], poly[U], poly[C] and poly[G], and double-stranded homopolymers poly[A]-poly[U] and poly[C]-poly[G]. Multiple resonances are observed (i.e. in the microwave through terahertz frequency regime). We also present a computational method to predict the low-frequency absorption spectra of short artificial DNA and RNA. Theoretical conformational analysis of molecules was utilized to derive the low-frequency vibrational modes. Oscillator strengths were calculated for all the vibrational modes in order to evaluate their weight in the absorption spectrum of a molecule. Normal modes and absorption spectra of the double-stranded RNA chain poly[C]-poly[G] were calculated. The absorption spectra extracted from the experiment wer...

  7. Gamma-ray spectra of individual components of decay series (United States)

    Griffin, Henry


    In order to obtain high quality spectra to update the ``Heath Catalog" of spectra with Ge detectors, we (I and a group of Univ. of Michigan undergraduates*) have investigated the neutron activation and decay products related to natural thorium and natural uranium. We have used the UM Ford Nuclear Reactor for irradiations and the UM Phoenix Memorial Lab for the remaining work. Spectra have been obtained with a variety of detectors, some suitable for low energies (>5 keV) and others efficient (70%) for high energies. Sources have been obtained in a variety of forms, each of which has been characterized in comparison with a thin, point source. We will report on A=233 (Th, Pa, and U, and the Np-237 parent of Pa-233), A=234 (Th and the Pa isomers), and A=239 (U, Np, and the Am-243 parent of Np-239). *The 2000-01 undergrad research group consists of Jason Banker, Adam Berro, Adam Cole, Amelia Deschamps, Erik Epp, Ralph Pierre, and Emma Wong.

  8. Proton and Helium Spectra from the CREAM-III Flight (United States)

    Yoon, Y. S.; Anderson, T.; Barrau, A.; Conklin, N. B.; Coutu, S.; Derome, L.; Han, J. H.; Jeon, J. A.; Kim, K. C.; Kim, M. H.; Lee, H. Y.; Lee, J.; Lee, M. H.; Lee, S. E.; Link, J. T.; Menchaca-Rocha, A.; Mitchell, J. W.; Mognet, S. I.; Nutter, S.; Park, I. H.; Picot-Clemente, N.; Putze, A.; Seo, E. S.; Smith, J.; Wu, J.


    Primary cosmic-ray elemental spectra have been measured with the balloon-borne Cosmic Ray Energetics And Mass (CREAM) experiment since 2004. The third CREAM payload (CREAM-III) flew for 29 days during the 2007-2008 Antarctic season. Energies of incident particles above 1 TeV are measured with a calorimeter. Individual elements are clearly separated with a charge resolution of ˜0.12 e (in charge units) and ˜0.14 e for protons and helium nuclei, respectively, using two layers of silicon charge detectors. The measured proton and helium energy spectra at the top of the atmosphere are harder than other existing measurements at a few tens of GeV. The relative abundance of protons to helium nuclei is 9.53 ± 0.03 for the range of 1 TeV/n to 63 TeV/n. This ratio is considerably smaller than other measurements at a few tens of GeV/n. The spectra become softer above ˜20 TeV. However, our statistical uncertainties are large at these energies and more data are needed.

  9. Proton and Helium Spectra from the CREAM-III Flight

    Energy Technology Data Exchange (ETDEWEB)

    Yoon, Y. S.; Han, J. H.; Kim, K. C.; Kim, M. H.; Lee, M. H.; Lee, S. E. [Institute for Physical Science and Technology, University of Maryland, College Park, MD, 20742 (United States); Anderson, T.; Conklin, N. B.; Coutu, S.; Mognet, S. I. [Department of Physics, Penn State University, University Park, PA 16802 (United States); Barrau, A.; Derome, L. [Laboratoire de Physique Subatomique et Cosmologie, Grenoble (France); Jeon, J. A.; Lee, H. Y.; Lee, J.; Park, I. H. [Department of Physics, Sungkyunkwan University, Suwon 16419 (Korea, Republic of); Link, J. T.; Mitchell, J. W. [Astrophysics Space Division, NASA Goddard Space Flight Center, Greenbelt, MD 20771 (United States); Menchaca-Rocha, A. [Instituto de Fisica, Universidad Nacional Autonoma de Mexico (Mexico); Nutter, S. [Department of Physics, Northern Kentucky University, Highland Heights, KY 41099 (United States); and others


    Primary cosmic-ray elemental spectra have been measured with the balloon-borne Cosmic Ray Energetics And Mass (CREAM) experiment since 2004. The third CREAM payload (CREAM-III) flew for 29 days during the 2007–2008 Antarctic season. Energies of incident particles above 1 TeV are measured with a calorimeter. Individual elements are clearly separated with a charge resolution of ∼0.12 e (in charge units) and ∼0.14 e for protons and helium nuclei, respectively, using two layers of silicon charge detectors. The measured proton and helium energy spectra at the top of the atmosphere are harder than other existing measurements at a few tens of GeV. The relative abundance of protons to helium nuclei is 9.53 ± 0.03 for the range of 1 TeV/n to 63 TeV/n. This ratio is considerably smaller than other measurements at a few tens of GeV/n. The spectra become softer above ∼20 TeV. However, our statistical uncertainties are large at these energies and more data are needed.

  10. Impact of Fission Neutron Energies on Reactor Antineutrino Spectra (United States)

    Hermanek, Keith; Littlejohn, Bryce; Gustafson, Ian


    Recent measurements of the reactor antineutrino spectra (Double Chooz, Reno, and Daya Bay) have shown a discrepancy in the 5-7 MeV region when compared to current theoretical models (Vogel and Huber-Mueller). There are numerous theories pertaining to this antineutrino anomaly, including theories that point to new physics beyond the standard model. In the paper ``Possible Origins and Implications of the Shoulder in Reactor Neutrino Spectra'' by A. Hayes et al., explanations for this anomaly are suggested. One theory is that there are interactions from fast and epithermal incident neutrons which are significant enough to create more events in the 5-7 MeV by a noticeable amount. In our research, we used the Oklo software network created by Dan Dwyer. This generates ab initio antineutrino and beta decay spectra based on standard fission yield databases ENDF, JENDL, JEFF, and the beta decay transition database ENSDF-6. Utilizing these databases as inputs, we show with reasonable assumptions one can prove contributions of fast and epithermal neutrons is less than 3% in the 5-7 MeV region. We also discovered rare isotopes are present in beta decay chains but not well measured and have no corresponding database information, and studied its effect onto the spectrum.

  11. Hydration of amino acids: FTIR spectra and molecular dynamics studies. (United States)

    Panuszko, Aneta; Adamczak, Beata; Czub, Jacek; Gojło, Emilia; Stangret, Janusz


    The hydration of selected amino acids, alanine, glycine, proline, valine, isoleucine and phenylalanine, has been studied in aqueous solutions by means of FTIR spectra of HDO isotopically diluted in H2O. The difference spectra procedure and the chemometric method have been applied to remove the contribution of bulk water and thus to separate the spectra of solute-affected HDO. To support interpretation of obtained spectral results, molecular dynamics simulations of amino acids were performed. The structural-energetic characteristic of these solute-affected water molecules shows that, on average, water affected by amino acids forms stronger and shorter H-bonds than those in pure water. Differences in the influence of amino acids on water structure have been noticed. The effect of the hydrophobic side chain of an amino acid on the solvent interactions seems to be enhanced because of the specific cooperative coupling of water strong H-bond chain, connecting the carboxyl and amino groups, with the clathrate-like H-bond network surrounding the hydrocarbon side chain. The parameter derived from the spectral data, which corresponds to the contributions of the population of weak hydrogen bonds of water molecules which have been substituted by the stronger ones in the hydration sphere of amino acids, correlated well with the amino acid hydrophobicity indexes.

  12. Theoretical modeling of infrared spectra of the hydrogen and deuterium bond in aspirin crystal (United States)

    Ghalla, Houcine; Rekik, Najeh; Michta, Anna; Oujia, Brahim; Flakus, Henryk T.


    An extended quantum theoretical approach of the ν IR lineshape of cyclic dimers of weakly H-bonded species is proposed. We have extended a previous approach [M.E.-A. Benmalti, P. Blaise, H.T. Flakus, O. Henri-Rousseau, Chem. Phys. 320 (2006) 267] by accounting for the anharmonicity of the slow mode which is described by a "Morse" potential in order to reproduce the polarized infrared spectra of the hydrogen and deuterium bond in acetylsalicylic acid (aspirin) crystals. From comparison of polarized IR spectra of isotopically neat and isotopically diluted aspirin crystals it resulted that centrosymmetric aspirin dimer was the bearer of the crystal main spectral properties. In this approach, the adiabatic approximation is performed for each separate H-bond bridge of the dimer and a strong non-adiabatic correction is introduced into the model via the resonant exchange between the fast mode excited states of the two moieties. Within the strong anharmonic coupling theory, according to which the X-H→⋯Y high-frequency mode is anharmonically coupled to the H-bond bridge, this model incorporated the Davydov coupling between the excited states of the two moieties, the quantum direct and indirect dampings and the anharmonicity for the H-bond bridge. The spectral density is obtained within the linear response theory by Fourier transform of the damped autocorrelation functions. The evaluated spectra are in fairly good agreement with the experimental ones by using a minimum number of independent parameters. The effect of deuteration has been well reproduced by reducing simply the angular frequency of the fast mode and the anharmonic coupling parameter.

