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Sample records for scanned-energy mode photoelectron

  1. Scanned-energy mode photoelectron diffraction measurements at beamline 7.0.1

    Energy Technology Data Exchange (ETDEWEB)

    Toomes, R.; Booth, N.A.; Woodruff, D.P. [Univ. of Warwick, Coventry (United Kingdom)] [and others

    1997-04-01

    This report covers the results of the authors first experimental run, in May 1996, conducted to explore the advantages offered by the high spectral resolution available at the SpectroMicroscopy Facility on beam line 7.0 to conduct scanned-energy mode photoelectron diffraction (PhD). This technique is now a well-established method for the determination of local structure of atomic and molecular adsorbates on well-characterised surfaces. The directly-emitted component of an adsorbate core-level photoelectron wavefield interferes coherently with components of the same wavefield elastically scattered by surrounding atoms, leading to a modulation in the photoemission intensity as a function of kinetic energy in any specific emission direction. A series of such PhD modulation spectra, each typically covering energies from 50-500 eV, for a series of different emission directions, provides the basis for a quantitative structure determination of the emitter-scatterer geometry. Within the last years the authors have developed an integrated approach to extract the structural information from these photoelectron diffraction (PhD) spectra in a quantitative way. A direct data inversion technique (the so-called Projection method) provides a first-order estimate of the local adsorbate geometry in the form of an `image` of the scatterer atoms which are nearest neighbours to the emitter. This information is then used as a starting model for optimisation of the structural parameters by comparing the experimental PhD spectra with the results of multiple scattering simulations using a code developed by Fritzsche. The optimisation uses an automated trial-and-error procedure by minimising a reliability factor which provides an objective measure of the quality of agreement between experiment and theory. The authors have successfully applied this approach to the structure determination of about 30 adsorption systems.

  2. The structure of formate on TiO{sub 2}(110) by scanned-energy and scanned-angle photoelectron diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Thevuthasan, S.; Kim, Y.J.; Herman, G.S. [Pacific Northwest National Laboratory, Richland, WA (United States)] [and others

    1997-04-01

    There is a considerable interest in understanding the interaction of small organic molecules with oxide surfaces. The chemistry of formate interactions with TiO{sub 2}(110) has been investigated by several groups, but there is little information on the structure of the adsorbate/surface complex. Recently the authors combined high-energy x-ray photoelectron diffraction (XPD) measurements at PNNL with low-energy scanned-angle and scanned-energy photoelectron diffraction measurements at the ALS to investigate the structure of the formate ion on TiO{sub 2}(110) in detail. The high-energy XPD results reveal that formate binds through the oxygens in a bidentate fashion to Ti cation rows along the [001] direction with an O-C-O bond angle of about 126{degrees}. Low-energy photoelectron diffraction data, which is briefly described below, was used to identify the specific bonding geometry, including the bond length between the Ti cation and the oxygen in the formate.

  3. Electron-Vibration Coupling in Molecular Materials: Assignment of Vibronic Modes from Photoelectron Momentum Mapping.

    Science.gov (United States)

    Graus, M; Grimm, M; Metzger, C; Dauth, M; Tusche, C; Kirschner, J; Kümmel, S; Schöll, A; Reinert, F

    2016-04-08

    Electron-phonon coupling is one of the most fundamental effects in condensed matter physics. We here demonstrate that photoelectron momentum mapping can reveal and visualize the coupling between specific vibrational modes and electronic excitations. When imaging molecular orbitals with high energy resolution, the intensity patterns of photoelectrons of the vibronic sidebands of molecular states show characteristic changes due to the distortion of the molecular frame in the vibronically excited state. By comparison to simulations, an assignment of specific vibronic modes is possible, thus providing unique information on the coupling between electronic and vibronic excitation.

  4. Photoelectron diffraction studies of molecular adsorbates on transition metal surfaces

    CERN Document Server

    Kang, J H

    2001-01-01

    Quantitative structure determinations using scanned- energy mode photoelectron diffraction are presented for three adsorption systems. For the Ni(110)/C sub 6 H sub 6 system it was determined that the benzene molecule is adsorbed above the on hollow site. The molecular plane is parallel to the surface, and the molecule is centered on a four-fold coordinated site with two opposite C-C bonds perpendicular to axis. The C-Ni nearest-neighbour layer spacing is 1.81+-0.03 A. A very high precision for the C-C distance (1.45+-0.03 A) was found and an isotropic expansion of the C-C bond lengths was confirmed. A study of the adsorption site of CO in the Ni (111)/p(2x2)-O/CO coadsorbed phase over different sample preparation temperatures revealed that the atop site is favoured. The Ni-C spacing is given by 1.77+-0.01 A. Reanalysis of old data for a surface prepared at 120 K, which is a previous analysis concluded had hcp (70 %) and fcc (30 %) site occupation, showed a mixture of hop (65 %) and atop (35 %) sites. The oc...

  5. Photoelectronic characterization of heterointerfaces.

    Energy Technology Data Exchange (ETDEWEB)

    Brumbach, Michael Todd

    2012-02-01

    In many devices such as solar cells, light emitting diodes, transistors, etc., the performance relies on the electronic structure at interfaces between materials within the device. The objective of this work was to perform robust characterization of hybrid (organic/inorganic) interfaces by tailoring the interfacial region for photoelectron spectroscopy. Self-assembled monolayers (SAM) were utilized to induce dipoles of various magnitudes at the interface. Additionally, SAMs of molecules with varying dipolar characteristics were mixed into spatially organized structures to systematically vary the apparent work function. Polymer thin films were characterized by depositing films of varying thicknesses on numerous substrates with and without interfacial modifications. Hard X-ray photoelectron spectroscopy (HAXPES) was performed to evaluate a buried interface between indium tin oxide (ITO), treated under various conditions, and poly(3-hexylthiophene) (P3HT). Conducting polymer films were found to be sufficiently conducting such that no significant charge redistribution in the polymer films was observed. Consequently, a further departure from uniform substrates was taken whereby electrically disconnected regions of the substrate presented ideally insulating interfacial contacts. In order to accomplish this novel strategy, interdigitated electrodes were used as the substrate. Conducting fingers of one half of the electrodes were electrically grounded while the other set of electrodes were electronically floating. This allowed for the evaluation of substrate charging on photoelectron spectra (SCOPES) in the presence of overlying semiconducting thin films. Such an experiment has never before been reported. This concept was developed out of the previous experiments on interfacial modification and thin film depositions and presents new opportunities for understanding chemical and electronic changes in a multitude of materials and interfaces.

  6. Photoelectron imaging of cyanovinylidene and cyanoacetylene anions.

    Science.gov (United States)

    Goebbert, Daniel J; Khuseynov, Dmitry; Sanov, Andrei

    2010-02-18

    Negative ions of cyanoacetylene and cyanovinylidene are generated simultaneously via the competing 1,1-H(2)(+) and 1,2-H(2)(+) abstraction channels of O(-) reaction with acrylonitrile. The two stable isomeric forms of the anion, CCHCN(-) and HCCCN(-), are separated by a large (approximately 2 eV) potential energy barrier. Their photodetachment provides access to both the reactant and the product sides of the neutral cyanovinylidene --> cyanoacetylene rearrangement reaction, predicted to involve only a very small barrier. Using photoelectron imaging spectroscopy at 532 and 355 nm, the adiabatic electron affinity of the reactive intermediate :C horizontal lineCHCN (X(1)A'), is determined to be 1.84 +/- 0.01 eV. The photoelectron spectrum of CCHCN(-) exhibits a vibrational progression attributed to the excitation of the CCH bending mode. The observed spectral features are reproduced reasonably well using a Franck-Condon simulation under the parallel-mode approximation. In contrast to unsubstituted acetylene, cyanoacetylene has a stable anionic state, which is adiabatically weakly bound, but has an experimentally determined vertical detachment energy of 1.04 +/- 0.05 eV. This measurement, along with the broad, structureless photoelectron spectrum of HCCCN(-) (with no identifiable origin), reflects the large geometry difference between the w-shaped structure of the anion and the linear equilibrium geometry of HCCCN.

  7. Photoelectron spectroscopy and the dipole approximation

    Energy Technology Data Exchange (ETDEWEB)

    Hemmers, O.; Hansen, D.L.; Wang, H. [Univ. of Nevada, Las Vegas, NV (United States)] [and others

    1997-04-01

    Photoelectron spectroscopy is a powerful technique because it directly probes, via the measurement of photoelectron kinetic energies, orbital and band structure in valence and core levels in a wide variety of samples. The technique becomes even more powerful when it is performed in an angle-resolved mode, where photoelectrons are distinguished not only by their kinetic energy, but by their direction of emission as well. Determining the probability of electron ejection as a function of angle probes the different quantum-mechanical channels available to a photoemission process, because it is sensitive to phase differences among the channels. As a result, angle-resolved photoemission has been used successfully for many years to provide stringent tests of the understanding of basic physical processes underlying gas-phase and solid-state interactions with radiation. One mainstay in the application of angle-resolved photoelectron spectroscopy is the well-known electric-dipole approximation for photon interactions. In this simplification, all higher-order terms, such as those due to electric-quadrupole and magnetic-dipole interactions, are neglected. As the photon energy increases, however, effects beyond the dipole approximation become important. To best determine the range of validity of the dipole approximation, photoemission measurements on a simple atomic system, neon, where extra-atomic effects cannot play a role, were performed at BL 8.0. The measurements show that deviations from {open_quotes}dipole{close_quotes} expectations in angle-resolved valence photoemission are observable for photon energies down to at least 0.25 keV, and are quite significant at energies around 1 keV. From these results, it is clear that non-dipole angular-distribution effects may need to be considered in any application of angle-resolved photoelectron spectroscopy that uses x-ray photons of energies as low as a few hundred eV.

  8. Hollow-tip scanning photoelectron microscopy

    Science.gov (United States)

    Cherkun, A. P.; Mironov, B. N.; Aseyev, S. A.; Chekalin, S. V.

    2014-07-01

    A new type of microscopy based on scanning in vacuum by a beam of charged particles transmitted through a hollow probe has been implemented. This approach provides controllable motion of spatially localized ion, electron, molecular (atomic), and soft X-ray beams and investigation of the surface in the shear force mode. In the photoelectron mode, in which electrons are transmitted through a 2-μm quartz capillary, a surface profile of gadolinium irradiated by 400-nm femtosecond laser pulses has been visualized with a subwave spatial resolution. The new method of microscopy opens an opportunity of investigations in the field of nanometer local photodesorption of molecular ions (one of the last ideas of V.S. Letokhov).

  9. Photoelectron Spectroscopy Study of Quinonimides

    Energy Technology Data Exchange (ETDEWEB)

    Hossain, Ekram [The; Deng, Shihu M. [Physical; Gozem, Samer [Department; Krylov, Anna I. [Department; Wang, Xue-Bin [Physical; Wenthold, Paul G. [The

    2017-08-03

    Structures and energetics of o-, m- and p-quinonimide anions (OC6H4N) and quinoniminyl radicals have been investigated by using negative ion photoelectron spectroscopy. Modeling of the photoelectron spectrum of the ortho isomer shows that the ground state of the anion is a triplet, while the quinoniminyl radical has a doublet ground state with a doublet-quartet splitting of 35.5 kcal/mol. The para radical has doublet ground state, but a band for a quartet state is missing from the photoelectron spectrum indicating that the anion has a singlet ground state, in contrast to previously reported calculations. The theoretical modeling is revisited here, and it is shown that accurate predictions for the electronic structure of the para quinonimide anion require both an accurate account of electron correlation and a sufficiently diffuse basis set. Electron affinities of o- and p-quinoniminyl radicals are measured to be 1.715 ± 0.010 and 1.675 ± 0.010 eV, respectively. The photoelectron spectrum of the m-quinonimide anion shows that the ion undergoes several different rearrangements, including a rearrangement to the energetically favorable para isomer. Such rearrangements preclude a meaningful analysis of the experimental spectrum.

  10. Beam-line systems for pump-probe photoelectron spectroscopy using SR and laser

    CERN Document Server

    Kamada, M; Takahashi, K; Doi, Y I; Fukui, K; Kinoshita, T; Haruyama, Y; Asaka, S; Fujii, Y; Itoh, M

    2001-01-01

    Combined systems for photoelectron spectroscopy using synchrotron radiation (SR) and laser have been constructed at BL5A and BL6A2 in the UVSOR facility, Okazaki. The systems consist of photoelectron spectrometers with high performance, mode-locked lasers, and timing electronic circuits. The laser pulses with repetition frequency of 90 MHz are synchronized with the SR pulses. An upgrade project to install a micro-ESCA at BL6A2, which is now in progress, is also reported.

  11. Coherent Control of Photoelectron Wavepacket Angular Interferograms

    OpenAIRE

    Hockett, Paul; Wollenhaupt, Matthias; Baumert, Thomas

    2015-01-01

    Coherent control over photoelectron wavepackets, via the use of polarization-shaped laser pulses, can be understood as a time and polarization-multiplexed process. In this work, we investigate this multiplexing via computation of the observable photoelectron angular interferograms resulting from multi-photon atomic ionization with polarization-shaped laser pulses. We consider the polarization sensitivity of both the instantaneous and cumulative continuum wavefunction; the nature of the cohere...

  12. Photoelectron spectroscopy of supersonic molecular beams

    Energy Technology Data Exchange (ETDEWEB)

    Pollard, J.E.

    1982-05-01

    A new technique for performing high resolution molecular photoelectron spectroscopy is described, beginning with its conceptual development, through the construction of a prototypal apparatus, to the initial applications on a particularly favorable molecular system. The distinguishing features of this technique are: (1) the introduction of the sample in the form of a collimated supersonic molecular beam; and (2) the use of an electrostatic deflection energy analyzer which is carefully optimized in terms of sensitivity and resolution. This combination makes it possible to obtain photoelectron spectra at a new level of detail for many small molecules. Three experiments are described which rely on the capability to perform rotationally-resolved photoelectron spectroscopy on the hydrogen molecule and its isotopes. The first is a measurement of the ionic vibrational and rotational spectroscopic constants and the vibrationally-selected photoionization cross sections. The second is a determination of the photoelectron asymmetry parameter, ..beta.., for selected rotational transitions. The third is an investigation of the rotational relaxation in a free jet expansion, using photoelectron spectroscopy as a probe of the rotational state population distributions. In the closing chapter an assessment is made of the successes and limitations of the technique, and an indication is given of areas for further improvement in future spectrometers.

  13. Coherent control of photoelectron wavepacket angular interferograms

    Science.gov (United States)

    Hockett, P.; Wollenhaupt, M.; Baumert, T.

    2015-11-01

    Coherent control over photoelectron wavepackets, via the use of polarization-shaped laser pulses, can be understood as a time and polarization-multiplexed process, where the final (time-integrated) observable coherently samples all instantaneous states of the light-matter interaction. In this work, we investigate this multiplexing via computation of the observable photoelectron angular interferograms resulting from multi-photon atomic ionization with polarization-shaped laser pulses. We consider the polarization sensitivity of both the instantaneous and cumulative continuum wavefunction; the nature of the coherent control over the resultant photoelectron interferogram is thus explored in detail. Based on this understanding, the use of coherent control with polarization-shaped pulses as a methodology for a highly multiplexed coherent quantum metrology is also investigated, and defined in terms of the information content of the observable.

  14. Performance of the SRRC scanning photoelectron microscope

    CERN Document Server

    Hong, I H; Yin, G C; Wei, D H; Juang, J M; Dann, T E; Klauser, R; Chuang, T J; Chen, C T; Tsang, K L

    2001-01-01

    A scanning photoelectron microscope has been constructed at SRRC. This SPEM system consists primarily of a Fresnel zone plate (ZP) with an order-selection aperture, a flexure scanning stage, a hemispherical electron analyzer, and sample/ZP insertion system. The flexure stage is used to scan the sample. A hemispherical analyzer with Omni V lens and a 16-channel multichannel detector (MCD) is used to collect photoelectrons. A set of 16 photoelectron images at different kinetic energies can be simultaneously acquired in one single scan. The data acquisition system is designed to collect up to 32 images concurrently, including 16 MCD signals, total electron yield and transmitted photon flux. The design and some initial test results of this SPEM station are presented and discussed.

  15. Coherent Control of Photoelectron Wavepacket Angular Interferograms

    CERN Document Server

    Hockett, Paul; Baumert, Thomas

    2015-01-01

    Coherent control over photoelectron wavepackets, via the use of polarization-shaped laser pulses, can be understood as a time and polarization-multiplexed process. In this work, we investigate this multiplexing via computation of the observable photoelectron angular interferograms resulting from multi-photon atomic ionization with polarization-shaped laser pulses. We consider the polarization sensitivity of both the instantaneous and cumulative continuum wavefunction; the nature of the coherent control over the resultant photoelectron interferogram is thus explored in detail. Based on this understanding, the use of coherent control with polarization-shaped pulses as a methodology for a highly multiplexed coherent quantum metrology is also investigated, and defined in terms of the information content of the observable.

  16. Time-resolved photoelectron spectroscopy using synchrotron radiation time structure.

    Science.gov (United States)

    Bergeard, N; Silly, M G; Krizmancic, D; Chauvet, C; Guzzo, M; Ricaud, J P; Izquierdo, M; Stebel, L; Pittana, P; Sergo, R; Cautero, G; Dufour, G; Rochet, F; Sirotti, F

    2011-03-01

    Synchrotron radiation time structure is becoming a common tool for studying dynamic properties of materials. The main limitation is often the wide time domain the user would like to access with pump-probe experiments. In order to perform photoelectron spectroscopy experiments over time scales from milliseconds to picoseconds it is mandatory to measure the time at which each measured photoelectron was created. For this reason the usual CCD camera-based two-dimensional detection of electron energy analyzers has been replaced by a new delay-line detector adapted to the time structure of the SOLEIL synchrotron radiation source. The new two-dimensional delay-line detector has a time resolution of 5 ns and was installed on a Scienta SES 2002 electron energy analyzer. The first application has been to characterize the time of flight of the photoemitted electrons as a function of their kinetic energy and the selected pass energy. By repeating the experiment as a function of the available pass energy and of the kinetic energy, a complete characterization of the analyzer behaviour in the time domain has been obtained. Even for kinetic energies as low as 10 eV at 2 eV pass energy, the time spread of the detected electrons is lower than 140 ns. These results and the time structure of the SOLEIL filling modes assure the possibility of performing pump-probe photoelectron spectroscopy experiments with the time resolution given by the SOLEIL pulse width, the best performance of the beamline and of the experimental station.

  17. Conformational effects in photoelectron circular dichroism

    Science.gov (United States)

    Turchini, S.

    2017-12-01

    Photoelectron circular dichroism (PECD) is a novel type of spectroscopy, which presents surprising sensitivity to conformational effects in chiral systems. While classical photoelectron spectroscopy mainly responds to conformational effects in terms of energy level shifts, PECD provides a rich and detailed response to tiny changes in electronic and structural properties by means of the intensity dispersion of the circular dichroism as a function of photoelectron kinetic energy. In this work, the basics of PECD will be outlined, emphasizing the role of interference from the l,l+/- 1 outgoing partial wave of the photoelectron in the PECD transition matrix element, which is responsible for the extreme sensitivity to conformational effects. Examples using molecular systems and interfaces will shed light on the powerful application of PECD to classical conformational effects such as group substitution, isomerism, conformer population and clustering. Moreover, the PECD results will be reported in challenging new fields where conformations play a key role, such as vibrational effects, transient chirality and time- resolved experiments. To date, PECD has mostly been based on synchrotron radiation facilities, but it also has a future as a table-top lab experiment by means of multiphoton ionization. An important application of PECD as an analytical tool will be reported. The aim of this review is to illustrate that in PECD, the presence of conformational effects is essential for understanding a wide range of effects from a new perspective, making it different from classical spectroscopy.

  18. Photoelectron circular dichroism in different ionization regimes

    Science.gov (United States)

    Wollenhaupt, Matthias

    2016-12-01

    Photoelectron circular dichroism (PECD) describes an asymmetry in the photoelectron angular distribution (PAD) from photoionization of randomly oriented enantiomers with circularly polarized light. Beaulieu et al present a comprehensive set of measured PADs from multiphoton ionization of limonene and fenchone in different ionization regimes (multiphoton and tunneling) and analyze the resulting PECD (Beaulieu et al 2016 New J. Phys. 18 102002). From their observations the authors conclude that the PECD is universal in the sense that the molecular chirality is encoded in the PAD independent of the ionization regime. The analysis is supplemented by a classical model based on electron scattering in a chiral potential. The paper presents beautiful data and is an important step towards a more complete physical picture of PECD. The results and their interpretation stimulate the ongoing vivid debate on the role of resonances in multiphoton PECD.

  19. Photoelectronic Sensor with Gold Nanoparticle Plasmon Antenna

    Science.gov (United States)

    2016-07-20

    because LSPR enhances electron-hole pair generation in Au nanostructures and hot electrons are injected into the semiconductor through the Schottky...this concept based on Schottoky contact to the photoelectronic hybrid sensing device with a transparent semiconductor channel and Plasmon antenna...Naofumi Okamoto, Yasuaki Ishikawa, Ichiro Yamashita and Yukiharu Uraoka, “Detection of Ferritin on Graphene -based Field-Effect Transistor for Bio

  20. Anion photoelectron spectroscopy of radicals and clusters

    Energy Technology Data Exchange (ETDEWEB)

    Travis, Taylor R. [Univ. of California, Berkeley, CA (United States)

    1999-12-01

    Anion photoelectron spectroscopy is used to study free radicals and clusters. The low-lying 2Σ and 2π states of C2nH (n = 1--4) have been studied. The anion photoelectron spectra yielded electron affinities, term values, and vibrational frequencies for these combustion and astrophysically relevant species. Photoelectron angular distributions allowed the author to correctly assign the electronic symmetry of the ground and first excited states and to assess the degree of vibronic coupling in C2H and C4H. Other radicals studied include NCN and I3. The author was able to observe the low-lying singlet and triplet states of NCN for the first time. Measurement of the electron affinity of I3 revealed that it has a bound ground state and attachment of an argon atom to this moiety enabled him to resolve the symmetric stretching progression.

  1. Experimental study of a photoelectron sheath

    Science.gov (United States)

    Dove, Adrienne; Horanyi, Mihaly; Wang, Xu; Piquette, Marcus; Poppe, Andrew R.; Robertson, Scott

    2012-04-01

    We describe a set of laboratory experiments to reproduce and investigate the photoelectron layer that occurs above UV-illuminated surfaces in space. The experiments are done in vacuum with UV illumination at 172 nm that is sufficiently intense for the creation of a photoelectron layer above a large, planar metal surface with a Debye shielding distance of ˜7 centimeters, small in comparison with the scale of the experiment. The emitting surface electrically floats to a potential approximately 1.5 V more positive than a nearby equipotential surface. Retarding potential analysis of the energy distribution of the electrons emitted from the electrically floating surface, as well as Langmuir probe data, show an effective electron temperature of 1.4 (±0.3) eV and a density of 4×1010 m-3. Langmuir probe measurements are taken throughout the photoelectron sheath to determine the electron density, which show good agreement with results from a 1-D particle-in-cell simulation. These experiments enable the better understanding of the plasma environment of spacecraft, the moon, and other airless bodies in the solar system, and the processes that might be responsible for the charging, mobilization, and transport of dust particles on their surfaces.

  2. Photoelectron spectroscopy bulk and surface electronic structures

    CERN Document Server

    Suga, Shigemasa

    2014-01-01

    Photoelectron spectroscopy is now becoming more and more required to investigate electronic structures of various solid materials in the bulk, on surfaces as well as at buried interfaces. The energy resolution was much improved in the last decade down to 1 meV in the low photon energy region. Now this technique is available from a few eV up to 10 keV by use of lasers, electron cyclotron resonance lamps in addition to synchrotron radiation and X-ray tubes. High resolution angle resolved photoelectron spectroscopy (ARPES) is now widely applied to band mapping of materials. It attracts a wide attention from both fundamental science and material engineering. Studies of the dynamics of excited states are feasible by time of flight spectroscopy with fully utilizing the pulse structures of synchrotron radiation as well as lasers including the free electron lasers (FEL). Spin resolved studies also made dramatic progress by using higher efficiency spin detectors and two dimensional spin detectors. Polarization depend...

  3. The photodetected function of silicon photoelectronic lambda negative resistance transistor (PLBT)

    Science.gov (United States)

    Zhang, Shi-lin; Zhang, Bo; Guo, Wei-lian; Mao, Lu-hong; Zhang, Pei-ning

    2005-01-01

    In this paper, the photo-detected and controlled functions based on silicon photo-electronic Lambda transistor (PLBT) are reported. PLBT is composed of a npn vertical bipolar transistor as main device and a enhancement-mode MOSFET transistor as feedback device which connected in parallel across the base and collector terminals of bipolar transistor. Photo-electronic-lambda bipolar transistor (PLBT) is one important member of Si-photo electronic negative resistance devices. It has wide applications in photo-electronic coupler, light detector, light sensor and other photo-electronic circuit modules, which is significant for the further study of photo-electronic devices and circuits. When the Si-photo-electronic negative transistor device works as a load, it has two stable output states (bistability characteristics) with the change of the input light signals. Using the photo-bistable and self-locking characteristics of the PLBT, a photo-controlled Bistable Logic Circuit Element has been set up successfully. Through detail studying and analyzing to the operation feature and load feature of the photo-controlled bistable circuit, the nonlinear characteristic of the circuit is demonstrated. Furthermore the applications of this circuit element have been studied and verified.

  4. Atomic photoelectron-spectroscopy studies using synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Kobrin, P.H.

    1983-02-01

    Photoelectron spectroscopy combined with tunable synchrotron radiation has been used to study the photoionization process in several atomic systems. The time structure of the synchrotron radiation source at the Stanford Synchrotron Radiation Laboratory (SSRL) was used to record time-of-flight (TOF) photoelectron spectra of gaseous Cd, Hg, Ne, Ar, Ba, and Mn. The use of two TOF analyzers made possible the measurement of photoelectron angular distributions as well as branching ratios and partial cross sections.

  5. Bimolecular reaction dynamics from photoelectron spectroscopy of negative ions

    Energy Technology Data Exchange (ETDEWEB)

    Bradforth, S.E.