  13. Quantitative analysis of dinuclear manganese(II) EPR spectra. (United States)

    Golombek, Adina P; Hendrich, Michael P


    A quantitative method for the analysis of EPR spectra from dinuclear Mn(II) complexes is presented. The complex [(Me(3)TACN)(2)Mn(II)(2)(mu-OAc)(3)]BPh(4) (1) (Me(3)TACN=N, N('),N(")-trimethyl-1,4,7-triazacyclononane; OAc=acetate(1-); BPh(4)=tetraphenylborate(1-)) was studied with EPR spectroscopy at X- and Q-band frequencies, for both perpendicular and parallel polarizations of the microwave field, and with variable temperature (2-50K). Complex 1 is an antiferromagnetically coupled dimer which shows signals from all excited spin manifolds, S=1 to 5. The spectra were simulated with diagonalization of the full spin Hamiltonian which includes the Zeeman and zero-field splittings of the individual manganese sites within the dimer, the exchange and dipolar coupling between the two manganese sites of the dimer, and the nuclear hyperfine coupling for each manganese ion. All possible transitions for all spin manifolds were simulated, with the intensities determined from the calculated probability of each transition. In addition, the non-uniform broadening of all resonances was quantitatively predicted using a lineshape model based on D- and r-strain. As the temperature is increased from 2K, an 11-line hyperfine pattern characteristic of dinuclear Mn(II) is first observed from the S=3 manifold. D- and r-strain are the dominate broadening effects that determine where the hyperfine pattern will be resolved. A single unique parameter set was found to simulate all spectra arising for all temperatures, microwave frequencies, and microwave modes. The simulations are quantitative, allowing for the first time the determination of species concentrations directly from EPR spectra. Thus, this work describes the first method for the quantitative characterization of EPR spectra of dinuclear manganese centers in model complexes and proteins. The exchange coupling parameter J for complex 1 was determined (J=-1.5+/-0.3 cm(-1); H(ex)=-2JS(1).S(2)) and found to be in agreement with a

  14. Measuring neutron spectra in radiotherapy using the nested neutron spectrometer. (United States)

    Maglieri, Robert; Licea, Angel; Evans, Michael; Seuntjens, Jan; Kildea, John


    Out-of-field neutron doses resulting from photonuclear interactions in the head of a linear accelerator pose an iatrogenic risk to patients and an occupational risk to personnel during radiotherapy. To quantify neutron production, in-room measurements have traditionally been carried out using Bonner sphere systems (BSS) with activation foils and TLDs. In this work, a recently developed active detector, the nested neutron spectrometer (NNS), was tested in radiotherapy bunkers. The NNS is designed for easy handling and is more practical than the traditional BSS. Operated in current-mode, the problem of pulse pileup due to high dose-rates is overcome by measuring current, similar to an ionization chamber. In a bunker housing a Varian Clinac 21EX, the performance of the NNS was evaluated in terms of reproducibility, linearity, and dose-rate effects. Using a custom maximum-likelihood expectation-maximization algorithm, measured neutron spectra at various locations inside the bunker were then compared to Monte Carlo simulations of an identical setup. In terms of dose, neutron ambient dose equivalents were calculated from the measured spectra and compared to bubble detector neutron dose equivalent measurements. The NNS-measured spectra for neutrons at various locations in a treatment room were found to be consistent with expectations for both relative shape and absolute magnitude. Neutron fluence-rate decreased with distance from the source and the shape of the spectrum changed from a dominant fast neutron peak near the Linac head to a dominant thermal neutron peak in the moderating conditions of the maze. Monte Carlo data and NNS-measured spectra agreed within 30% at all locations except in the maze where the deviation was a maximum of 40%. Neutron ambient dose equivalents calculated from the authors' measured spectra were consistent (one standard deviation) with bubble detector measurements in the treatment room. The NNS may be used to reliably measure the neutron

  15. Experimental Effects on IR Reflectance Spectra: Particle Size and Morphology

    Energy Technology Data Exchange (ETDEWEB)

    Beiswenger, Toya N.; Myers, Tanya L.; Brauer, Carolyn S.; Su, Yin-Fong; Blake, Thomas A.; Ertel, Alyssa B.; Tonkyn, Russell G.; Szecsody, James E.; Johnson, Timothy J.; Smith, Milton; Lanker, Cory


    For geologic and extraterrestrial samples it is known that both particle size and morphology can have strong effects on the species’ infrared reflectance spectra. Due to such effects, the reflectance spectra cannot be predicted from the absorption coefficients alone. This is because reflectance is both a surface as well as a bulk phenomenon, incorporating both dispersion as well as absorption effects. The same spectral features can even be observed as either a maximum or minimum. The complex effects depend on particle size and preparation, as well as the relative amplitudes of the optical constants n and k, i.e. the real and imaginary components of the complex refractive index. While somewhat oversimplified, upward-going amplitude in the reflectance spectrum usually result from surface scattering, i.e. rays that have been reflected from the surface without penetration, whereas downward-going peaks are due to either absorption or volume scattering, i.e. rays that have penetrated or refracted into the sample interior and are not reflected. While the effects are well known, we report seminal measurements of reflectance along with quantified particle size of the samples, the sizing obtained from optical microscopy measurements. The size measurements are correlated with the reflectance spectra in the 1.3 – 16 micron range for various bulk materials that have a combination of strong and weak absorption bands in order to understand the effects on the spectral features as a function of the mean grain size of the sample. We report results for both sodium sulfate Na2SO4 as well as ammonium sulfate (NH4)2SO4; the optical constants have been measured for (NH4)2SO4. To go a step further from the field to the laboratory we explore our understanding of particle size effects on reflectance spectra in the field using standoff detection. This has helped identify weaknesses and strengths in detection using standoff distances of up 160 meters away from the Target. The studies have

  16. Temperature dependent analysis of three classes of fluorescence spectra from p-6P nanofiber films

    DEFF Research Database (Denmark)

    Balzer, F.; Pogantsch, Alexander; Rubahn, Horst-Günter


    devices, given that the spectra are reproducible for varying surface temperatures. A detailed investigation as a function of surface temperature variation from 300 to 30 K reveals three classes of spectra: (a) spectra with well resolved excitonic peaks, which shift 35meV to the blue with decreasing...... temperature, (b) similar spectra with an additional intermediate broadening around 150 K, and (c) excitonic spectra similar to (b), but with a green defect emission band. Quantitative fitting of type (a) spectra results in an  exciton–phonon coupling factor of 80 ± 10meV and an average phonon temperature of Θ...

  17. Measurements of the neutral particle spectra on Mars by MSL/RAD from 2015-11-15 to 2016-01-15 (United States)

    Guo, Jingnan; Zeitlin, Cary; Wimmer-Schweingruber, Robert; Hassler, Donald M.; Köhler, Jan; Ehresmann, Bent; Böttcher, Stephan; Böhm, Eckart; Brinza, David E.


    The Radiation Assessment Detector (RAD), onboard the Mars Science Laboratory (MSL) rover Curiosity, has been measuring the energetic charged and neutral particles and the radiation dose rate on the surface of Mars since the landing of the rover in August 2012. In contrast to charged particles, neutral particles (neutrons and γ-rays) are measured indirectly: the energy deposition spectra produced by neutral particles are complex convolutions of the incident particle spectra with the detector response functions. An inversion technique has been developed and applied to jointly unfold the deposited energy spectra measured in two scintillators of different types (CsI for high γ detection efficiency, and plastic for neutrons) to obtain the neutron and γ-ray spectra. This result is important for determining the biological impact of the Martian surface radiation contributed by neutrons, which interact with materials differently from the charged particles. These first in-situ measurements on Mars provide (1) an important reference for assessing the radiation-associated health risks for future manned missions to the red planet and (2) an experimental input for validating the particle transport codes used to model the radiation environments within spacecraft or on the surface of planets. Here we present neutral particle spectra as well as the corresponding dose and dose equivalent rates derived from RAD measurement during a period (November 15, 2015 to January 15, 2016) for which the surface particle spectra have been simulated via different transport models.

  18. Investigating the Near-Infrared Properties of Planetary Nebulae II. Medium Resolution Spectra. 2; Medium Resolution Spectra (United States)

    Hora, Joseph L.; Latter, William B.; Deutsch, Lynne K.


    We present medium-resolution (R approximately 700) near-infrared (lambda = 1 - 2.5 micrometers) spectra of a sample of planetary nebulae (PNe). A narrow slit was used which sampled discrete locations within the nebulae; observations were obtained at one or more positions in the 41 objects included in the survey. The PN spectra fall into one of four general categories: H1 emission line-dominated PNe, H1 and H2 emission line PNe, H2 emission line-dominated PNe, and continuum-dominated PNe. These categories correlate with morphological type, with the elliptical PNe falling into the first group, and the bipolar PNe primarily in the H2 and continuum emission groups. The categories also correlate with C/O ratio, with the O-rich objects falling into the first group and the C-rich objects in the groups. Other spectral features were observed in all catagories, such as continuum emission from the central star, and warm dust continuum emission towards the long wavelength end of the spectra. H2 was detected in four PNe in this survey for the first time. An analysis was performed using the H2 line ratios in all of the PN spectra in the survey where a sufficient number of lines were observed to determine the ortho-to-para ratio and the rotational and vibrational excitation temperatures of the H-2 in those objects. One unexpected result from this analysis is that the H-2 is excited by absorption of ultraviolet photons in most of the PNe, although there are several PNe in which collisional excitation plays an important role. The correlation between bipolar morphology and H2 emission has been strengthened with the new detections of H2 in this survey.