    1992-11-01

    The transition state region of a neutral bimolecular reaction may be experimentally investigated by photoelectron spectroscopy of an appropriate negative ion. The photoelectron spectrum provides information on the spectroscopy and dynamics of the short lived transition state and may be used to develop model potential energy surfaces that are semi-quantitative in this important region. The principles of bound [yields] bound negative ion photoelectron spectroscopy are illustrated by way of an example: a full analysis of the photoelectron bands of CN[sup [minus

  6. SU-E-CAMPUS-J-06: The Impact of CT-Scan Energy On Range Uncertainty in Proton Therapy Planning

    Energy Technology Data Exchange (ETDEWEB)

    Grantham, K [University of Missouri-Columbia, St. Louis, MO (United States); Li, H [Washington University School of Medicine, Saint Louis, MO (United States); Zhao, T [Washington University School of Medicine, St. Louis, MO (United States); Klein, E [Washington University, Saint Louis, MO (United States)

    2014-06-15

    Purpose: To investigate the impact of tube potential (kVp) on the CTnumber (HU) to proton stopping power ratio (PSPR) conversion table; the range uncertainty and the dosimetric change introduced by a mismatch in kVp between the CT and the HU to PSPR table used to calculate dose are analyzed. Methods: A CIRS CT-ED phantom was scanned with a Philips Brilliance 64-slice scanner under 90kVp and 120kVp tube potentials. Two HU to PSPR curves were then created. Using Eclipse (Varian) a treatment plan was created for a single beam in a water phantom (HU=0) passing through a wedge-shaped heterogeneity (HU=1488). The dose was recalculated by changing only the HU to PSPR table used in the dose calculation. The change in range (the distal 90% isodose line) relative to a distal structure was recorded as a function of heterogeneity thickness in the beam. To show the dosimetric impact of a mismatch in kVp between the CT and the HU to PSPR table, we repeated this procedure using a clinical plan comparing DVH data. Results: The HU to PSPR tables diverge for low-density bone and higher density structures. In the phantom plan, the divergence of the tables results in a change in range of ~1mm per cm of bone in the beam path for the HU used. For the clinical plan, a mismatch in kVp showed a 28% increase in mean dose to the brainstem along with a 10% increase in maximum dose to the brainstem center. Conclusion: A mismatch in kVp between the CT and the HU to PSPR table can introduce significant uncertainty in the proton beam range. For dense bone, the measured range uncertainty is about 1mm per cm of bone in the beam. CT-scan energy verification should be employed, particularly when high-density media is in the proton beam path.

  7. Spectroscopy of transient neutral species via negative ion photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Weaver, A.

    1991-12-01

    Negative ion photoelectron spectroscopy has been used to study two types of transient neutral species: bound free radicals (NO{sub 2} and NO{sub 3}) and unstable neutral species ((IHI) and (FH{sub 2})). The negative ion time-of-flight photoelectron spectrometer used for these experiments is described in detail.

  8. Spectroscopy of transient neutral species via negative ion photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Weaver, Alexandra [Univ. of California, Berkeley, CA (United States)

    1991-12-01

    Negative ion photoelectron spectroscopy has been used to study two types of transient neutral species: bound free radicals (NO2 and NO3) and unstable neutral species ([IHI] and [FH2]). The negative ion time-of-flight photoelectron spectrometer used for these experiments is described in detail.

  9. Scaling Laws for Photoelectron Holography in the Midinfrared Wavelength Regime

    NARCIS (Netherlands)

    Huismans, Y.; Gijsbertsen, A.; Smolkowska, A. S.; Jungmann, J. H.; Rouzee, A.; Logman, Pswm; Lepine, F.; Cauchy, C.; Zamith, S.; Marchenko, T.; Bakker, J. M.; G. Berden,; Redlich, B.; van der Meer, A. F. G.; Ivanov, M. Y.; Yan, T. M.; Bauer, D.; Smirnova, O.; Vrakking, M. J. J.

    2012-01-01

    Midinfrared strong-field laser ionization offers the promise of measuring holograms of atoms and molecules, which contain both spatial and temporal information of the ion and the photoelectron with subfemtosecond temporal and angstrom spatial resolution. We report on the scaling of photoelectron

  10. Scaling laws for photoelectron holography in the midinfrared wavelength regime

    NARCIS (Netherlands)

    Huismans, Y.; Gijsbertsen, A.; Smolkowska, A S; Jungmann, J H; Rouz??e, A.; Logman, P. S W M; L??pine, F.; Cauchy, C.; Zamith, S; Marchenko, T; Bakker, Joost M.; Berden, G.; Redlich, B; Van Der Meer, A. F G; Ivanov, M Yu; Yan, T. M.; Bauer, D.; Smirnova, O; Vrakking, M. J J

    2012-01-01

    Midinfrared strong-field laser ionization offers the promise of measuring holograms of atoms and molecules, which contain both spatial and temporal information of the ion and the photoelectron with subfemtosecond temporal and angstrom spatial resolution. We report on the scaling of photoelectron

  11. Photoelectron backscattering from silicon anodes of hybrid photodetector tubes

    CERN Document Server

    D'Ambrosio, C

    2000-01-01

    The impact of photoelectron backscattering on spectral distributions measured with hybrid photodetector tubes has been calculated. The calculations are based on the backscattering coefficient mu , the average number of photoelectrons N/sub phel/ emitted from the photocathode, and on the distribution of the fractional photoelectron energy q absorbed in silicon during the backscattering process. We obtained the following results: the average number of absorbed (measured) photoelectrons N/sub meas/ in the silicon anode amounts to ~88% of the incident N/sub phel/. Photoelectron- and gamma-absorption peaks are broadened by a factor 1.043 due to backscattering. As an example, for photomultiplier tubes, this broadening can amount to an average factor of 1.18 due to statistic and gain fluctuations on the dynode chain. (15 refs).

  12. Photoelectron spectrometer for attosecond spectroscopy of liquids and gases

    Energy Technology Data Exchange (ETDEWEB)

    Jordan, I.; Huppert, M.; Wörner, H. J., E-mail: hwoerner@ethz.ch [Laboratory of Physical Chemistry, ETH Zurich, Vladimir-Prelog-Weg 2, 8093 Zurich (Switzerland); Brown, M. A. [Laboratory for Surface Science and Technology, Department of Materials, ETH Zurich, Vladimir-Prelog-Weg 5, 8093 Zurich (Switzerland); Bokhoven, J. A. van [Institute for Chemical and Bioengineering, ETH Zurich, Vladimir-Prelog-Weg 1, 8093 Zurich (Switzerland); Laboratory for Catalysis and Sustainable Chemistry, Paul Scherrer Institute, 5232 Villigen (Switzerland)

    2015-12-15

    A new apparatus for attosecond time-resolved photoelectron spectroscopy of liquids and gases is described. It combines a liquid microjet source with a magnetic-bottle photoelectron spectrometer and an actively stabilized attosecond beamline. The photoelectron spectrometer permits venting and pumping of the interaction chamber without affecting the low pressure in the flight tube. This pressure separation has been realized through a sliding skimmer plate, which effectively seals the flight tube in its closed position and functions as a differential pumping stage in its open position. A high-harmonic photon spectrometer, attached to the photoelectron spectrometer, exit port is used to acquire photon spectra for calibration purposes. Attosecond pulse trains have been used to record photoelectron spectra of noble gases, water in the gas and liquid states as well as solvated species. RABBIT scans demonstrate the attosecond resolution of this setup.

  13. Threshold photoelectron spectroscopy of the imidogen radical

    Energy Technology Data Exchange (ETDEWEB)

    Garcia, Gustavo A., E-mail: gustavo.garcia@synchrotron-soleil.fr [Synchrotron SOLEIL, L’Orme des Merisiers, St. Aubin, BP 48, 91192 Gif sur Yvette (France); Gans, Bérenger [Institut des Sciences Moléculaires d’Orsay, Univ Paris-Sud, CNRS, Bât 210, Univ Paris-Sud, 91405 Orsay Cedex (France); Tang, Xiaofeng [Synchrotron SOLEIL, L’Orme des Merisiers, St. Aubin, BP 48, 91192 Gif sur Yvette (France); Ward, Michael; Batut, Sébastien [PC2A, Université de Lille 1, UMR CNRS-USTL 8522, Cité Scientifique Bât. C11, F-59655 Villeneuve d’Ascq (France); Nahon, Laurent [Synchrotron SOLEIL, L’Orme des Merisiers, St. Aubin, BP 48, 91192 Gif sur Yvette (France); Fittschen, Christa [PC2A, Université de Lille 1, UMR CNRS-USTL 8522, Cité Scientifique Bât. C11, F-59655 Villeneuve d’Ascq (France); Loison, Jean-Christophe [ISM, Université de Bordeaux, CNRS, 351 cours de la Libération, 33405 Talence Cedex (France)

    2015-08-15

    We present the threshold photoelectron spectroscopy of the imidogen radical (NH) recorded in the photon energy region up to 1 eV above its first ionization threshold. The radical was produced by reaction of NH{sub 3} and F in a microwave discharge flow-tube and photoionized using vacuum ultraviolet (VUV) synchrotron radiation. A double imaging coincidence spectrometer was used to record mass-selected spectra and avoid contributions from the byproducts present in the reactor and background gas. The energy region includes the ground X{sup +2}Π and first electronically excited a{sup +4}Σ{sup −} states of NH{sup +}. Strong adiabatic transitions and weak vibrational progressions up to v{sup +} = 2 are observed for both electronic states. The rotational profile seen in the origin band has been modeled using existing neutral and cationic spectroscopic constants leading to a precise determination of the adiabatic ionization energy at 13.480 ± 0.002 eV.

  14. Bimolecular reaction dynamics from photoelectron spectroscopy of negative ions

    Energy Technology Data Exchange (ETDEWEB)

    Bradforth, Stephen Edmund [Univ. of California, Berkeley, CA (United States)

    1992-11-01

    The transition state region of a neutral bimolecular reaction may be experimentally investigated by photoelectron spectroscopy of an appropriate negative ion. The photoelectron spectrum provides information on the spectroscopy and dynamics of the short lived transition state and may be used to develop model potential energy surfaces that are semi-quantitative in this important region. The principles of bound {yields} bound negative ion photoelectron spectroscopy are illustrated by way of an example: a full analysis of the photoelectron bands of CN-, NCO- and NCS-. Transition state photoelectron spectra are presented for the following systems Br + HI, Cl + HI, F + HI, F + CH30H,F + C2H5OH,F + OH and F + H2. A time dependent framework for the simulation and interpretation of the bound → free transition state photoelectron spectra is subsequently developed and applied to the hydrogen transfer reactions Br + HI, F + OH → O(3P, 1D) + HF and F + H2. The theoretical approach for the simulations is a fully quantum-mechanical wave packet propagation on a collinear model reaction potential surface. The connection between the wavepacket time evolution and the photoelectron spectrum is given by the time autocorrelation function. For the benchmark F + H2 system, comparisons with three-dimensional quantum calculations are made.

  15. Surface state photoelectrons in topological insulators: Green's function approach.

    Science.gov (United States)

    Schmeltzer, D; Saxena, A

    2015-12-09

    We compute the photoemission intensity and polarization for the surface states in topological insulators. Due to the chirality and linear energy dispersion the effective electron-photon coupling is normalized by the tunneling amplitude (τ) into the vacuum. We investigate a chiral Dirac Hamiltonian for different cases: helical, Zeeman and warping, allowing us to study spin textures. Using the Green's function formalism we obtain exact results for the emitted photoelectrons to second order in the laser field. The number of emitted photoelectrons is sensitive to the laser coherent state intensity whereas the photoelectron polarization is sensitive to the surface topology of electronic states and incoming photon polarization.

  16. The martian photoelectron boundary as seen by MAVEN

    Science.gov (United States)

    Garnier, P.; Steckiewicz, M.; Mazelle, C.; Xu, S.; Mitchell, D.; Holmberg, M. K. G.; Halekas, J. S.; Andersson, L.; Brain, D. A.; Espley, J. R.; Lillis, R. J.; Luhmann, J. G.; Sauvaud, J.-A.; Jakosky, B. M.

    2017-09-01

    We analyze here in details the location, drivers, properties, and implications for escape of the martian photoelectron boundary based on the Mars Atmosphere and Volatile Evolution (MAVEN) data obtained from September 2014 until May 2016.

  17. Emitter-site selective photoelectron circular dichroism of trifluoromethyloxirane

    OpenAIRE

    Ilchen, M.; Hartmann, G.; Schmidt, Ph.; Wolf, T. J. A.; Ehresmann, A.; Moeller, S.; Knie, A.; Demekhin, Ph. V.; Rupprecht, P.; Artemyev, A. N.; Coffee, R N; Li, Z; Ohldag, H.; Ogasawara, H.; Osipov, T.

    2017-01-01

    The angle-resolved inner-shell photoionization of R-trifluoromethyloxirane, C3H3F3O, is studied experimentally and theoretically. Thereby, we investigate the photoelectron circular dichroism (PECD) for nearly-symmetric O 1s and F 1s electronic orbitals, which are localized on different molecular sites. The respective dichroic $\\beta_{1}$ and angular distribution $\\beta_{2}$ parameters are measured at the photoelectron kinetic energies from 1 to 16 eV by using variably polarized synchrotron ra...

  18. The time-resolved photoelectron spectrum of toluene using a perturbation theory approach

    Science.gov (United States)

    Richings, Gareth W.; Worth, Graham A.

    2014-12-01

    A theoretical study of the intra-molecular vibrational-energy redistribution of toluene using time-resolved photo-electron spectra calculated using nuclear quantum dynamics and a simple, two-mode model is presented. Calculations have been carried out using the multi-configuration time-dependent Hartree method, using three levels of approximation for the calculation of the spectra. The first is a full quantum dynamics simulation with a discretisation of the continuum wavefunction of the ejected electron, whilst the second uses first-order perturbation theory to calculate the wavefunction of the ion. Both methods rely on the explicit inclusion of both the pump and probe laser pulses. The third method includes only the pump pulse and generates the photo-electron spectrum by projection of the pumped wavepacket onto the ion potential energy surface, followed by evaluation of the Fourier transform of the autocorrelation function of the subsequently propagated wavepacket. The calculations performed have been used to study the periodic population flow between the 6a and 10b16b modes in the S1 excited state, and compared to recent experimental data. We obtain results in excellent agreement with the experiment and note the efficiency of the perturbation method.

  19. The time-resolved photoelectron spectrum of toluene using a perturbation theory approach

    Energy Technology Data Exchange (ETDEWEB)

    Richings, Gareth W.; Worth, Graham A., E-mail: g.a.worth@bham.ac.uk [School of Chemistry, University of Birmingham, Edgbaston, Birmingham, B15 2TT (United Kingdom)

    2014-12-28

    A theoretical study of the intra-molecular vibrational-energy redistribution of toluene using time-resolved photo-electron spectra calculated using nuclear quantum dynamics and a simple, two-mode model is presented. Calculations have been carried out using the multi-configuration time-dependent Hartree method, using three levels of approximation for the calculation of the spectra. The first is a full quantum dynamics simulation with a discretisation of the continuum wavefunction of the ejected electron, whilst the second uses first-order perturbation theory to calculate the wavefunction of the ion. Both methods rely on the explicit inclusion of both the pump and probe laser pulses. The third method includes only the pump pulse and generates the photo-electron spectrum by projection of the pumped wavepacket onto the ion potential energy surface, followed by evaluation of the Fourier transform of the autocorrelation function of the subsequently propagated wavepacket. The calculations performed have been used to study the periodic population flow between the 6a and 10b16b modes in the S{sub 1} excited state, and compared to recent experimental data. We obtain results in excellent agreement with the experiment and note the efficiency of the perturbation method.

  20. Vibrational Cooling in A Cold Ion Trap: Vibrationally Resolved Photoelectron Spectroscopy of Cold C60- Anions

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Xue B.; Woo, Hin-koon; Wang, Lai S.

    2005-08-01

    We demonstrate vibrational cooling of anions via collisions with a background gas in an ion trap attached to a cryogenically controlled cold head (10 ? 400 K). Photoelectron spectra of vibrationally cold C60- anions, produced by electrospray ionization and cooled in the cold ion trap, have been obtained. Relative to spectra taken at room temperature, vibrational hot bands are completely eliminated, yielding well resolved vibrational structures and a more accurate electron affinity for neutral C60. The electron affinity of C60 is measured to be 2.683 ? 0.008 eV. The cold spectra reveal complicated vibrational structures for the transition to the C60 ground state due to the Jahn-Teller effect in the ground state of C60-. Vibrational excitations in the two Ag modes and eight Hg modes are observed, providing ideal data to assess the vibronic couplings in C60-.

  1. Tracking ultrafast relaxation dynamics of furan by femtosecond photoelectron imaging

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Yuzhu, E-mail: yuzhu.liu@gmail.com [School of Physics and Optoelectronic Engineering, Nanjing University of Information Science and Technology, Nanjing 210044 (China); Knopp, Gregor [Paul Scherrer Institute, Villigen 5232 (Switzerland); Qin, Chaochao [Department of Physics, Henan Normal University, Xinxiang 453007 (China); Gerber, Thomas [Paul Scherrer Institute, Villigen 5232 (Switzerland)

    2015-01-13

    Graphical abstract: - Highlights: • Relaxation dynamics of furan are tracked by femtosecond photoelectron imaging. • The mechanism for ultrafast formation of α-carbene and β-carbene is proposed. • Ultrafast internal conversion from S{sub 2} to S{sub 1} is observed. • The transient characteristics of the fragment ions are obtained. • Single-color multi-photon ionization dynamics at 800 nm are also studied. - Abstract: Ultrafast internal conversion dynamics of furan has been studied by femtosecond photoelectron imaging (PEI) coupled with photofragmentation (PF) spectroscopy. Photoelectron imaging of single-color multi-photon ionization and two-color pump–probe ionization are obtained and analyzed. Photoelectron bands are assigned to the related states. The time evolution of the photoelectron signal by pump–probe ionization can be well described by a biexponential decay: two rapid relaxation pathways with time constants of ∼15 fs and 85 (±11) fs. The rapid relaxation is ascribed to the ultrafast internal conversion (IC) from the S{sub 2} state to the vibrationally hot S{sub 1} state. The second relaxation process is attributed to the redistributions and depopulation of secondarily populated high vibronic S{sub 1} state and the formation of α-carbene and β-carbene by H immigration. Additionally, the transient characteristics of the fragment ions are also measured and discussed as a complementary understanding.

  2. 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: Catalin.Miron@synchrotron-soleil.fr [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)

    2015-09-28

    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.

  3. Multimode Jahn-Teller and pseudo-Jahn-Teller coupling effects in the photoelectron spectrum of CH 3F

    Science.gov (United States)

    Mahapatra, S.; Vallet, V.; Woywod, C.; Köppel, H.; Domcke, W.

    2004-09-01

    The multimode Jahn-Teller (JT) and pseudo-Jahn-Teller (PJT) coupling effects in the photoelectron spectrum of methylfluoride are theoretically investigated with the aid of an ab initio quantum dynamical approach. The theoretical findings are compared with the experimental results of Karlsson et al. [Phys. Scripta 16 (1977) 225]. At the vertical configuration, the ground, first and second excited electronic states of the methylfluoride radical cation belong to the 2E, 2A 1 and 2E symmetry species. The three doubly degenerate vibrational modes cause a splitting of the degeneracy of the E electronic states of the radical cation and exhibit the (E⊗e)-JT effect. The same vibrational modes may also cause a coupling of the degenerate and the non-degenerate electronic states (PJT effect). In our theoretical approach we devise a model diabatic vibronic Hamiltonian within a quadratic vibronic coupling scheme. The parameters of the Hamiltonian are derived by performing extensive ab initio calculations at the CASSCF-MR-AQCC level of theory. The photoelectron bands are calculated by a quantum dynamical approach based on the Lanczos algorithm. A detailed examination of the various static and dynamic aspects of the problem reveals an interesting interplay of JT and PJT coupling effects in the photoelectron-induced dynamics of CH 3F +. The resolved progression in the first photoelectron band corresponding to the ground X˜2E electronic manifold of CH 3F + is found to be mainly caused by the C-F stretching (a 1), C-F bending (e) and CH 3 deformation (e) modes. The JT coupling effects are not particularly strong in this electronic manifold. This also holds for the second photoelectron band attributed to the vibronic structure of the Ã2A1 and B˜2E electronic states of CH 3F +. However, the extremely large Condon activity of the symmetric vibrational modes in the Ã2A1 electronic state contributes much to the broad and highly diffuse nature of this band which is also observed

  4. Photoelectron spectroscopy in heavy fermions: Inconsistencies with the Kondo model

    Energy Technology Data Exchange (ETDEWEB)

    Arko, A.J.; Joyce, J.J.; Blyth, R.R.; Canfield, P.C.; Thompson, J.D.; Bartlett, R.J.; Fisk, Z. [Los Alamos National Lab., NM (United States); Lawrence, J.; Tang, J. [California Univ., Irvine, CA (United States); Riseborough, P. [Polytechnic Univ., Brooklyn, NY (United States)

    1992-09-01

    We have investigated a number of Ce and Yb heavy fermion compounds via photoelectron spectroscopy and compared the results to the predictions of the Imurity Anderson Hamiltonian within the Gunnarson-Schonhammer approach. For the low T{sub K} materials investigated we find little or no correlation with T{sub K}, the only parameter that can be determined independent of photoemission.

  5. Graphene defect formation by extreme ultraviolet generated photoelectrons

    NARCIS (Netherlands)

    Gao, An; Lee, Christopher James; Bijkerk, Frederik

    2014-01-01

    We have studied the effect of photoelectrons on defect formation in graphene during extreme ultraviolet (EUV) irradiation. Assuming the major role of these low energy electrons, we have mimicked the process by using low energy primary electrons. Graphene is irradiated by an electron beam with energy

  6. Secondary-electron cascade in attosecond photoelectron spectroscopy from metals

    DEFF Research Database (Denmark)

    Baggesen, Jan Conrad; Madsen, Lars Bojer

    2009-01-01

    Attosecond spectroscopy is currently restricted to photon energies around 100 eV. We show that under these conditions, electron-electron scatterings, as the photoelectrons leave the metal, give rise to a tail of secondary electrons with lower energies and hence a significant background. We develop...

  7. Langmuir Wave Instability And Photoelectron Emission In Irradiated ...

    African Journals Online (AJOL)

    We have investigated dust charged fluctuation due to the combined effect of Langmuir Wave and Photoelectron Emission in Irradiated Dusty Plasma. The dispersion relation and growth of the Langmuir wave instability is also presented. The applicability of the developed dispersion relation and growth rate of the Langmuir ...

  8. Effects of photoelectrons on gold cathode gauges in KEKB Accelerator

    Energy Technology Data Exchange (ETDEWEB)

    Suetsugu, Yusuke; Hisamatsu, Hiromi; Kanazawa, Ken-ichi [High Energy Accelerator Research Organization, Tsukuba, Ibaraki (Japan)

    2000-03-01

    Some cold cathode gauges (CCGs) in KEKB Accelerator show different behavior from other ones. These gauges have following characteristics: (1) The locations of these CCGs are limited to just downstream side of bending magnets where the synchrotron radiation is intense. (2) The discharge current is proportional to the beam current. (3) The discharge current is observed even without a permanent magnet of CCG. (4) The discharge current per unit beam current approaches to a constant value as the integrated beam current increases. From these characteristics, the observed abnormal discharge current of these CCGs is considered to be due to the photoelectrons generated by the synchrotron radiation. A simulation shows that the electrons are not generated inside of the beam chamber but inside the gauge chamber by reflected SR or accelerated photoelectrons that are produced inside the beam chamber. Attaching small dipole magnet at the neck of CCG port can remove the effect of secondary electrons. (author)

  9. Recent trends in spin-resolved photoelectron spectroscopy

    Science.gov (United States)

    Okuda, Taichi

    2017-12-01

    Since the discovery of the Rashba effect on crystal surfaces and also the discovery of topological insulators, spin- and angle-resolved photoelectron spectroscopy (SARPES) has become more and more important, as the technique can measure directly the electronic band structure of materials with spin resolution. In the same way that the discovery of high-Tc superconductors promoted the development of high-resolution angle-resolved photoelectron spectroscopy, the discovery of this new class of materials has stimulated the development of new SARPES apparatus with new functions and higher resolution, such as spin vector analysis, ten times higher energy and angular resolution than conventional SARPES, multichannel spin detection, and so on. In addition, the utilization of vacuum ultra violet lasers also opens a pathway to the realization of novel SARPES measurements. In this review, such recent trends in SARPES techniques and measurements will be overviewed.

  10. Angular distribution and atomic effects in condensed phase photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Davis, R.F.

    1981-11-01

    A general concept of condensed phase photoelectron spectroscopy is that angular distribution and atomic effects in the photoemission intensity are determined by different mechanisms, the former being determined largely by ordering phenomena such as crystal momentum conservation and photoelectron diffraction while the latter are manifested in the total (angle-integrated) cross section. In this work, the physics of the photoemission process is investigated in several very different experiments to elucidate the mechanisms of, and correlation between, atomic and angular distribution effects. Theoretical models are discussed and the connection betweeen the two effects is clearly established. The remainder of this thesis, which describes experiments utilizing both angle-resolved and angle-integrated photoemission in conjunction with synchrotron radiation in the energy range 6 eV less than or equal to h ..nu.. less than or equal to 360 eV and laboratory sources, is divided into three parts.

  11. Low-energy photoelectron transmission through aerosol overlayers

    Science.gov (United States)

    Amanatidis, Stavros; Yoder, Bruce L.; Signorell, Ruth

    2017-06-01

    The transmission of low-energy (squalane, squalene, and di-ethyl-hexyl-sebacate shells. The photoelectrons are exclusively formed in the core of the particles by two-photon ionization. The total photoelectron yield recorded as a function of shell thicknesses (1-80 nm) shows a bi-exponential attenuation. For all substances, the damping parameter for shell thicknesses below 15 nm lies around 8 to 9 nm and is tentatively assigned to the electron attenuation length at electron kinetic energies of ≲1 eV. The significantly larger damping parameters for thick shells (>20 nm) are presumably a consequence of distorted core-shell structures. A first comparison of aerosol and traditional thin film overlayer methods is provided.