  19. Distinguishing Vaccinium species by chemical fingerprinting based on NMR spectra, validated with spectra collected in different laboratories. (United States)

    Markus, Michelle A; Ferrier, Jonathan; Luchsinger, Sarah M; Yuk, Jimmy; Cuerrier, Alain; Balick, Michael J; Hicks, Joshua M; Killday, K Brian; Kirby, Christopher W; Berrue, Fabrice; Kerr, Russell G; Knagge, Kevin; Gödecke, Tanja; Ramirez, Benjamin E; Lankin, David C; Pauli, Guido F; Burton, Ian; Karakach, Tobias K; Arnason, John T; Colson, Kimberly L


    A method was developed to distinguish Vaccinium species based on leaf extracts using nuclear magnetic resonance spectroscopy. Reference spectra were measured on leaf extracts from several species, including lowbush blueberry (Vaccinium angustifolium), oval leaf huckleberry (Vaccinium ovalifolium), and cranberry (Vaccinium macrocarpon). Using principal component analysis, these leaf extracts were resolved in the scores plot. Analysis of variance statistical tests demonstrated that the three groups differ significantly on PC2, establishing that the three species can be distinguished by nuclear magnetic resonance. Soft independent modeling of class analogies models for each species also showed discrimination between species. To demonstrate the robustness of nuclear magnetic resonance spectroscopy for botanical identification, spectra of a sample of lowbush blueberry leaf extract were measured at five different sites, with different field strengths (600 versus 700 MHz), different probe types (cryogenic versus room temperature probes), different sample diameters (1.7 mm versus 5 mm), and different consoles (Avance I versus Avance III). Each laboratory independently demonstrated the linearity of their NMR measurements by acquiring a standard curve for chlorogenic acid (R(2) = 0.9782 to 0.9998). Spectra acquired on different spectrometers at different sites classifed into the expected group for the Vaccinium spp., confirming the utility of the method to distinguish Vaccinium species and demonstrating nuclear magnetic resonance fingerprinting for material validation of a natural health product. Georg Thieme Verlag KG Stuttgart · New York.

  20. Role of geometry on the frequency spectra of U-shaped atomic force microscope probes (United States)

    Rezaei, E.; Turner, J. A.


    Contact resonance atomic force microscopy (CR-AFM) is a specific technique that is used to determine elastic or viscoelastic properties of materials. The success of this technique is highly dependent on the accuracy of frequency spectra that must be measured for both noncontact and the case in which the tip is in contact with the sample of interest. Thus, choosing the right probe is crucial for accurate experiments. U-shaped probes also offer new opportunities for CR-AFM measurements because of certain specific modes that have tip motion parallel to the sample surface such that these resonances can access in-plane sample properties. However, analysis of the spectra from U-shaped probes is much more challenging due to these modes. The geometry of these probes is the main driver for the spectral response. Here, this influence on the resonance frequencies of the commercially fabricated U-shaped probe AN2-300 is evaluated with respect to geometry in terms of leg width, crossbeam width, and crossbeam length. Both noncontact and contact cases are examined with respect to variations of the nominal geometry. An energy distribution approach is also presented to assist with the identification of modes that have close resonances. Finally, this analysis allows recommendations to be made in order to minimize the convergence of multiple resonances for a specific range of measurement parameters.

  1. Mass spectra of alkaloids from cissampelos pareira L Mass spectra of alkaloids from cissampelos pareira L.

    Directory of Open Access Journals (Sweden)

    Aguirre Gálviz Luis Enrique


    -bidi-font-family:"Times New Roman"; mso-bidi-theme-font:minor-bidi; mso-fareast-language:EN-US;} .MsoPapDefault {mso-style-type:export-only; margin-bottom:10.0pt; line-height:115%;} @page WordSection1 {size:612.0pt 792.0pt; margin:70.85pt 3.0cm 70.85pt 3.0cm; mso-header-margin:36.0pt; mso-footer-margin:36.0pt; mso-paper-source:0;} div.WordSection1 {page:WordSection1;} -->

    The mass spectra of the tertiary bis-benzyl-isoquinoline alkaloids, warifteine and methyl-warifteine, extracted from the ethnobotanically important species, Cissampelos pareira L.. are discussed. Infonnation about the reltive positions of two hydroxyl and two methoxyl groups in warifteine and the presence of a p-xylyl moiety in both compounds in provided.

    Se presenta una discusión de los espectros de masas de warifteina y metilwarifteina, dos alcaloides

  2. Collective Spectra of the Resonant Inverse Compton Scattering of the Assembly of Relativistic Electrons in an Intense Magnetic Field (United States)

    Liu, D. B.; Huang, Y. F.; Danzeng, L. B.; Chen, T. L.


    The resonant inverse Compton scattering (RICS) of relativistic electrons in an intense magnetic field of a neutron star is an efficient mechanism for producing the high-energy γ-rays due to its high efficiency, high frequency, highly beaming behaviour and comparatively good monochromaticity, concentrating most radiation in the high-frequency band (hard X-ray and γ-ray). In our previous work, it is argued that the dominant radiation mechanism responsible for the prompt γ-ray emission of gamma-ray bursts (GRBs) in the early stage could be the RICS of relativistic electrons. By using this mechanism, some puzzles in the study of GRBs could be clarified, e.g., the origin of the Amati relation, the formation of the observed broken power-law spectra, the related deadline problem, the polarization property, etc. The simplified analytical formulae of collective RICS spectra of the assembly of relativistic electrons in an intense magnetic field are derived in this paper, based on the simple RICS power spectra of a single fast electron given in our previous work. By using these formulae, a series of collective RICS spectra for various typical ambient low-frequency radiation fields around the central neutron star, e.g., the black body radiation, the nonthermal field with a power-law spectrum and the thermal bremsstrahlung field, are calculated. The collective RICS spectra are all in quite simple analytical expressions, which are convenient for comparison with the observed spectra. Our calculations show that the RICS process is really a very efficient radiation mechanism in the hard X-ray and γ-ray bands if the "accommodation condition" (or the "matching condition") is satisfied. Our calculations show that despite what kind of ambient soft-photon field is related, various collective RICS spectra have common broken power-law forms with different indexes in the low- and high-frequency bands respectively. Finally, we discuss the potential applications of RICS mechanism in high

  3. Representation of bidirectional ground motions for design spectra in building codes (United States)

    Stewart, Jonathan P.; Abrahamson, Norman A.; Atkinson, Gail M.; Beker, Jack W.; Boore, David M.; Bozorgnia, Yousef; Campbell, Kenneth W.; Comartin, Craig D.; Idriss, I.M.; Lew, Marshall; Mehrain, Michael; Moehle, Jack P.; Naeim, Farzad; Sabol, Thomas A.


    The 2009 NEHRP Provisions modified the definition of horizontal ground motion from the geometric mean of spectral accelerations for two components to the peak response of a single lumped mass oscillator regardless of direction. These maximum-direction (MD) ground motions operate under the assumption that the dynamic properties of the structure (e.g., stiffness, strength) are identical in all directions. This assumption may be true for some in-plan symmetric structures, however, the response of most structures is dominated by modes of vibration along specific axes (e.g., longitudinal and transverse axes in a building), and often the dynamic properties (especially stiffness) along those axes are distinct. In order to achieve structural designs consistent with the collapse risk level given in the NEHRP documents, we argue that design spectra should be compatible with expected levels of ground motion along those principal response axes. The use of MD ground motions effectively assumes that the azimuth of maximum ground motion coincides with the directions of principal structural response. Because this is unlikely, design ground motions have lower probability of occurrence than intended, with significant societal costs. We recommend adjustments to make design ground motions compatible with target risk levels.

  4. Correcting attenuated total reflection-fourier transform infrared spectra for water vapor and carbon dioxide

    DEFF Research Database (Denmark)

    Bruun, Susanne Wrang; Kohler, Achim; Adt, Isabelle


    an absorption band from either water vapor or CO(2). From two calibration data sets, gas model spectra were estimated in each of the four spectral regions, and these model spectra were applied for correction of gas absorptions in two independent test sets (spectra of aqueous solutions and a yeast biofilm (C....... albicans) growing on an ATR crystal, respectively). The amounts of the atmospheric gases as expressed by the model spectra were estimated by regression, using second-derivative transformed spectra, and the estimated gas spectra could subsequently be subtracted from the sample spectra. For spectra...... of the growing yeast biofilm, the gas correction revealed otherwise hidden variations of relevance for modeling the growth dynamics. As the presented method improved the interpretation of the principle component analysis (PCA) models, it has proven to be a valuable tool for filtering atmospheric variation in ATR...

  5. Determination of temperature and concentrations of main components in flames by fitting measured Raman spectra

    NARCIS (Netherlands)

    Sepman, A. V.; Toro, V.V.; Mokhov, A. V.; Levinsky, H. B.