  12. Photoelectron spectra and biological activity of cinnamic acid derivatives revisited

    Science.gov (United States)

    Novak, Igor; Klasinc, Leo; McGlynn, Sean P.

    2018-01-01

    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).

  13. Enantioselective femtosecond laser photoionization spectrometry of limonene using photoelectron circular dichroism

    NARCIS (Netherlands)

    Rafiee Fanood, M.M.; Janssen, M.H.M.; Powis, I.

    2015-01-01

    Limonene is ionized by circularly polarized 420 nm femtosecond laser pulses. Ion mass and photoelectron energy spectra identify the dominant (2 + 1) multiphoton ionization mechanism, aided by TDDFT calculations of the Rydberg excitations. Photoelectron circular dichroism measurements on pure

  14. Circular dichroism in photoelectron images from aligned nitric oxide molecules.

    Science.gov (United States)

    Sen, Ananya; Pratt, S T; Reid, K L

    2017-07-07

    We have used velocity map photoelectron imaging to study circular dichroism of the photoelectron angular distributions (PADs) of nitric oxide following two-color resonance-enhanced two-photon ionization via selected rotational levels of the A (2)Σ(+), v(')=0 state. By using a circularly polarized pump beam and a counter-propagating, circularly polarized probe beam, cylindrical symmetry is preserved in the ionization process, and the images can be reconstructed using standard algorithms. The velocity map imaging set up enables individual ion rotational states to be resolved with excellent collection efficiency, rendering the measurements considerably simpler to perform than previous measurements conducted with a conventional photoelectron spectrometer. The results demonstrate that circular dichroism is observed even when cylindrical symmetry is maintained, and serve as a reminder that dichroism is a general feature of the multiphoton ionization of atoms and molecules. The observed PADs are in good agreement with calculations based on parameters extracted from previous experimental results obtained by using a time-of-flight electron spectrometer.

  15. Ultrafast photoelectron spectroscopy of solutions: space-charge effect

    Science.gov (United States)

    Al-Obaidi, R.; Wilke, M.; Borgwardt, M.; Metje, J.; Moguilevski, A.; Engel, N.; Tolksdorf, D.; Raheem, A.; Kampen, T.; Mähl, S.; Kiyan, I. Yu; Aziz, E. F.

    2015-09-01

    The method of time-resolved XUV photoelectron spectroscopy is applied in a pump-probe experiment on a liquid micro-jet. We investigate how the XUV energy spectra of photoelectrons are influenced by the space charge created due to ionization of the liquid medium by the pump laser pulse. XUV light from high-order harmonic generation is used to probe the electron population of the valence shell of iron hexacyanide in water. By exposing the sample to a short UV pump pulse of 266 nm wavelength and ˜55 fs duration, we observe an energy shift of the spectral component associated with XUV ionization from the Fe 3d(t2g) orbital as well as a shift of the water spectrum. Depending on the sequence of the pump and probe pulses, the arising energy shift of photoelectrons acquires a positive or negative value. It exhibits a sharp positive peak at small time delays, which facilitates to determine the temporal overlap between pump and probe pulses. The negative spectral shift is due to positive charge accumulated in the liquid medium during ionization. Its dissipation is found to occur on a (sub)nanosecond time scale and has a biexponential character. A simple mean-field model is provided to interpret the observations. A comparison between the intensity dependencies of the spectral shift and the UV ionization yield shows that the space-charge effect can be significantly reduced when the pump intensity is attenuated below the saturation level of water ionization. For the given experimental conditions, the saturation intensity lies at 6× {10}10 W cm-2.

  16. Geometry Optimization of DC/RF Photoelectron Gun

    CERN Document Server

    Chen Ping; Yu, David

    2005-01-01

    Pre-acceleration of photoelectrons in a pulsed, high voltage, short, dc gap and its subsequent injection into an rf gun is a promising method to improve electron beam emittance in rf accelerators. Simulation work has been performed in order to optimize the geometric shapes of a dc/rf gun and improve electron beam properties. Variations were made on cathode and anode shapes, dc gap distance, and inlet shape of the rf cavity. Simulations showed that significant improvement on the normalized emittance (< 1 mm-mrad), compared to a dc gun with flat cathode, could be obtained after the geometric shapes of the gun were optimized.

  17. Photoelectron diffraction of magnetic ultrathin films: Fe/Cu(001)

    Energy Technology Data Exchange (ETDEWEB)

    Tobin, J.G. (Lawrence Livermore National Lab., CA (USA)); Wagner, M.K. (Wisconsin Univ., Madison, WI (USA). Dept. of Chemistry); Guo, X.Q.; Tong, S.Y. (Wisconsin Univ., Milwaukee, WI (USA). Dept. of Physics)

    1991-01-03

    The preliminary results of an ongoing investigation of Fe/Cu(001) are presented here. Energy dependent photoelectron diffraction, including the spin-dependent variant using the multiplet split Fe3s state, is being used to investigate the nanoscale structures formed by near-monolayer deposits of Fe onto Cu(001). Core-level photoemission from the Fe3p and Fe3s states has been generated using synchrotron radiation as the tunable excitation source. Tentatively, a comparison of the experimental Fe3p cross section measurements with multiple scattering calculations indicates that the Fe is in a fourfold hollow site with a spacing of 3.6{Angstrom} between it and the atom directly beneath it, in the third layer. This is consistent with an FCC structure. The possibility of utilizing spin-dependent photoelectron diffraction to investigate magnetic ultrathin films will be demonstrated, using our preliminary spectra of the multiplet-split Fe3s os near-monolayer Fe/Cu(001). 18 refs., 10 figs.

  18. Analytic quantum-interference conditions in Coulomb corrected photoelectron holography

    Science.gov (United States)

    Maxwell, A. S.; Al-Jawahiry, A.; Lai, X. Y.; Figueira de Morisson Faria, C.

    2018-02-01

    We provide approximate analytic expressions for above-threshold ionization (ATI) transition probabilities and photoelectron angular distributions. These analytic expressions are more general than those existing in the literature and include the residual binding potential in the electron continuum propagation. They successfully reproduce the ATI side lobes and specific holographic structures such as the near-threshold fan-shaped pattern and the spider-like structure that extends up to relatively high photoelectron energies. We compare such expressions with the Coulomb quantum orbit strong-field approximation (CQSFA) and the full solution of the time-dependent Schrödinger equation for different driving-field frequencies and intensities, and provide an in-depth analysis of the physical mechanisms behind specific holographic structures. Our results shed additional light on what aspects of the CQSFA must be prioritized in order to obtain the key holographic features, and highlight the importance of forward scattered trajectories. Furthermore, we find that the holographic patterns change considerably for different field parameters, even if the Keldysh parameter is kept roughly the same.

  19. Emitter-site-selective photoelectron circular dichroism of trifluoromethyloxirane

    Science.gov (United States)

    Ilchen, M.; Hartmann, G.; Rupprecht, P.; Artemyev, A. N.; Coffee, R. N.; Li, Z.; Ohldag, H.; Ogasawara, H.; Osipov, T.; Ray, D.; Schmidt, Ph.; Wolf, T. J. A.; Ehresmann, A.; Moeller, S.; Knie, A.; Demekhin, Ph. V.

    2017-05-01

    The angle-resolved inner-shell photoionization of R-trifluoromethyloxirane, C3H3F3O , is studied experimentally and theoretically. Thereby, we investigate the photoelectron circular dichroism (PECD) for nearly symmetric O 1 s and F 1 s electronic orbitals, which are localized on different molecular sites. The respective dichroic β1 and angular distribution β2 parameters are measured at the photoelectron kinetic energies from 1 to 16 eV by using variably polarized synchrotron radiation and velocity map imaging spectroscopy. The present experimental results are in good agreement with the outcome of ab initio electronic structure calculations. We report a sizable chiral asymmetry β1 of up to about 9% for the K -shell photoionization of oxygen atom. For the individual fluorine atoms, the present calculations predict asymmetries of similar size. However, being averaged over all fluorine atoms, it drops down to about 2%, as also observed in the present experiment. Our study demonstrates a strong emitter and site sensitivity of PECD in the one-photon inner-shell ionization of this chiral molecule.

  20. Photoelectron spectroscopy and Auger electron spectroscopy of solids and surfaces

    Energy Technology Data Exchange (ETDEWEB)

    Kowalczyk, S.P.

    1976-01-01

    The use of photoelectron spectroscopy, primarily x-ray photoelectron spectroscopy, to obtain information on the electronic structure of a wide variety of solids (especially the bulk electronic structure of solids) is covered. Both valence band and core-level spectra, as well as a few cases of photon excited Auger electron spectroscopy, are employed in the investigations to derive information on N(E). The effect of several modulations inherent in the measured I(E)'s, such as final state band structure, cross section, and relaxation, is discussed. Examples of many-electron interactions in PES are given. Some experimental aspects of PES and AES studies are given with emphasis on sample preparation techniques. Multiple splitting of core levels is examined using the Mn levels in MnF/sub 2/ as a detailed case study. Core level splittings in transition metals, rare earth metals, transition metal halides and several alloys are also reported. The application of PES to the study of the chemical bond in some crystalline semiconductors and insulators, A/sup N/B/sup 8-N/ and A/sup N/B/sup 10-N/ compounds is treated, and a spectroscopic scale of ionicity for these compounds is developed from the measured ''s-band'' splitting in the valence band density of states. (GHT)

  1. Photoelectron spectroscopy of a series of acetate and propionate esters

    Science.gov (United States)

    Śmiałek, Małgorzata A.; Guthmuller, Julien; MacDonald, Michael A.; Zuin, Lucia; Delwiche, Jacques; Hubin-Franskin, Marie-Jeanne; Lesniewski, Tadeusz; Mason, Nigel J.; Limão-Vieira, Paulo

    2017-10-01

    The electronic state and photoionization spectroscopy of a series of acetate esters: methyl acetate, isopropyl acetate, butyl acetate and pentyl acetate as well as two propionates: methyl propionate and ethyl propionate, have been determined using vacuum-ultraviolet photoelectron spectroscopy. These experimental investigations are complemented by ab initio calculations. The measured first adiabatic and vertical ionization energies were determined as: 10.21 and 10.45 eV for methyl acetate, 9.99 and 10.22 eV for isopropyl acetate, 10.07 and 10.26 eV for butyl acetate, 10.01 and 10.22 eV for pentyl acetate, 10.16 and 10.36 eV for methyl propionate and 9.99 and 10.18 eV for ethyl propionate. For the four smaller esters vibrational transitions were calculated and compared with those identified in the photoelectron spectrum, revealing the most distinctive ones to be a Csbnd O stretch combined with a Cdbnd O stretch. The ionization energies of methyl and ethyl esters as well as for a series of formates and acetates were compared showing a clear dependence of the value of the ionization energy on the size of the molecule with very little influence of its conformation.

  2. Photoion-photoelectron coincidence studies clusters and transient molecules

    Energy Technology Data Exchange (ETDEWEB)

    Norwood, K.

    1990-11-16

    Experimental photoion-photoelectron coincidence (PIPECO) spectra have been obtained at different nozzle stagnation pressures for Ar, Kr, Xe, and CO dimers and trimers in the wavelength regions corresponding to the respective ground states through all states accessible with a photon energy of 20 eV. Ionization energies for all ground states were measured and agree well with previously reported values. The formation of stable dimer ions from fragmentation of larger cluster ions initially produced by photoionization is efficient. For nozzle expansion conditions which minimize the formation of clusters larger than dimers, the intensities of the excited PIPECO bands for all clusters, except Ar{sub 2}{sup +} and Ar{sub 3}{sup +}, are found to be negligible with respect to the ground state PIPECO bands. The PIPECO technique has been used successfully to obtain the mass-selected threshold photoelectron spectra of the SO and S{sub 2}O transient molecules formed from a microwave discharge, effusive beam source. Analysis of the PIPECO spectra of all the clusters and transient molecules are presented. 177 refs., 32 figs., 6 tabs.