    The procedure of deriving flame temperature and major species concentrations by fitting measured Raman spectra in hydrocarbon flames is described. The approach simplifies the calibration procedure to determine temperature and major species concentrations from the measured Raman spectra. The

  6. Fitting of low-statistics peaks in alpha-particle spectra

    Energy Technology Data Exchange (ETDEWEB)

    Garcia-Torano, E. (Metrologia, Inst. de Investigacion Basica, CIEMAT, Madrid (Spain))


    The least-squares fitting of spectra with low statistics results in peak areas that depend on the definition of the statistical weights used in the minimization algorithm. This problem is of particular importance when analysing low-level spectra and complex spectra in which low-intensity peaks coexist with large ones. A typical example is the determination of alpha-particle emission probabilities by numerical analysis of alpha spectra obtained using semiconductor detectors. A systematic study has been carried out on the influence of different weights in the fitting of alpha-particle spectra. Reference spectra have been constructed by direct measurement or addition of several well-defined spectra. These spectra have been fitted by using different minimization criteria (Pearson's [chi][sup 2], Neyman's [chi][sup 2], and others), and the results have been compared. (orig.)

  7. On the spectra and coherence of some surface meteorological parameters in the Arabian Sea

    Digital Repository Service at National Institute of Oceanography (India)

    RameshKumar, M.R.; Fernandes, A.A.

    Spectra and cross-spectra of monthly time series of the surface meteorological parameters, sea surface temperature, air temperature, cloudiness, wind speed and sea level pressure were computed for the period 1948-1972 over the Arabian Sea...

  8. Infrared Spectra of Complexes Containing ACETYLENE-d2 (United States)

    Lauzin, Clément; Oliaee, J. Norooz; Moazzen-Ahmadi, N.; McKellar, A. R. W.


    Infrared spectra of the C_2D_2 dimer in the monomer νb{3} region (˜2439 wn) are observed by direct absorption using a rapid-scan tuneable diode laser spectrometer to probe a pulsed supersonic slit-jet expansion. We analyze the perpendicular K = 1-0 and 0-1 subbands of the vibrational mode involving the C_2D_2 monomer located at the top of the T-shaped dimer, but miss the parallel band involving the stem monomer vibration due to limited laser coverage. The results are consistent with previous work on acetylene dimers, but perturbations are much less evident than in the analogous infrared spectrum of C_2H_2. As expected, the tunneling splitting in the excited state (8 MHz) is much smaller than in the ground state (424 MHz). In the same region, we observe the H-bonded isomer of the C_2D_2-C_2H_2 dimer. This has not previously been observed, even though microwave spectra of almost every other conceivable deuterated isotopologue are known.B In addition to these acetylene dimers, our spectra also contain bands arising from impurities in the gas mixture which we assign to the C_2D_2-nitrogen and C_2D_2-water complexes [1] G.T. Fraser, R.D. Suenram, F.J. Lovas, A.S. Pine, J.T. Hougen, W.J. Lafferty, and J.S. Muenter, J. Chem. Phys. 89, 6028 (1988). [2] K. Matsumura, F.J. Lovas, and R.D. Suenram, J. Mol. Spectrosc. 150, 576 (1991)

  9. Far-infrared spectra for copper-zinc mixed ferrites

    Energy Technology Data Exchange (ETDEWEB)

    Zaki, H.M., E-mail: [Physics Department, Faculty of Science, King Abdul Aziz University, Jeddah (Saudi Arabia); Physics Department, Faculty of Science, Zagazig University (Egypt); Dawoud, H.A. [University of Gaza, P.O. Box 108, Gaza Strip, Palestine Physics Department (Palestinian Territory, Occupied)


    Infrared spectra of Zn{sup 2+} ions substituted Cu ferrites with the general formula Cu{sub 1-x}Zn{sub x}Fe{sub 2}O{sub 4} (where x=0.0, 0.2, 0.4, 0.6, 0.8 and 1) have been analyzed in the frequency range 200-1000 cm{sup -1}. These mixed ferrites were prepared by the standard double sintering ceramic method. Two prominent bands were observed, high-frequency band {nu}{sub 1} around 550 cm{sup -1} and low-frequency band {nu}{sub 2} around 395 cm{sup -1} and assigned to tetrahedral and octahedral sites for spinel lattice, respectively. On introducing zinc ions IR spectra indicate new shoulders or splitting on tetrahedral absorption bands around 600 and 700 cm{sup -1}. A small absorption band {nu}{sub 3} was observed around 310 cm{sup -1}. This indicates the migration of some Zn{sup 2+} ions to octahedral site. Another small weak absorption band was also observed around 265 cm{sup -1}; its intensity increased with Zn content. Force constant was calculated for both tetrahedral and octahedral sites. Threshold frequency {nu}{sub th} for the electronic transition was determined and found to increase with an increase in Zn ions. The half bandwidth for each site was calculated and the ratio seemed to increase with an increase in zinc content. The cation distribution for these ferrites was estimated in the light of IR spectra.

  10. Insights into quasar UV spectra using unsupervised clustering analysis (United States)

    Tammour, A.; Gallagher, S. C.; Daley, M.; Richards, G. T.


    Machine learning techniques can provide powerful tools to detect patterns in multidimensional parameter space. We use K-means - a simple yet powerful unsupervised clustering algorithm which picks out structure in unlabelled data - to study a sample of quasar UV spectra from the Quasar Catalog of the 10th Data Release of the Sloan Digital Sky Survey (SDSS-DR10) of Paris et al. Detecting patterns in large data sets helps us gain insights into the physical conditions and processes giving rise to the observed properties of quasars. We use K-means to find clusters in the parameter space of the equivalent width (EW), the blue- and red-half-width at half-maximum (HWHM) of the Mg II 2800 Å line, the C IV 1549 Å line, and the C III] 1908 Å blend in samples of broad absorption line (BAL) and non-BAL quasars at redshift 1.6-2.1. Using this method, we successfully recover correlations well-known in the UV regime such as the anti-correlation between the EW and blueshift of the C IV emission line and the shape of the ionizing spectra energy distribution (SED) probed by the strength of He II and the Si III]/C III] ratio. We find this to be particularly evident when the properties of C III] are used to find the clusters, while those of Mg II proved to be less strongly correlated with the properties of the other lines in the spectra such as the width of C IV or the Si III]/C III] ratio. We conclude that unsupervised clustering methods (such as K-means) are powerful methods for finding `natural' binning boundaries in multidimensional data sets and discuss caveats and future work.

  11. Infrared spectra in monitoring biochemical parameters of human blood (United States)

    Prabhakar, S.; Jain, N.; Singh, R. A.


    Infrared spectroscopy is gaining recognition as a promising method. The infrared spectra of selected regions (2000-400cm-1) of blood tissue samples are reported. Present study related to the role of spectral peak fitting in the study of human blood and quantitative interpretations of infrared spectra based on chemometrics. The spectral variations are interpreted in terms of the biochemical and pathological processes involved. The mean RNA/DNA ratio of fitted intensities and analytical area as calculated from the transmittance peaks at 1121cm-1/1020cm-1 is found to be 0.911A.U and 2.00A.U. respectively. The ratio of 1659cm-1/1544cm-1 (amide-I/amide-II) bands is found to shed light on the change in the DNA content. The ratio of amide-I/amide-II is almost unity (≈1.054) for blood spectra. The deviation from unity is an indication of DNA absorption from the RBC cells. The total phosphate content has found to be 25.09A.U. The level for glycogen/phosphate ratio (areas under peaks 1030cm-1/1082cm-1) is found to be 0.286A.U. The ratio of unsaturated and saturated carbonyl compounds (C=O) in blood samples is in form of esters and the analytical areas under the spectral peaks at 1740cm-1 and 1731cm-1 for unsaturated esters and saturated esters respectively found to be 0.618A.U.

  12. Objective identification of informative wavelength regions in galaxy spectra

    Energy Technology Data Exchange (ETDEWEB)

    Yip, Ching-Wa; Szalay, Alexander S.; Budavári, Tamás; Wyse, Rosemary F. G. [Department of Physics and Astronomy, The Johns Hopkins University, 3701 San Martin Drive, Baltimore, MD 21218 (United States); Mahoney, Michael W. [Department of Mathematics, Stanford University, Stanford, CA 94305 (United States); Csabai, István; Dobos, Laszlo, E-mail:, E-mail:, E-mail: [Department of Physics of Complex Systems, Eötvös Loránd University, H-1117 Budapest (Hungary)


    Understanding the diversity in spectra is the key to determining the physical parameters of galaxies. The optical spectra of galaxies are highly convoluted with continuum and lines that are potentially sensitive to different physical parameters. Defining the wavelength regions of interest is therefore an important question. In this work, we identify informative wavelength regions in a single-burst stellar population model using the CUR Matrix Decomposition. Simulating the Lick/IDS spectrograph configuration, we recover the widely used D {sub n}(4000), Hβ, and Hδ {sub A} to be most informative. Simulating the Sloan Digital Sky Survey spectrograph configuration with a wavelength range 3450-8350 Å and a model-limited spectral resolution of 3 Å, the most informative regions are: first region—the 4000 Å break and the Hδ line; second region—the Fe-like indices; third region—the Hβ line; and fourth region—the G band and the Hγ line. A principal component analysis on the first region shows that the first eigenspectrum tells primarily the stellar age, the second eigenspectrum is related to the age-metallicity degeneracy, and the third eigenspectrum shows an anti-correlation between the strengths of the Balmer and the Ca K and H absorptions. The regions can be used to determine the stellar age and metallicity in early-type galaxies that have solar abundance ratios, no dust, and a single-burst star formation history. The region identification method can be applied to any set of spectra of the user's interest, so that we eliminate the need for a common, fixed-resolution index system. We discuss future directions in extending the current analysis to late-type galaxies. ASCII formatted tables of the regional eigenspectra are available.

  13. Smoothed Spectra, Ogives, and Error Estimates for Atmospheric Turbulence Data (United States)

    Dias, Nelson Luís


    A systematic evaluation is conducted of the smoothed spectrum, which is a spectral estimate obtained by averaging over a window of contiguous frequencies. The technique is extended to the ogive, as well as to the cross-spectrum. It is shown that, combined with existing variance estimates for the periodogram, the variance—and therefore the random error—associated with these estimates can be calculated in a straightforward way. The smoothed spectra and ogives are biased estimates; with simple power-law analytical models, correction procedures are devised, as well as a global constraint that enforces Parseval's identity. Several new results are thus obtained: (1) The analytical variance estimates compare well with the sample variance calculated for the Bartlett spectrum and the variance of the inertial subrange of the cospectrum is shown to be relatively much larger than that of the spectrum. (2) Ogives and spectra estimates with reduced bias are calculated. (3) The bias of the smoothed spectrum and ogive is shown to be negligible at the higher frequencies. (4) The ogives and spectra thus calculated have better frequency resolution than the Bartlett spectrum, with (5) gradually increasing variance and relative error towards the low frequencies. (6) Power-law identification and extraction of the rate of dissipation of turbulence kinetic energy are possible directly from the ogive. (7) The smoothed cross-spectrum is a valid inner product and therefore an acceptable candidate for coherence and spectral correlation coefficient estimation by means of the Cauchy-Schwarz inequality. The quadrature, phase function, coherence function and spectral correlation function obtained from the smoothed spectral estimates compare well with the classical ones derived from the Bartlett spectrum.

  14. Compton spectra of atoms at high x-ray intensity (United States)

    Son, Sang-Kil; Geffert, Otfried; Santra, Robin


    Compton scattering is the nonresonant inelastic scattering of an x-ray photon by an electron and has been used to probe the electron momentum distribution in gas-phase and condensed-matter samples. In the low x-ray intensity regime, Compton scattering from atoms dominantly comes from bound electrons in neutral atoms, neglecting contributions from bound electrons in ions and free (ionized) electrons. In contrast, in the high x-ray intensity regime, the sample experiences severe ionization via x-ray multiphoton multiple ionization dynamics. Thus, it becomes necessary to take into account all the contributions to the Compton scattering signal when atoms are exposed to high-intensity x-ray pulses provided by x-ray free-electron lasers (XFELs). In this paper, we investigate the Compton spectra of atoms at high x-ray intensity, using an extension of the integrated x-ray atomic physics toolkit, xatom. As the x-ray fluence increases, there is a significant contribution from ionized electrons to the Compton spectra, which gives rise to strong deviations from the Compton spectra of neutral atoms. The present study provides not only understanding of the fundamental XFEL-matter interaction but also crucial information for single-particle imaging experiments, where Compton scattering is no longer negligible. , which features invited work from the best early-career researchers working within the scope of J. Phys. B. This project is part of the Journal of Physics series’ 50th anniversary celebrations in 2017. Sang-Kil Son was selected by the Editorial Board of J. Phys. B as an Emerging Leader.

  15. Handbook of proton-NMR spectra and data index

    CERN Document Server

    Asahi Research Center Co, Ltd


    Handbook of Proton-NMR Spectra and Data: Index to Volumes 1-10 compiles four types of indexes used in charting the proton-NMR spectral database -Chemical Name Index, Molecular Formula Index, Substructure Index, and Chemical Shift Index. The Chemical Name Index compiles all chemical names in alphabetical order, followed by a spectrum number. When the desired organic compound cannot be found in the Chemical Name Index or its nomenclature is unclear, it becomes necessary to look for a compound by means of its molecular formula, hence the Molecular Formula Index. A unique notation system for repre

  16. Spectra and dynamics of small molecules Alexander von Humboldt lectures

    CERN Document Server

    Field, Robert W


    These seven lectures are intended to serve as an introduction for beginning graduate students to the spectra of small molecules. The author succeeds in illustrating the concepts by using language and metaphors that capture and elegantly convey simple insights into dynamics that lie beyond archival molecular constants. The lectures can simultaneously be viewed as a collection of interlocking special topics that have fascinated the author and his students over the years. Though neither a textbook nor a scholarly monograph, the book provides an illuminating perspective that will benefit students and researchers alike.

  17. Nature of the Pygmy Resonance in Continuous Gamma-Spectra

    Energy Technology Data Exchange (ETDEWEB)

    Rekstad, J; Siem, S; Bernstein, L; Schiller, A; Garrett, P; Nelson, R; Guttormsen, M; Algin, E; Voinov, A


    Two-step-cascade spectra of the {sup 171}Yb(n, {gamma}{gamma}){sup 172}Yb reaction have been measured using thermal neutrons. They are compared to calculations based on experimental values of the level density and radiative strength function obtained from the {sup 173}Yb({sup 3}He,{alpha}{gamma}){sup 172}Yb reaction. The multipolarity of a 6.5(15) {mu}{sub N}{sup 2} resonance at 3.3(1) MeV in the strength function is determined to be M1 by this comparison.

  18. Evolution of transmission spectra of double cladding fiber during etching (United States)

    Ivanov, Oleg V.; Tian, Fei; Du, Henry


    We investigate the evolution of optical transmission through a double cladding fiber-optic structure during etching. The structure is formed by a section of SM630 fiber with inner depressed cladding between standard SMF-28 fibers. Its transmission spectrum exhibits two resonance dips at wavelengths where two cladding modes have almost equal propagation constants. We measure transmission spectra with decreasing thickness of the cladding and show that the resonance dips shift to shorter wavelengths, while new dips of lower order modes appear from long wavelength side. We calculate propagation constants of cladding modes and resonance wavelengths, which we compare with the experiment.

  19. Atomic transition probabilities of Ce I from Fourier transform spectra (United States)

    Lawler, J. E.; Chisholm, J.; Nitz, D. E.; Wood, M. P.; Sobeck, J.; Den Hartog, E. A.


    Atomic transition probabilities for 2874 lines of the first spectrum of cerium (Ce I) are reported. These data are from new branching fraction measurements on Fourier transform spectra normalized with previously reported radiative lifetimes from time-resolved laser-induced-fluorescence measurements (Den Hartog et al 2009 J. Phys. B: At. Mol. Opt. Phys. 42 085006). The wavelength range of the data set is from 360 to 1500 nm. Comparisons are made to previous investigations which are less extensive. Accurate Ce i transition probabilities are needed for lighting research and development on metal halide high-intensity discharge lamps.