  3. Ultrafast photoelectron spectroscopy of small molecule organic films

    Science.gov (United States)

    Read, Kendall Laine

    As research in the field of ultrafast optics has produced shorter and shorter pulses, at an ever-widening range of frequencies, ultrafast spectroscopy has grown correspondingly. In particular, ultrafast photoelectron spectroscopy allows direct observation of electrons in transient or excited states, regardless of the eventual relaxation mechanisms. High-harmonic conversion of 800nm, femtosecond, Ti:sapphire laser pulses allows excite/probe spectroscopy down into atomic core level states. To this end, an ultrafast, X-UV photoelectron spectroscopic system is described, including design considerations for the high-harmonic generation line, the time of flight detector, and the subsequent data collection electronics. Using a similar experimental setup, I have performed several ultrafast, photoelectron excited state decay studies at the IBM, T. J. Watson Research Center. All of the observed materials were electroluminescent thin film organics, which have applications as the emitter layer in organic light emitting devices. The specific materials discussed are: Alq, BAlq, DPVBi, and Alq doped with DCM or DMQA. Alq:DCM is also known to lase at low photoexcitation thresholds. A detailed understanding of the involved relaxation mechanisms is beneficial to both applications. Using 3.14 eV excite, and 26.7 eV probe, 90 fs laser pulses, we have observed the lowest unoccupied molecular orbital (LUMO) decay rate over the first 200 picoseconds. During this time, diffusion is insignificant, and all dynamics occur in the absence of electron transport. With excitation intensities in the range of 100μJ/cm2, we have modeled the Alq, BAlq, and DPVBi decays via bimolecular singlet-singlet annihilation. At similar excitations, we have modeled the Alq:DCM decay via Förster transfer, stimulated emission, and excimeric formation. Furthermore, the Alq:DCM occupied to unoccupied molecular orbital energy gap was seen to shrink as a function of excite-to-probe delay, in accordance with the

  4. Attosecond photoelectron spectroscopy of electron transport in solids

    Energy Technology Data Exchange (ETDEWEB)

    Magerl, Elisabeth

    2011-03-31

    Time-resolved photoelectron spectroscopy of condensed matter systems in the attosecond regime promises new insights into excitation mechanisms and transient dynamics of electrons in solids. This timescale became accessible directly only recently with the development of the attosecond streak camera and of laser systems providing few-cycle, phase-controlled laser pulses in the near-infrared, which are used to generate isolated, sub-femtosecond extreme-ultraviolet pulses with a well-defined timing with respect to the near-infrared pulse. Employing these pulses, the attosecond streak camera offers time resolutions as short as a few 10 attoseconds. In the framework of this thesis, a new, versatile experimental apparatus combining attosecond pulse generation in gases with state of the art surface science techniques is designed, constructed, and commissioned. Employing this novel infrastructure and the technique of the attosecond transient recorder, we investigate transport phenomena occurring after photoexcitation of electrons in tungsten and rhenium single crystals and show that attosecond streaking is a unique method for resolving extremely fast electronic phenomena in solids. It is demonstrated that electrons originating from different energy levels, i.e. from the conduction band and the 4f core level, are emitted from the crystal surface at different times. The origin of this time delay, which is below 150 attoseconds for all studied systems, is investigated by a systematic variation of several experimental parameters, in particular the photon energy of the employed attosecond pulses. These experimental studies are complemented by theoretical studies of the group velocity of highly-excited electrons based on ab initio calculations. While the streaking technique applied on single crystals can provide only information about the relative time delay between two types of photoelectrons, the absolute transport time remains inaccessible. We introduce a scheme of a reference

  5. The altitude variation of the ionospheric photoelectron flux A comparison of theory and measurement

    Science.gov (United States)

    Richards, P. G.; Torr, D. G.

    1985-01-01

    The 145 to 300-km altitude variation of the measured photoelectron flux in the 13 to 18 eV, 28 to 34 eV, and 50 to 55 eV energy regions are compared with the variations expected from theory. There is a strong linear relationship between the measured photoelectron flux and the attenuation of the solar EUV flux at these energies. Therefore, the photoelectron flux is sensitive to changes in the solar zenith angle, neutral density scale height, and total neutral density. However, contrary to previous assertions, the photoelectron flux at most energies is not sensitive to the relative densities of the neutral constituents. In addition, good agreement between theory and measurement is obtained. By using the concept of photoelectron production frequencies, the usually complex evaluation of the local equilibrium photoelectron flux is reduced to a trivial calculation so that the steps in the calculation can be readily verified.

  6. Nanotip-based photoelectron microgun for ultrafast LEED

    Science.gov (United States)

    Storeck, Gero; Vogelgesang, Simon; Sivis, Murat; Schäfer, Sascha; Ropers, Claus

    2017-01-01

    We present the design and fabrication of a micrometer-scale electron gun for the implementation of ultrafast low-energy electron diffraction from surfaces. A multi-step process involving photolithography and focused-ion-beam nanostructuring is used to assemble and electrically contact the photoelectron gun, which consists of a nanotip photocathode in a Schottky geometry and an einzel lens for beam collimation. We characterize the low-energy electron pulses by a transient electric field effect and achieve pulse durations of 1.3 ps at an electron energy of 80 eV. First diffraction images in a backscattering geometry (at 50 eV electron energy) are shown. PMID:28580366

  7. Photoelectron Emission Spectroscopy of Inorganic Cations in Aqueous Solution.

    Science.gov (United States)

    1980-12-01

    I.7 Equation (12) clearly shows the relationship between the free energies AGz(aq) and AG for photoelectron emission and thermodynamics in the...York, 1963, pp. 1-30). (i.0OSelected Values of Chemical Thermodynamic Properties, Circular No. 500 of the National Bureau of Standards (U. S...data E " z 4,61 - G B t S eV eV eV Ag+ 7.60 (Cl04), 7.52 (C104, 5 M HCLO4 ) 21.48 4.95 3.80 T1+ 7.40 (F-), 7.46 (C10, 5 H HC1O4) 20.42 3.55 4.67 V2

  8. X-Ray Photoelectron Spectroscopic Characterization of Iron Oxide Nanoparticles

    Science.gov (United States)

    Radu, T.; Iacovita, C.; Benea, D.; Turcu, R.

    2017-05-01

    We report X-ray photoelectron spectroscopy (XPS) results on iron oxide magnetic nanoparticle (Fe3O4) synthesized using solvothermal reduction in the presence of polyethylene glycol. The magnetite obtained was employed as precursor for the synthesis of γ-Fe2O3 (by oxygen dissociation) which in turn was transformed into α-Fe2O3. We confirmed the magnetite, maghemite and hematite structure by Fourier Transformed Spectroscopy (FTIR) and X-ray diffraction (XRD). The analysis of the XPS core level and valence band (VB) photoemission spectra for all investigated samples is discussed in terms of the degree of iron oxidation. This is of fundamental importance to better understand the electronic structure of the obtained iron oxide nanoparticles in order to control and improve their quality for specific biomedical applications. Moreover, theoretical band structure calculations are performed for magnetite and the separate contributions of Fe in tetragonal and octahedral environment are shown.

  9. Photoelectron microscopy in the life sciences: Imaging neuron networks

    Energy Technology Data Exchange (ETDEWEB)

    Mercanti, D. (Istituto di Neurobiologia del CNR, Viale Marx 15, 00100 Roma (Italy)); De Stasio, G. (ISM-CNR, Via E. Fermi 38, 00044 Frascati, Roma (Italy)); Ciotti, M.T. (Istituto di Neurobiologia del CNR, Viale Marx 15, 00100 Roma (Italy)); Capasso, C.; Ng, W.; Ray-Chaudhuri, A.K.; Liang, S.H.; Cole, R.K.; Guo, Z.Y.; Wallace, J. (Department of Physics, University of Wisconsin, Madison, WI (USA) Electrical and Computer Engineering, University of Wisconsin, Madison, WI (USA)); Margaritondo, G. (Institut de Physique Appliquee, Ecole Polytechnique Federale de Lausanne, Ecublens (Switzerland)); Cerrina, F. (Departments of Physics, University of Wisconsin, Madison, WI (USA) Electrical and Computer Engineering, University of Wisconsin, Madison, WI (USA)); Underwood, J.; Perera, R.; Kortright, J. (Center for X-ray Optics, Lawrence Berkeley Laboratory, Berkeley, CA 94720 (USA))

    1991-05-01

    Photoemission techniques like electron spectroscopy for chemical analysis are the leading electronic probes in materials science---but their impact in the life sciences has been minimal. A critical problem is that the lateral resolution in ordinary photoemission does not exceed a few tenths of a millimeter. This space-averaged probe is nearly useless for most of the fundamental problems in biophysics and biochemistry, which deal with microstructures in the submicron range or smaller. This limit is being overcome with photoemission microscopes, such as our scanning instrument MAXIMUM. The first scanning photoelectron micrographs of a cellular system with submicron resolution are presented. Minute details of neuron networks are imaged on MAXIMUM, thereby opening the way to novel applications of photoemission in the life sciences. The details include individual neurons, axons, dendrites, and synapses, and composite large-area scanning micrographs were routinely produced with a lateral resolution of 0.5 {mu}m.

  10. X-ray photoelectron spectroscopy of FeP phosphide

    Energy Technology Data Exchange (ETDEWEB)

    Teterin, Yu. A.; Sobolev, A. V., E-mail: salex12@rambler.ru, E-mail: alex@radio.chem.msu.ru; Presnyakov, I. A.; Maslakov, K. I. [Moscow State University (Russian Federation); Teterin, A. Yu. [National Research Center “Kurchatov Institute,” (Russian Federation); Morozov, I. V.; Chernyavskii, I. O. [Moscow State University (Russian Federation); Ivanov, K. E. [National Research Center “Kurchatov Institute,” (Russian Federation); Shevel’kov, A. V. [Moscow State University (Russian Federation)

    2017-02-15

    The structure of the outer and inner electron spectra of iron (2p, 3p, 3s, and 3d) and phosphorus (3s and 3p) atoms in FeP monophosphide is studied in detail by the X-ray photoelectron spectroscopy (XPS) method. On the basis of the analysis of the binding energy of electrons, as well as the parameters characterizing the structure of experimental spectra, a conclusion is made that Fe{sup 3+} (d{sup 5}) cations in FeP are stabilized in a state with intermediate value of the total spin (IS, S = 3/2). The range of values of intra-atomic parameters (10Dq, J{sub H}) is established in which the consideration of the high degree of covalence of Fe–P bonds may lead to the stabilization of (FeP{sub 6}){sup 15–} clusters in the IS state.

  11. Core level photoelectron spectroscopy probed heterogeneous xenon/neon clusters

    Science.gov (United States)

    Pokapanich, Wandared; Björneholm, Olle; Öhrwall, Gunnar; Tchaplyguine, Maxim

    2017-06-01

    Binary rare gas clusters; xenon and neon which have a significant contrariety between sizes, produced by a co-expansion set up and have been studied using synchrotron radiation based x-ray photoelectron spectroscopy. Concentration ratios of the heterogeneous clusters; 1%, 3%, 5% and 10% were controlled. The core level spectra were used to determine structure of the mixed cluster and analyzed by considering screening mechanisms. Furthermore, electron binding energy shift calculations demonstrated cluster aggregation models which may occur in such process. The results showed that in the case of low mixing ratios of 3% and 5% of xenon in neon, the geometric structures exhibit xenon in the center and xenon/neon interfaced in the outer shells. However, neon cluster vanished when the concentration of xenon was increased to 10%.

  12. SPIN POLARIZED PHOTOELECTRON SPECTROSCOPY AS A PROBE OF MAGNETIC SYSTEMS.

    Energy Technology Data Exchange (ETDEWEB)

    JOHNSON, P.D.; GUNTHERODT, G.

    2006-11-01

    Spin-polarized photoelectron spectroscopy has developed into a versatile tool for the study of surface and thin film magnetism. In this chapter, we examine the methodology of the technique and its recent application to a number of different problems. We first examine the photoemission process itself followed by a detailed review of spin-polarization measurement techniques and the related experimental requirements. We review studies of spin polarized surface states, interface states and quantum well states followed by studies of the technologically important oxide systems including half-metallic transition metal oxides, ferromagnet/oxide interfaces and the antiferromagnetic cuprates that exhibit high Tc Superconductivity. We also discuss the application of high-resolution photoemission with spin resolving capabilities to the study of spin dependent self energy effects.

  13. Size Effects in Angle-Resolved Photoelectron Spectroscopy of Free Rare-Gas Clusters

    Energy Technology Data Exchange (ETDEWEB)

    Rolles, D.; Zhang, H.; Pesic, Z.D.; Bilodeau, R.C.; Wills, A.; Kukk, E.; Rude, B.S.; Ackerman, G.D.; Bozek, J.D.; Muino, R.D.; de Abajo, F.J.G.; Berrah, N.; /Western

    2007-05-23

    The photoionization of free Xe clusters is investigated by angle-resolved time-of-flight photoelectron spectroscopy. The measurements probe the evolution of the photoelectron angular distribution parameter as a function of photon energy and cluster size. While the overall photon-energy-dependent behavior of the photoelectrons from the clusters is very similar to that of the free atoms, distinct differences in the angular distribution point at cluster-size-dependent effects. Multiple scattering calculations trace their origin to elastic photoelectron scattering.

  14. Development of a Portable Single Photon Ionization-Photoelectron Ionization Time-of-Flight Mass Spectrometer

    Directory of Open Access Journals (Sweden)

    Yunguang Huang

    2015-01-01

    Full Text Available A vacuum ultraviolet lamp based single photon ionization- (SPI- photoelectron ionization (PEI portable reflecting time-of-flight mass spectrometer (TOFMS was designed for online monitoring gas samples. It has a dual mode ionization source: SPI for analyte with ionization energy (IE below 10.6 eV and PEI for IE higher than 10.6 eV. Two kinds of sampling inlets, a capillary inlet and a membrane inlet, are utilized for high concentration and trace volatile organic compounds, respectively. A mass resolution of 1100 at m/z 64 has been obtained with a total size of 40 × 31 × 29 cm, the weight is 27 kg, and the power consumption is only 70 W. A mixture of benzene, toluene, and xylene (BTX, SO2, and discharging products of SF6 were used to test its performance, and the result showed that the limit of quantitation for BTX is as low as 5 ppbv (S/N = 10 : 1 with linear dynamic ranges greater than four orders of magnitude. The portable TOFMS was also evaluated by analyzing volatile organic compounds from wine and decomposition products of SF6 inside of a gas-insulated switchgear.