  20. Energy Dependence of Inclusive Spectra in $e^{+} e^{-}$ Annihilation

    CERN Document Server

    Abreu, P; Adye, T; Adzic, P; Albrecht, Z; Alderweireld, T; Alekseev, G D; Alemany, R; Allmendinger, T; Allport, P P; Almehed, S; Amaldi, Ugo; Amapane, N; Amato, S; Anassontzis, E G; Andersson, P; Andreazza, A; Andringa, S; Antilogus, P; Apel, W D; Arnoud, Y; Åsman, B; Augustin, J E; Augustinus, A; Baillon, Paul; Bambade, P; Barão, F; Barbiellini, Guido; Barbier, R; Bardin, Dimitri Yuri; Barker, G; Baroncelli, A; Battaglia, Marco; Baubillier, M; Becks, K H; Begalli, M; Behrmann, A; Beillière, P; Belokopytov, Yu A; Belous, K S; Benekos, N C; Benvenuti, Alberto C; Bérat, C; Berggren, M; Bertini, D; Bertrand, D; Besançon, M; Bigi, M; Bilenky, S M; Bizouard, M A; Bloch, D; Blom, H M; Bonesini, M; Bonivento, W; Boonekamp, M; Booth, P S L; Borgland, A W; Borisov, G; Bosio, C; Botner, O; Boudinov, E; Bouquet, B; Bourdarios, C; Bowcock, T J V; Boyko, I; Bozovic, I; Bozzo, M; Branchini, P; Brenke, T; Brenner, R A; Brückman, P; Brunet, J M; Bugge, L; Buran, T; Burgsmüller, T; Buschbeck, Brigitte; Buschmann, P; Cabrera, S; Caccia, M; Calvi, M; Camporesi, T; Canale, V; Carena, F; Carroll, L; Caso, Carlo; Castillo-Gimenez, M V; Cattai, A; Cavallo, F R; Chabaud, V; Chapkin, M M; Charpentier, P; Chaussard, L; Checchia, P; Chelkov, G A; Chierici, R; Shlyapnikov, P; Chochula, P; Chorowicz, V; Chudoba, J; Cieslik, K; Collins, P; Contri, R; Cortina, E; Cosme, G; Cossutti, F; Cowell, J H; Crawley, H B; Crennell, D J; Crépé, S; Crosetti, G; Cuevas-Maestro, J; Czellar, S; Davenport, Martyn; Da Silva, W; Deghorain, A; Della Ricca, G; Delpierre, P A; Demaria, N; De Angelis, A; de Boer, Wim; De Clercq, C; De Lotto, B; De Min, A; De Paula, L S; Dijkstra, H; Di Ciaccio, Lucia; Dolbeau, J; Doroba, K; Dracos, M; Drees, J; Dris, M; Duperrin, A; Durand, J D; Eigen, G; Ekelöf, T J C; Ekspong, Gösta; Ellert, M; Elsing, M; Engel, J P; Erzen, B; Espirito-Santo, M C; Falk, E; Fanourakis, G K; Fassouliotis, D; Fayot, J; Feindt, Michael; Fenyuk, A; Ferrari, P; Ferrer, A; Ferrer-Ribas, E; Ferro, F; Fichet, S; Firestone, A; Flagmeyer, U; Föth, H; Fokitis, E; Fontanelli, F; Franek, B J; Frodesen, A G; Frühwirth, R; Fulda-Quenzer, F; Fuster, J A; Galloni, A; Gamba, D; Gamblin, S; Gandelman, M; García, C; Gaspar, C; Gaspar, M; Gasparini, U; Gavillet, P; Gazis, E N; Gelé, D; Ghodbane, N; Gil, I; Glege, F; Gokieli, R; Golob, B; Gómez-Ceballos, G; Gonçalves, P; González-Caballero, I; Gopal, Gian P; Gorn, L; Górski, M; Guz, Yu; Gracco, Valerio; Grahl, J; Graziani, E; Green, C; Grimm, H J; Gris, P; Grosdidier, G; Grzelak, K; Günther, M; Guy, J; Hahn, F; Hahn, S; Haider, S; Hallgren, A; Hamacher, K; Hansen, J; Harris, F J; Hedberg, V; Heising, S; Hernández, J J; Herquet, P; Herr, H; Hessing, T L; Heuser, J M; Higón, E; Holmgren, S O; Holt, P J; Hoorelbeke, S; Houlden, M A; Hrubec, Josef; Huet, K; Hughes, G J; Hultqvist, K; Jackson, J N; Jacobsson, R; Jalocha, P; Janik, R; Jarlskog, C; Jarlskog, G; Jarry, P; Jean-Marie, B; Johansson, E K; Jönsson, P E; Joram, C; Juillot, P; Kapusta, F; Karafasoulis, K; Katsanevas, S; Katsoufis, E C; Keränen, R; Kersevan, Borut P; Khomenko, B A; Khovanskii, N N; Kiiskinen, A P; King, B J; Kinvig, A; Kjaer, N J; Klapp, O; Klein, H; Kluit, P M; Kokkinias, P; Koratzinos, M; Kostyukhin, V; Kourkoumelis, C; Kuznetsov, O; Krammer, Manfred; Kriznic, E; Krstic, P S; Krumshtein, Z; Kubinec, P; Kurowska, J; Kurvinen, K L; Lamsa, J; Lane, D W; Langefeld, P; Laugier, J P; Lauhakangas, R; Ledroit, F; Lefébure, V; Leinonen, L; Leisos, A; Leitner, R; Lenzen, Georg; Lepeltier, V; Lesiak, T; Lethuillier, M; Libby, J; Liko, D; Lipniacka, A; Lippi, I; Lörstad, B; Loken, J G; Lopes, J H; López, J M; López-Fernandez, R; Loukas, D; Lutz, P; Lyons, L; MacNaughton, J N; Mahon, J R; Maio, A; Malek, A; Malmgren, T G M; Maltezos, S; Malychev, V; Mandl, F; Marco, J; Marco, R P; Maréchal, B; Margoni, M; Marin, J C; Mariotti, C; Markou, A; Martínez-Rivero, C; Martínez-Vidal, F; Martí i García, S; Masik, J; Mastroyiannopoulos, N; Matorras, F; Matteuzzi, C; Matthiae, Giorgio; Mazzucato, F; Mazzucato, M; McCubbin, M L; McKay, R; McNulty, R; McPherson, G; Meroni, C; Meyer, W T; Migliore, E; Mirabito, L; Mitaroff, Winfried A; Mjörnmark, U; Moa, T; Moch, M; Møller, R; Mönig, K; Monge, M R; Moreau, X; Morettini, P; Morton, G A; Müller, U; Münich, K; Mulders, M; Mulet-Marquis, C; Muresan, R; Murray, W J; Muryn, B; Myatt, Gerald; Myklebust, T; Naraghi, F; Nassiakou, M; Navarria, Francesco Luigi; Navas, S; Nawrocki, K; Negri, P; Némécek, S; Neufeld, N; Neumeister, N; Nicolaidou, R; Nielsen, B S; Nikolenko, M; Nomokonov, V P; Normand, Ainsley; Nygren, A; Obraztsov, V F; Olshevskii, A G; Onofre, A; Orava, Risto; Orazi, G; Österberg, K; Ouraou, A; Paganoni, M; Paiano, S; Pain, R; Paiva, R; Palacios, J; Palka, H; Papadopoulou, T D; Papageorgiou, K; Pape, L; Parkes, C; Parodi, F; Parzefall, U; Passeri, A; Passon, O; Pegoraro, M; Peralta, L; Pernicka, Manfred; Perrotta, A; Petridou, C; Petrolini, A; Phillips, H T; Pierre, F; Pimenta, M; Piotto, E; Podobnik, T; Pol, M E; Polok, G; Poropat, P; Pozdnyakov, V; Privitera, P; Pukhaeva, N; Pullia, Antonio; Radojicic, D; Ragazzi, S; Rahmani, H; Ratoff, P N; Read, A L; Rebecchi, P; Redaelli, N G; Regler, Meinhard; Reid, D; Reinhardt, R; Renton, P B; Resvanis, L K; Richard, F; Rídky, J; Rinaudo, G; Røhne, O M; Romero, A; Ronchese, P; Rosenberg, E I; Rosinsky, P; Roudeau, Patrick; Rovelli, T; Royon, C; Ruhlmann-Kleider, V; Ruiz, A; Saarikko, H; Sacquin, Yu; Sadovskii, A; Sajot, G; Salt, J; Sampsonidis, D; Sannino, M; Schneider, H; Schwemling, P; Schwering, B; Schwickerath, U; Schyns, M A E; Scuri, F; Seager, P; Sedykh, Yu; Segar, A M; Sekulin, R L; Shellard, R C; Sheridan, A; Siebel, M; Simard, L C; Simonetto, F; Sissakian, A N; Smadja, G; Smirnov, N; Smirnova, O G; Smith, G R; Sopczak, André; Sosnowski, R; Spassoff, Tz; Spiriti, E; Sponholz, P; Squarcia, S; Stanescu, C; Stanic, S; Stevenson, K; Stocchi, A; Strauss, J; Strub, R; Stugu, B; Szczekowski, M; Szeptycka, M; Tabarelli de Fatis, T; Chikilev, O G; Tegenfeldt, F; Terranova, F; Thomas, J; Timmermans, J; Tinti, N; Tkatchev, L G; Todorova-Nová, S; Tomaradze, A G; Tomé, B; Tonazzo, A; Tortora, L; Tranströmer, G; Treille, D; Tristram, G; Trochimczuk, M; Troncon, C; Tsirou, A L; Turluer, M L; Tyapkin, I A; Tzamarias, S; Ullaland, O; Uvarov, V; Valenti, G; Vallazza, E; van Apeldoorn, G W; van Dam, P; Van Eldik, J; Van Lysebetten, A; Van Remortel, N; Van Vulpen, I B; Vassilopoulos, N; Vegni, G; Ventura, L; Venus, W A; Verbeure, F; Verlato, M; Vertogradov, L S; Verzi, V; Vilanova, D; Vitale, L; Vlasov, E; Vodopyanov, A S; Vollmer, C F; Voulgaris, G; Vrba, V; Wahlen, H; Walck, C; Weiser, C; Wicke, D; Wickens, J H; Wilkinson, G R; Winter, M; Witek, M; Wolf, G; Yi, J; Yushchenko, O P; Zaitsev, A; Zalewska-Bak, A; Zalewski, Piotr; Zavrtanik, D; Zevgolatakos, E; Zimin, N I; Zucchelli, G C; Zumerle, G


    Inclusive charged hadron distributions as obtaind from the DELPHI measurements at 130, 136, 161, 172 and 183 GeV are presented as a function of the variables rapidity, $\\xi_p$, $p$ and transversal momenta. Data are compared with event generators and with MLLA calculations, in order to examine the hypothesis of local parton hadron duality. The differential momentum spectra show an indication for coherence effects in the production of soft particles. The relation between the energy dependence of the charged multiplicity and the rapidity distribution is examined.

  1. GRABGAM Analysis of Ultra-Low-Level HPGe Gamma Spectra

    Energy Technology Data Exchange (ETDEWEB)

    Winn, W.G.


    The GRABGAM code has been used successfully for ultra-low level HPGe gamma spectrometry analysis since its development in 1985 at Savannah River Technology Center (SRTC). Although numerous gamma analysis codes existed at that time, reviews of institutional and commercial codes indicated that none addressed all features that were desired by SRTC. Furthermore, it was recognized that development of an in-house code would better facilitate future evolution of the code to address SRTC needs based on experience with low-level spectra. GRABGAM derives its name from Gamma Ray Analysis BASIC Generated At MCA/PC.