  15. Characterization of fast photoelectron packets in weak and strong laser fields in ultrafast electron microscopy.

    Science.gov (United States)

    Plemmons, Dayne A; Tae Park, Sang; Zewail, Ahmed H; Flannigan, David J

    2014-11-01

    The development of ultrafast electron microscopy (UEM) and variants thereof (e.g., photon-induced near-field electron microscopy, PINEM) has made it possible to image atomic-scale dynamics on the femtosecond timescale. Accessing the femtosecond regime with UEM currently relies on the generation of photoelectrons with an ultrafast laser pulse and operation in a stroboscopic pump-probe fashion. With this approach, temporal resolution is limited mainly by the durations of the pump laser pulse and probe electron packet. The ability to accurately determine the duration of the electron packets, and thus the instrument response function, is critically important for interpretation of dynamics occurring near the temporal resolution limit, in addition to quantifying the effects of the imaging mode. Here, we describe a technique for in situ characterization of ultrashort electron packets that makes use of coupling with photons in the evanescent near-field of the specimen. We show that within the weakly-interacting (i.e., low laser fluence) regime, the zero-loss peak temporal cross-section is precisely the convolution of electron packet and photon pulse profiles. Beyond this regime, we outline the effects of non-linear processes and show that temporal cross-sections of high-order peaks explicitly reveal the electron packet profile, while use of the zero-loss peak becomes increasingly unreliable. Copyright © 2014 Elsevier B.V. All rights reserved.

  16. Unravelling the Mechanism of Resonant Two-Photon Photodetachment of the Vinylidene Anion, H_2C=C^-, Using Velocity-Map Photoelectron Imaging

    Science.gov (United States)

    Gerardi, H. K.; Breen, K. J.; Gardenier, G. H.; Guasco, T. L.; Laaser, J. E.; Weddle, G. H.; Johnson, M. A.

    2009-06-01

    Vinylidene, an isomer of acetylene and the simplest unsaturated carbene, has been studied extensively due to its role as a possible intermediate in a wide range of important chemical reactions. The neutral form of vinylidene is an extremely short-lived species and therefore information about its structure and potential energy surface may be gained through the study of its stable anionic form. Using velocity-map photoelectron imaging to investigate the behavior of the anion, we observe electron loss with excitation energies lower than the established electron adiabatic detachment energy (ADE). An in-depth analysis of the velocity-map images and corresponding photoelectron spectra taken at various energies within the C-H stretching region as well as at energies around the ADE provide plausible explanations for the observed behavior. The study also reveals interesting angular distributions specific to certain vibrational modes that are not trivial to understand at this point.

  17. Silicon nanocrystals with high boron and phosphorus concentration hydrophilic shell—Raman scattering and X-ray photoelectron spectroscopic studies

    Energy Technology Data Exchange (ETDEWEB)

    Fujii, Minoru, E-mail: fujii@eedept.kobe-u.ac.jp; Sugimoto, Hiroshi; Hasegawa, Masataka; Imakita, Kenji [Department of Electrical and Electronic Engineering, Graduate School of Engineering, Kobe University, Rokkodai, Nada, Kobe 657-8501 (Japan)

    2014-02-28

    Boron (B) and phosphorus (P) codoped silicon (Si) nanocrystals, which exhibit very wide range tunable luminescence due to the donor to acceptor transitions and can be dispersed in polar liquids without organic ligands, are studied by Raman scattering and X-ray photoelectron spectroscopies. Codoped Si nanocrystals exhibit a Raman spectrum significantly different from those of intrinsic ones. First, the Raman peak energy is almost insensitive to the size and is very close to that of bulk Si crystal in the diameter range of 2.7 to 14 nm. Second, the peak is much broader than that of intrinsic ones. Furthermore, an additional broad peak, the intensity of which is about 20% of the main peak, appears around 650 cm{sup −1}. The peak can be assigned to local vibrational modes of substitutional B and B-P pairs, B clusters, B-interstitial clusters, etc. in Si crystal. The Raman and X-ray photoelectron spectroscopic studies suggest that a crystalline shell heavily doped with these species is formed at the surface of a codoped Si nanocrystal and it induces the specific properties, i.e., hydrophilicity, high-stability in water, high resistance to hydrofluoric acid, etc.

  18. Imaging Molecular Structure through Femtosecond Photoelectron Diffraction on Aligned and Oriented Gas-Phase Molecules

    DEFF Research Database (Denmark)

    Boll, Rebecca; Rouzee, Arnaud; Adolph, Marcus

    2014-01-01

    This paper gives an account of our progress towards performing femtosecond time-resolved photoelectron diffraction on gas-phase molecules in a pump-probe setup combining optical lasers and an X-ray Free-Electron Laser. We present results of two experiments aimed at measuring photoelectron angular...

  19. Photoelectron spectra and electronic structures of some indigo dyes

    Science.gov (United States)

    Bauer, Helmut; Kowski, Klaus; Kuhn, Hubert; Lüttke, Wolfgang; Rademacher, Paul

    1998-04-01

    The He(I) photoelectron spectra of thioindigo ( 3), selenoindigo ( 4), bi(4,4-dimethyltetrahydropyrrole-3-one-2-ylidene) ( 5), bi(4,4-dimethyltetrahydrothiophene-3-one-2-ylidene) ( 6), octahydroindigo ( 8), 4,4'-dibutyl-5,5'-dimethylpyrrolindigo ( 9), and thiophenindigo ( 10) have been obtained by evaporating the compounds at temperatures up to about 350°C. The ionization potentials (IPs) are compared with those of the parent compound indigo ( 1) and are related to orbital energies or electronic states of the respective radical cations with the aid of semi-empirical SCF MO calculations. A satisfactory interpretation of the spectra is achieved with the Outer Valence Green's function method OVGF in combination with PM3 results. The first three IPs of all indigoid molecules in this study have the same origin, i.e. they relate to similar molecular orbitals. Because of the close relationship of the electronic structures of indigoid molecules, the IPs of the unknown unsubstituted pyrrolindigo ( 7) could be estimated.

  20. Photoelectron imaging following 2 + 1 multiphoton excitation of HBr.

    Science.gov (United States)

    Romanescu, Constantin; Loock, Hans-Peter

    2006-07-07

    The photodissociation and photoionization dynamics of HBr via low-n Rydberg and ion-pair states was studied by using 2 + 1 REMPI spectroscopy and velocity map imaging of photoelectrons. Two-photon excitation at about 9.4-10 eV was used to prepare rotationally selected excited states. Following absorption of the third photon the unperturbed F (1)Delta(2) and i (3)Delta(2) states ionize directly into the ground vibrational state of the molecular ion according to the Franck-Condon principle and upon preservation of the ion core. In case of the V (1)Sigma(+)(0(+)) ion-pair state and the perturbed E (1)Sigma(+)(0(+)), g (3)Sigma(-)(0(+)), and H (1)Sigma(+)(0(+)) Rydberg states the absorption of the third photon additionally results in a long vibrational progression of HBr(+) in the X (2)Pi state as well as formation of electronically excited atomic photofragments. The vibrational excitation of the molecular ion is explained by autoionization of repulsive superexcited states into the ground state of the molecular ion. In contrast to HCl, the perturbed Rydberg states of HBr show strong participation of the direct ionization process, with ionic core preservation.

  1. X-Ray Photoelectron Spectroscopic Characterization of Iron Oxide Nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Radu, T., E-mail: Teodora.Radu@itim-cj.ro [National Institute for Research and Development of Isotopic and Molecular Technologies, 67-103 Donat Street, 400293, Cluj Napoca (Romania); Iacovita, C. [Department of Pharmaceutical Physics-Biophysics, Faculty of Pharmacy, “Iuliu Hatieganu” University of Medicine and Pharmacy, 400349, Cluj-Napoca (Romania); Benea, D. [Faculty of Physics, Babes Bolyai University, 400271, Cluj-Napoca (Romania); Turcu, R. [National Institute for Research and Development of Isotopic and Molecular Technologies, 67-103 Donat Street, 400293, Cluj Napoca (Romania)

    2017-05-31

    Highlights: • Characterization of three types of iron oxides magnetic nanoparticles. • A correlation between valence band XPS and the degree of iron oxidation is proposed. • Theoretical contributions of Fe in tetragonal and octahedral environment are shown. - Abstract: We report X-ray photoelectron spectroscopy (XPS) results on iron oxide magnetic nanoparticle (Fe{sub 3}O{sub 4}) synthesized using solvothermal reduction in the presence of polyethylene glycol. The magnetite obtained was employed as precursor for the synthesis of γ-Fe{sub 2}O{sub 3} (by oxygen dissociation) which in turn was transformed into α-Fe{sub 2}O{sub 3}. We confirmed the magnetite, maghemite and hematite structure by Fourier Transformed Spectroscopy (FTIR) and X-ray diffraction (XRD). The analysis of the XPS core level and valence band (VB) photoemission spectra for all investigated samples is discussed in terms of the degree of iron oxidation. This is of fundamental importance to better understand the electronic structure of the obtained iron oxide nanoparticles in order to control and improve their quality for specific biomedical applications. Moreover, theoretical band structure calculations are performed for magnetite and the separate contributions of Fe in tetragonal and octahedral environment are shown.

  2. Probing electronic binding potentials with attosecond photoelectron wavepackets

    Science.gov (United States)

    Kiesewetter, D.; Jones, R. R.; Camper, A.; Schoun, S. B.; Agostini, P.; Dimauro, L. F.

    2018-01-01

    The central goal of attosecond science is to visualize, understand and ultimately control electron dynamics in matter over the fastest relevant timescales. To date, numerous schemes have demonstrated exquisite temporal resolution, on the order of ten attoseconds, in measurements of the response of photo-excited electrons to time-delayed probes. However, attributing this response to specific dynamical mechanisms is difficult, requiring guidance from advanced calculations. Here we show that energy transfer between an oscillating field and low-energy attosecond photoelectron wavepackets directly provides coarse-grained information on the effective binding potential from which the electrons are liberated. We employ a dense extreme ultraviolet (XUV) harmonic comb to photoionize He, Ne and Ar atoms and record the electron spectra as a function of the phase of a mid-infrared dressing field. The amplitude and phase of the resulting interference modulations in the electron spectra reveal the average momentum and change in momentum of the electron wavepackets during the first quarter-period of the dressing field after their creation, reflecting the corresponding coarse characteristics of the binding potential.

  3. Failure Modes

    DEFF Research Database (Denmark)

    Jakobsen, K. P.; Burcharth, H. F.; Ibsen, Lars Bo

    1999-01-01

    The present appendix contains the derivation of ten different limit state equations divided on three different failure modes. Five of the limit state equations can be used independently of the characteristics of the subsoil, whereas the remaining five can be used for either drained or undrained s...

  4. Coincident photoelectron spectroscopy on superconductors; Koinzidente Photoelektronenspektroskopie an Supraleitern

    Energy Technology Data Exchange (ETDEWEB)

    Voss, Stefan

    2011-07-01

    Aim of the performed experiments of this thesis was to attempt to detect Cooper pairs as carriers of the superconducting current directly by means of the photoelectric effect. The method of the coincident photoelectron spectroscopy aims thereby at the detection of two coherently emitted electrons by the interaction with a photon. Because electrostatic analyzers typically cover only a very small spatial angle, which goes along with very low coincidence rates, in connection with this thesis a time-of-flight projection system has been developed, which maps nearly the whole spatial angle on a position-resolving detector. The pulsed light source in form of special synchrotron radiation necessary for the measurement has been adjusted so weak, that only single photons could arrive at the sample. Spectroscoped were beside test measurements on silver layers both a lead monocrystal as representative of the classical BCS superconductors and monocrystalline Bi{sub 2}Sr{sub 2}CaCu{sub 2}O{sub 8} from the family of the high-temperature superconductors. With excitation energies up to 40 eV could be shown that sufficiently smooth and clean surfaces in the superconducting phase exhibit within the resolving power of about 0.5 eV no recognizable differences in comparison to the normally conducting phase. Beside these studies furthermore the simple photoemission at the different samples and especially in the case of the lead crystal is treated, because here no comparable results are known. Thereby the whole momentum space is discussed and the Fermi surface established as three-dimensional model, by means of which the measurement results are discussed. in the theoretical descriptions different models for the Cooper-pair production are presented, whereby to the momentum exchange with the crystal a special role is attributed, because this can only occur in direct excitations via discrete lattice vectors.

  5. Assignment of benzodiazepine UV absorption spectra by the use of photoelectron spectroscopy

    Science.gov (United States)

    Khvostenko, O. G.; Tzeplin, E. E.; Lomakin, G. S.

    2002-04-01

    Correlations between singlet transition energies and energy gaps of corresponding pairs of occupied and unoccupied molecular orbitals were revealed in a series of benzodiazepines. The occupied orbital energies were taken from the photoelectron spectra of the compound investigated, the unoccupied ones were obtained from MNDO/d calculations, and the singlet energies were taken from the UV absorption spectra. The correspondence of the singlet transitions to certain molecular orbitals was established using MNDO/d calculations and comparing between UV and photoelectron spectra. It has been concluded that photoelectron spectroscopy can be applied for interpretation of UV absorption spectra of various compounds on the basis of similar correlations.

  6. Hydrogen plasma induced photoelectron emission from low work function cesium covered metal surfaces

    Science.gov (United States)

    Laulainen, J.; Aleiferis, S.; Kalvas, T.; Koivisto, H.; Kronholm, R.; Tarvainen, O.