  2. Correcting coal mixture composition using infrared spectra of components

    Energy Technology Data Exchange (ETDEWEB)

    Popov, S.E.; Rus' yanova, N.D.; Bubnovskaya, L.M.; Popov, V.K.; Belyaeva, L.I.; Stepanov, Yu.V. (Khar' kovskii Nauchno-Issledovatel' skii Uglekhimicheskii Institut (USSR))


    Discusses use of infrared spectrometry in optimizing coal mixtures used in coking plants. Infrared spectra characterize chemical structure of organic matter in various types of coal as well as their molecular structure. By using infrared spectrometers, the optimum content of individual coal components in a mixture can be determined, one component can be replaced by another, or optimum composition of individual components under conditions of quality fluctuations is possible. A computerized optimization method is characterized. The method is characterized by high reliability, accuracy and short calculation time.

  3. Beamstrahlung spectra in next generation linear colliders. Revision

    Energy Technology Data Exchange (ETDEWEB)

    Barklow, T.; Chen, P. [Stanford Linear Accelerator Center, Menlo Park, CA (United States); Kozanecki, W. [DAPNIA-SPP, CEN-Saclay (France)


    For the next generation of linear colliders, the energy loss due to beamstrahlung during the collision of the e{sup +}e{sup {minus}} beams is expected to substantially influence the effective center-of-mass energy distribution of the colliding particles. In this paper, we first derive analytical formulae for the electron and photon energy spectra under multiple beamstrahlung processes, and for the e{sup +}e{sup {minus}} and {gamma}{gamma} differential luminosities. We then apply our formulation to various classes of 500 GeV e{sup +}e{sup {minus}} linear collider designs currently under study.

  4. Rotational Spectra in 29 Vibrationally Excited States of Interstellar Aminoacetonitrile

    Energy Technology Data Exchange (ETDEWEB)

    Kolesniková, L.; Alonso, E. R.; Mata, S.; Alonso, J. L. [Grupo de Espectroscopia Molecular (GEM), Edificio Quifima, Área de Química-Física, Laboratorios de Espectroscopia y Bioespectroscopia, Parque Científico UVa, Unidad Asociada CSIC, Universidad de Valladolid, E-47011 Valladolid (Spain)


    We report a detailed spectroscopic investigation of the interstellar aminoacetonitrile, a possible precursor molecule of glycine. Using a combination of Stark and frequency-modulation microwave and millimeter wave spectroscopies, we observed and analyzed the room-temperature rotational spectra of 29 excited states with energies up to 1000 cm{sup −1}. We also observed the {sup 13}C isotopologues in the ground vibrational state in natural abundance (1.1%). The extensive data set of more than 2000 new rotational transitions will support further identifications of aminoacetonitrile in the interstellar medium.

  5. Entanglement spectra of superconductivity ground states on the honeycomb lattice (United States)

    Predin, Sonja; Schliemann, John


    We analytically evaluate the entanglement spectra of the superconductivity states in graphene, primarily focusing on the s-wave and chiral d x2- y2 + id xy superconductivity states. We demonstrate that the topology of the entanglement Hamiltonian can differ from that of the subsystem Hamiltonian. In particular, the topological properties of the entanglement Hamiltonian of the chiral d x2- y2 + id xy superconductivity state obtained by tracing out one spin direction clearly differ from those of the time-reversal invariant Hamiltonian of noninteracting fermions on the honeycomb lattice.

  6. Interpretation of tandem mass spectra of posttranslationally modified peptides

    DEFF Research Database (Denmark)

    Bunkenborg, J.; Matthiesen, R.


    Tandem mass spectrometry provides a sensitive means of analyzing the amino acid sequence of peptides and modified peptides by providing accurate mass measurements of precursor and fragment ions. Modern mass spectrometry instrumentation is capable of rapidly generating many thousands of tandem mas...... spectra and protein database search engines have been developed to match the experimental data to peptide candidates. In most studies there is a schism between discarding perfectly valid data and including nonsensical peptide identifications-this is currently a major bottleneck in data...

  7. The Gaia-ESO Survey: processing FLAMES-UVES spectra (United States)

    Sacco, G. G.; Morbidelli, L.; Franciosini, E.; Maiorca, E.; Randich, S.; Modigliani, A.; Gilmore, G.; Asplund, M.; Binney, J.; Bonifacio, P.; Drew, J.; Feltzing, S.; Ferguson, A.; Jeffries, R.; Micela, G.; Negueruela, I.; Prusti, T.; Rix, H.-W.; Vallenari, A.; Alfaro, E.; Allende Prieto, C.; Babusiaux, C.; Bensby, T.; Blomme, R.; Bragaglia, A.; Flaccomio, E.; Francois, P.; Hambly, N.; Irwin, M.; Koposov, S.; Korn, A.; Lanzafame, A.; Pancino, E.; Recio-Blanco, A.; Smiljanic, R.; Van Eck, S.; Walton, N.; Bergemann, M.; Costado, M. T.; de Laverny, P.; Heiter, U.; Hill, V.; Hourihane, A.; Jackson, R.; Jofre, P.; Lewis, J.; Lind, K.; Lardo, C.; Magrini, L.; Masseron, T.; Prisinzano, L.; Worley, C.


    The Gaia-ESO Survey is a large public spectroscopic survey that aims to derive radial velocities and fundamental parameters of about 105 Milky Way stars in the field and in clusters. Observations are carried out with the multi-object optical spectrograph FLAMES, using simultaneously the medium-resolution (R ~ 20 000) GIRAFFE spectrograph and the high-resolution (R ~ 47 000) UVES spectrograph. In this paper we describe the methods and the software used for the data reduction, the derivation of the radial velocities, and the quality control of the FLAMES-UVES spectra. Data reduction has been performed using a workflow specifically developed for this project. This workflow runs the ESO public pipeline optimizing the data reduction for the Gaia-ESO Survey, automatically performs sky subtraction, barycentric correction and normalisation, and calculates radial velocities and a first guess of the rotational velocities. The quality control is performed using the output parameters from the ESO pipeline, by a visual inspection of the spectra and by the analysis of the signal-to-noise ratio of the spectra. Using the observations of the first 18 months, specifically targets observed multiple times at different epochs, stars observed with both GIRAFFE and UVES, and observations of radial velocity standards, we estimated the precision and the accuracy of the radial velocities. The statistical error on the radial velocities is σ ~ 0.4 km s-1 and is mainly due to uncertainties in the zero point of the wavelength calibration. However, we found a systematic bias with respect to the GIRAFFE spectra (~0.9 km s-1) and to the radial velocities of the standard stars (~0.5 km s-1) retrieved from the literature. This bias will be corrected in the future data releases, when a common zero point for all the set-ups and instruments used for the survey is be established. Based on observations made with the ESO/VLT, at Paranal Observatory, under programme 188.B-3002 (The Gaia-ESO Public

  8. Atomic transition probabilities of Ce I from Fourier transform spectra

    Energy Technology Data Exchange (ETDEWEB)

    Lawler, J E; Wood, M P; Den Hartog, E A [Department of Physics, University of Wisconsin, 1150 University Ave., Madison, WI 53706 (United States); Chisholm, J [Department of Physics, Boston College, 140 Commonwealth Ave., Chestnut Hill, MA 02467 (United States); Nitz, D E [Department of Physics, St. Olaf College, 1520 St. Olaf Ave., Northfield, MN 55057 (United States); Sobeck, J, E-mail: jelawler@wisc.ed, E-mail: chishojd@bc.ed, E-mail: nitz@stolaf.ed, E-mail: mpwood@wisc.ed, E-mail: jsobeck@uchicago.ed, E-mail: eadenhar@wisc.ed [Department of Astronomy and Astrophysics, University of Chicago, 5640 Ellis Ave., Chicago, IL 60637 (United States)


    Atomic transition probabilities for 2874 lines of the first spectrum of cerium (Ce I) are reported. These data are from new branching fraction measurements on Fourier transform spectra normalized with previously reported radiative lifetimes from time-resolved laser-induced-fluorescence measurements (Den Hartog et al 2009 J. Phys. B: At. Mol. Opt. Phys. 42 085006). The wavelength range of the data set is from 360 to 1500 nm. Comparisons are made to previous investigations which are less extensive. Accurate Ce i transition probabilities are needed for lighting research and development on metal halide high-intensity discharge lamps.

  9. Low-temperature Raman spectra of L-histidine crystal

    Energy Technology Data Exchange (ETDEWEB)

    Souda, G.P. de; Freire, P.T.C.; Mendes Filho, J.; Melo, F.E.A., E-mail: [Universidade Federal do Ceara (UFCE), Fortaleza, CE (Brazil). Departamento de Fisica; Lima, C.L. [Universidade Federal do Piaui (UFPI), Teresina, PI (Brazil). Departamento de Fisica


    We present a Raman spectroscopy investigation of the vibrational properties of l-histidine crystals at low temperatures. The temperature dependence of the spectra show discontinuities at 165 K, which we identify with modifications in the bonds associated to both the NH{sub 3}{sup +} and CO{sub 2} − motifs indicative of a conformational phase transition that changes the intermolecular bonds. Additional evidence of such a phase transition is provided by differential scanning calorimetry measurements, which identified an enthalpic anomaly at ∼165 K. (author)

  10. A transient model to simulate HTPEM fuel cell impedance spectra

    DEFF Research Database (Denmark)

    Vang, Jakob Rabjerg; Andreasen, Søren Juhl; Kær, Søren Knudsen


    diffusion of cathode gas species in gas diffusion layers and catalyst layer, transport of protons in the membrane and the catalyst layers, and double layer capacitive effects in the catalyst layers. The model has been fitted simultaneously to a polarization curve and to an impedance spectrum recorded......This paper presents a spatially resolved transient fuel cell model applied to the simulation of high temperature PEM fuel cell impedance spectra. The model is developed using a 2D finite volume method approach. The model is resolved along the channel and across the membrane. The model considers...

  11. Predicting charmonium and bottomonium spectra with a quark harmonic oscillator (United States)

    Norbury, J. W.; Badavi, F. F.; Townsend, L. W.


    The nonrelativistic quark model is applied to heavy (nonrelativistic) meson (two-body) systems to obtain sufficiently accurate predictions of the spin-averaged mass levels of the charmonium and bottomonium spectra as an example of the three-dimensional harmonic oscillator. The present calculations do not include any spin dependence, but rather, mass values are averaged for different spins. Results for a charmed quark mass value of 1500 MeV/c-squared show that the simple harmonic oscillator model provides good agreement with experimental values for 3P states, and adequate agreement for the 3S1 states.

  12. Harmonic inversion analysis of exceptional points in resonance spectra


    Fuchs, Jacob; Main, Jörg; Cartarius, Holger; Wunner, Günter


    The spectra of, e.g. open quantum systems are typically given as the superposition of resonances with a Lorentzian line shape, where each resonance is related to a simple pole in the complex energy domain. However, at exceptional points two or more resonances are degenerate and the resulting non-Lorentzian line shapes are related to higher order poles in the complex energy domain. In the Fourier-transform time domain an $n$-th order exceptional point is characterised by a non-exponentially de...

  13. Interatomic scattering in energy dependent photoelectron spectra of Ar clusters

    Energy Technology Data Exchange (ETDEWEB)

    Patanen, M.; Benkoula, S.; Nicolas, C.; Goel, A. [Synchrotron SOLEIL, L’Orme des Merisiers, Saint-Aubin, BP 48, 91192 Gif-sur-Yvette Cedex (France); Antonsson, E. [Synchrotron SOLEIL, L’Orme des Merisiers, Saint-Aubin, BP 48, 91192 Gif-sur-Yvette Cedex (France); Physikalische und Theoretische Chemie Institut für Chemie und Biochemie, Fachbereich Biologie, Chemie, Pharmazie, Freie Universität Berlin, Takustrasse 3, 14195 Berlin (Germany); Neville, J. J. [Synchrotron SOLEIL, L’Orme des Merisiers, Saint-Aubin, BP 48, 91192 Gif-sur-Yvette Cedex (France); Department of Chemistry, University of New Brunswick, Fredericton, New Brunswick E3B 6E2 (Canada); Miron, C., E-mail: [Synchrotron SOLEIL, L’Orme des Merisiers, Saint-Aubin, BP 48, 91192 Gif-sur-Yvette Cedex (France); Extreme Light Infrastructure - Nuclear Physics (ELI-NP), ‘Horia Hulubei’ National Institute for Physics and Nuclear Engineering, 30 Reactorului Street, RO-077125 Măgurele, Jud. Ilfov (Romania)


    Soft X-ray photoelectron spectra of Ar 2p levels of atomic argon and argon clusters are recorded over an extended range of photon energies. The Ar 2p intensity ratios between atomic argon and clusters’ surface and bulk components reveal oscillations similar to photoelectron extended X-ray absorption fine structure signal (PEXAFS). We demonstrate here that this technique allows us to analyze separately the PEXAFS signals from surface and bulk sites of free-standing, neutral clusters, revealing a bond contraction at the surface.

  14. The Swift UVOT grism calibration and example spectra


    Kuin, Paul; Breeveld, Alice; Page, Mat


    The calibration of the two UVOT grisms which provide slitless spectroscopy in the 170-500 nm (UV grism) and 295-660 nm (visible grism) ranges has been completed. The UV grism has a spectral resolution ($\\lambda/\\Delta\\lambda$) of 75 at $\\lambda$2600 \\AA\\ for source magnitudes of u=10-16 mag, while the visible grism has a spectral resolution of 100 at $\\lambda$4000 \\AA\\ for source magnitudes of b=12-17 mag. For brighter spectra, coincidence loss (pile-up) occurs in the photon-counting detector...

  15. Electronic absorption spectra and geometry of organic molecules an application of molecular orbital theory

    CERN Document Server

    Suzuki, Hiroshi


    Electronic Absorption Spectra and Geometry of Organic Molecules: An Application of Molecular Orbital Theory focuses on electronic absorption spectra of organic compounds and molecules. The book begins with the discussions on molecular spectra, electronic absorption spectra of organic compounds, and practical measures of absorption intensity. The text also focuses on molecular orbital theory and group theory. Molecular state functions; fundamental postulates of quantum theory; representation of symmetry groups; and symmetry operations and symmetry groups are described. The book also dis

  16. Monte Carlo simulation of the experimental pulse height spectra produced in diamond detectors by quasi-mono-energetic neutrons (United States)

    Milocco, A.; Pillon, M.; Angelone, M.; Plompen, A.; Krása, A.; Trkov, A.


    This work was carried out in view of the possible use of diamond detectors as high resolution neutron spectrometers for the ITER project. An MCNP5(X) based computational tool has been developed to simulate the fast neutron response of diamond detectors. The source neutrons are generated by a source routine, developed earlier, that includes deuteron beam energy loss, angular straggling, and two-body relativistic kinematics. The diamond detector routine calculates a pulse height spectrum that is built up by elastic and inelastic scattering, (n,a), (n,p), and (n,d) reaction channels. A combination of nuclear data from ENDF/B-VII.0, TENDL-2010, and ENSDF is used. The simulated spectra are compared with measured spectra. It is shown that the simulation tool allows an interpretation of most of the characteristic features in the spectrum. This is an important step towards the use of diamond detectors for spectral analysis and fluence measurements. © 2001 Elsevier Science.

  17. Monte Carlo and least-squares methods applied in unfolding of X-ray spectra measured with cadmium telluride detectors

    Energy Technology Data Exchange (ETDEWEB)

    Moralles, M. [Centro do Reator de Pesquisas, Instituto de Pesquisas Energeticas e Nucleares, Caixa Postal 11049, CEP 05422-970, Sao Paulo SP (Brazil)], E-mail:; Bonifacio, D.A.B. [Centro do Reator de Pesquisas, Instituto de Pesquisas Energeticas e Nucleares, Caixa Postal 11049, CEP 05422-970, Sao Paulo SP (Brazil); Bottaro, M.; Pereira, M.A.G. [Instituto de Eletrotecnica e Energia, Universidade de Sao Paulo, Av. Prof. Luciano Gualberto, 1289, CEP 05508-010, Sao Paulo SP (Brazil)


    Spectra of calibration sources and X-ray beams were measured with a cadmium telluride (CdTe) detector. The response function of the detector was simulated using the GEANT4 Monte Carlo toolkit. Trapping of charge carriers were taken into account using the Hecht equation in the active zone of the CdTe crystal associated with a continuous function to produce drop of charge collection efficiency near the metallic contacts and borders. The rise time discrimination is approximated by a cut in the depth of the interaction relative to cathode and corrections that depend on the pulse amplitude. The least-squares method with truncation was employed to unfold X-ray spectra typically used in medical diagnostics and the results were compared with reference data.

  18. Monte Carlo and least-squares methods applied in unfolding of X-ray spectra measured with cadmium telluride detectors (United States)

    Moralles, M.; Bonifácio, D. A. B.; Bottaro, M.; Pereira, M. A. G.


    Spectra of calibration sources and X-ray beams were measured with a cadmium telluride (CdTe) detector. The response function of the detector was simulated using the GEANT4 Monte Carlo toolkit. Trapping of charge carriers were taken into account using the Hecht equation in the active zone of the CdTe crystal associated with a continuous function to produce drop of charge collection efficiency near the metallic contacts and borders. The rise time discrimination is approximated by a cut in the depth of the interaction relative to cathode and corrections that depend on the pulse amplitude. The least-squares method with truncation was employed to unfold X-ray spectra typically used in medical diagnostics and the results were compared with reference data.

  19. Shifting nodal-plane suppressions in high-order harmonic spectra from diatomic molecules in orthogonally polarized driving fields

    CERN Document Server

    Das, T


    We analyze the imprint of nodal planes in high-order harmonic spectra from aligned diatomic molecules in intense laser fields whose components exhibit orthogonal polarizations. We show that the typical suppression in the spectra associated to nodal planes is distorted, and that this distortion can be employed to map the electron's angle of return to its parent ion. This investigation is performed semi-analytically at the single-molecule response and single-active orbital level, using the strong-field approximation and the steepest descent method. We show that the velocity form of the dipole operator is superior to the length form in providing information about this distortion. However, both forms introduce artifacts that are absent in the actual momentum-space wavefunction. Furthermore, elliptically polarized fields lead to larger distortions in comparison to two-color orthogonally polarized fields. These features are investigated in detail for $\\mathrm{O}_2$, whose highest occupied molecular orbital provides...

  20. FTIR spectra of whey and casein hydrolysates in relation to their functional properties

    NARCIS (Netherlands)

    Ven, van der C.; Muresan, S.; Gruppen, H.; Bont, D.B.A.; Merck, K.B.; Voragen, A.G.J.


    Mid-infrared spectra of whey and casein hydrolysates were recorded using Fourier transform infrared (FTIR) spectroscopy. Multivariate data analysis techniques were used to investigate the capacity of FTIR spectra to classify hydrolysates and to study the ability of the spectra to predict bitterness,