    2017-10-01

    Experimental results of hydrogen plasma induced photoelectron emission from cesium covered metal surfaces under ion source relevant conditions are reported. The transient photoelectron current during the Cs deposition process is measured from Mo, Al, Cu, Ta, Y, Ni, and stainless steel (SAE 304) surfaces. The photoelectron emission is 2-3.5 times higher at optimal Cs layer thickness in comparison to the clean substrate material. Emission from the thick layer of Cs is found to be 60%-80% lower than the emission from clean substrates.

  7. Observation of promoted C-O bond weakening on the heterometallic nickel-silver: Photoelectron velocity-map imaging spectroscopy of AgNi(CO)n-

    Science.gov (United States)

    Liu, Zhiling; Xie, Hua; Zou, Jinghan; Fan, Hongjun; Tang, Zichao

    2017-06-01

    We report a joint experimental and theoretical study on heterodinuclear silver-nickel carbonyl clusters: AgNi(CO)n- and AgNi(CO)n (n = 2, 3). The photoelectron spectra and photoelectron angular distribution provide information on the electronic structures and geometries of these complexes. Electron affinities of AgNi(CO)2 and AgNi(CO)3 are measured from the photoelectron velocity-map imaging spectra to be 2.29 ± 0.03 and 2.32 ± 0.03 eV, respectively. The complementary theoretical calculations at the B3LYP level and Franck-Condon simulations are performed to establish their geometrical structures. The C-O stretching modes are activated upon photodetachment and determined to be 2024 and 2028 cm-1 for AgNi(CO)2 and AgNi(CO)3, respectively, which are notably red-shifted with respect to those of corresponding unsaturated binary nickel carbonyls. These findings will shed light on the promoted C-O bond weakening by the introduction of a foreign atom to binary unsaturated TM carbonyl complexes.

  8. Evaluation of Photoelectron Therapy Effect on Hepatocellular Carcinoma

    Directory of Open Access Journals (Sweden)

    bahram Mofid

    2007-10-01

    Full Text Available Mofid B1, Navabpoor M2, Alizadeh Azimi M3 1. Assistant professor, Department of Radiotherapy, Faculty of Para-Medicine, Shahid Beheshti University of medical sciences 2. Instructor, Department of Technology of radiology, Faculty of Para-Medicine, Shahid Beheshti University of medical sciences Abstract Background: Photoelectron therapy method has been usad successfully, on the body phantom, cancer cells culture and animals. In this method, drugs containing x-Ray opaque factors–with high atomic numbers–are injected into the patient’s vein. After appropriate drug accumulation, about at least ten percent of the total injected amounts, 200kev. up to 300kev. of localized x-Ray beams is radiated to the site of the tumor. The Ethic Committee of Shahid Beheshti University of Medical Education and Health Services authorized the implementation of this new cancer treatment method, initially only on the group of patients who suffered from hepato-cellular carcinoma. Hepato cellular carcinoma is one of the most current malignancies of liver. In some cases, in addition to surgery, several approaches exist to come near the aim of predominating hepato-cellular carcinoma such as chemotherapy, current Radiation Therapy, Radio-Frequency application (RF, Trans-Artepical Chemo Embolization, (TACE, and Percutaneous Ethanol Injection (PEI. The effectiveness of the above-mentioned methods is about 10%-47%, applied alone or along side each other. Materials and methods: This study was a clinical-trial one. In this study, first, lipiodol (an x-ray opaque material with a high atomic number was transferred into the main vessel terminating to the tumor by angio-catheterization. Then,200kev. up to 250kev. of localized x-ray was radiated to the site of the tumor in one session. The drug volume was proportionally selected to the volume of the tumor, and the irradiation intensity was between 400 to 600cent.Gy. the beam energy absorption capacity of this drug is as times as

  9. Photoelectron spectroscopy on doped organic semiconductors and related interfaces

    Energy Technology Data Exchange (ETDEWEB)

    Olthof, Selina Sandra

    2010-06-08

    Using photoelectron spectroscopy, we show measurements of energy level alignment of organic semiconducting layers. The main focus is on the properties and the influence of doped layers. The investigations on the p-doping process in organic semiconductors show typical charge carrier concentrations up to 2.10{sup 20} cm{sup -3}. By a variation of the doping concentration, an over proportional influence on the position of the Fermi energy is observed. Comparing the number of charge carriers with the amount of dopants present in the layer, it is found that only 5% of the dopants undergo a full charge transfer. Furthermore, a detailed investigation of the density of states beyond the HOMO onset reveals that an exponentially decaying density of states reaches further into the band gap than commonly assumed. For an increasing amount of doping, the Fermi energy gets pinned on these states which suggests that a significant amount of charge carriers is present there. The investigation of metal top and bottom contacts aims at understanding the asymmetric current-voltage characteristics found for some symmetrically built device stacks. It can be shown that a reaction between the atoms from the top contact with the molecules of the layer leads to a change in energy level alignment that produces a 1.16 eV lower electron injection barrier from the top. Further detailed investigations on such contacts show that the formation of a silver top contact is dominated by diffusion processes, leading to a broadened interface. However, upon insertion of a thin aluminum interlayer this diffusion can be stopped and an abrupt interface is achieved. Furthermore, in the case of a thick silver top contact, a monolayer of molecules is found to oat on top of the metal layer, almost independent on the metal layer thickness. Finally, several device stacks are investigated, regarding interface dipoles, formation of depletion regions, energy alignment in mixed layers, and the influence of the built

  10. Identifying backward-rescattering photoelectron hologram with orthogonal two-color laser fields.

    Science.gov (United States)

    Li, Yang; Zhou, Yueming; He, Mingrui; Li, Min; Lu, Peixiang

    2016-10-17

    Backscattering photoelectron hologram (BPH) originating from direct and backward-rescattering electrons encodes important structural information and ultrafast dynamics of the underlying processes. However, the BPH is usually overshadowed by other interference structures in the photoelectrons momentum spectra, preventing a direct extraction of information using BPH. Here we theoretically demonstrate disentanglement of the BPH from other types of interference with the orthogonal two-color field, where a weak orthogonal component is used to streak the BPH. By carefully adjusting the relative phase of the two-color field, the BPH is effectively separated from other interferences in the photoelectron momentum spectra and thus the BPH is unambiguously identified. This takes a significant step to time-resolved imaging of the attosecond dynamics with strong-field photoelectron holography.

  11. Photoelectron angular distributions from photodetachment of negative ions in strong laser fields

    Energy Technology Data Exchange (ETDEWEB)

    Bai Lihua; Liu Yuheng; Cui Tingting; Wang Yan; Zhang Huifang; Deng Dongmei [Department of Physics, Shanghai University, Shanghai 200444 (China); Ren Xianghe, E-mail: lhbai@163.com [Institute of Advance Energy, Kyoto University, Gokasho, Uji, Kyoto, 611-0011 (Japan)

    2011-02-01

    Using a nonperturbative scattering theory, the photoelectron angular distributions (PADs) of negative ions irradiated by intense laser fields are studied. Various PADs are obtained. Similar to that of atoms, PADs of negative ions show main lobes and jet-like structures. Here, the main lobe means the formation of the detached photoelectrons around the direction of laser polarization, while the jet-like structure means a peaked-out formation of photoelectrons emitted from the waist between the two main lobes. For a set of above-threshold-detachment peaks, with one-more-photon absorption, the number of the jet-like structures is not always increased by one, which verifies that the jet-like structures are irrelevant to photoelectron angular momentum.

  12. Single photoelectron trapping, storage, and detection in a one-electron quantum dot

    Science.gov (United States)

    Rao, Deepak Sethu; Szkopek, Thomas; Robinson, Hans Daniel; Yablonovitch, Eli; Jiang, Hong-Wen

    2005-12-01

    There has been considerable progress in electrostatically emptying, and refilling, quantum dots with individual electrons. Typically the quantum dot is defined by electrostatic gates on a GaAs /AlyGa1-yAs modulation-doped heterostructure. We report the filling of such a quantum dot by a single photoelectron, originating from an individual photon. The electrostatic dot can be emptied and reset in a controlled fashion before the arrival of each photon. The trapped photoelectron is detected by a point contact transistor integrated adjacent to the electrostatic potential trap. Each stored photoelectron causes a persistent negative step in the transistor channel current. Such a controllable, benign, single photoelectron detector could allow for information transfer between flying photon qubits and stored electron qubits.

  13. Photoelectron and ICD electron angular distributions from fixed-in-space neon dimers

    Energy Technology Data Exchange (ETDEWEB)

    Jahnke, T [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Czasch, A [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Schoeffler, M [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Schoessler, S [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Kaesz, M [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Titze, J [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Kreidi, K [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Grisenti, R E [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Staudte, A [Steacie Institute for Molecular Sciences, 100 Sussex Drive, Ottawa (Canada); Jagutzki, O [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Schmidt, L Ph H [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Semenov, S K [State University of Aerospace Instrumentation, 190000 St. Petersburg (Russian Federation); Cherepkov, N A [State University of Aerospace Instrumentation, 190000 St. Petersburg (Russian Federation); Schmidt-Boecking, H [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany); Doerner, R [Institut fuer Kernphysik, J W Goethe-Universitaet Frankfurt am Main, Max-von-Laue-Str. 1, D-60438 Frankfurt (Germany)

    2007-07-07

    We report on molecular frame angular distributions of 2s photoelectrons and electrons emitted by interatomic Coulombic decay from neon dimers. We found that the measured angular distribution of the photoelectron strongly depends on the environment of the cluster. The experimental results are in excellent agreement with frozen core Hartree-Fock calculations. The ICD electrons show slight variations in their angular distribution for different kinetic energies.

  14. Time-resolved photoelectron spectroscopy and ab initio multiple spawning studies of hexamethylcyclopentadiene

    DEFF Research Database (Denmark)

    Wolf, T. J. A.; Kuhlman, Thomas Scheby; Schalk, O.

    2014-01-01

    Time-resolved photoelectron spectroscopy and ab initio multiple spawning were applied to the ultrafast non-adiabatic dynamics of hexamethylcyclopentadiene. The high level of agreement between experiment and theory associates wavepacket motion with a distinct degree of freedom.......Time-resolved photoelectron spectroscopy and ab initio multiple spawning were applied to the ultrafast non-adiabatic dynamics of hexamethylcyclopentadiene. The high level of agreement between experiment and theory associates wavepacket motion with a distinct degree of freedom....

  15. X-ray Photoelectron Spectroscopic and Raman microscopic investigation of the variscite group minerals: Variscite, strengite, scorodite and mansfieldite.

    Science.gov (United States)

    Kloprogge, J Theo; Wood, Barry J

    2017-10-05

    Several structurally related AsO4 and PO4 minerals, were studied with Raman microscopy and X-ray Photoelectron Spectroscopy (XPS). XPS revealed only Fe, As and O for scorodite. The Fe 2p, As 3d, and O 1s indicated one position for Fe(2+), while 2 different environments for O and As were observed. The O 1s at 530.3eV and the As 3d 5/2 at 43.7eV belonged to AsO4, while minor bands for O 1s at 531.3eV and As 3d 5/2 at 44.8eV were due to AsO4 groups exposed on the surface possibly forming OH-groups. Mansfieldite showed, besides Al, As and O, a trace of Co. The PO4 equivalent of mansfieldite is variscite. The change in crystal structure replacing As with P resulted in an increase in the binding energy (BE) of the Al 2p by 2.9eV. The substitution of Fe(3+) for Al(3+) in the structure of strengite resulted in a Fe 2p at 710.8eV. An increase in the Fe 2p BE of 4.8eV was found between mansfieldite and strengite. The scorodite Raman OH-stretching region showed a sharp band at 3513cm(-1) and a broad band around 3082cm(-1). The spectrum of mansfieldite was like that of scorodite with a sharp band at 3536cm(-1) and broader maxima at 3100cm(-1) and 2888cm(-1). Substituting Al in the arsenate structure instead of Fe resulted in a shift of the metal-OH-stretching mode by 23cm(-1) towards higher wavenumbers due to a slightly longer H-bonding in mansfieldite compared to scorodite. The intense band for scorodite at 805cm(-1) was ascribed to the symmetric stretching mode of the AsO4. The medium intensity bands at 890, 869, and 830cm(-1) were ascribed to the internal modes. A significant shift towards higher wavenumbers was observed for mansfieldite. The strengite Raman spectrum in the 900-1150cm(-1) shows a strong band at 981cm(-1) accompanied by a series of less intense bands. The 981cm(-1) band was assigned to the PO4 symmetric stretching mode, while the weak band at 1116cm(-1) was the corresponding antisymmetric stretching mode. The remaining bands at 1009, 1023 and 1035cm(-1) were

  16. X-ray Photoelectron Spectroscopic and Raman microscopic investigation of the variscite group minerals: Variscite, strengite, scorodite and mansfieldite

    Science.gov (United States)

    Kloprogge, J. Theo; Wood, Barry J.

    2017-10-01

    Several structurally related AsO4 and PO4 minerals, were studied with Raman microscopy and X-ray Photoelectron Spectroscopy (XPS). XPS revealed only Fe, As and O for scorodite. The Fe 2p, As 3d, and O 1s indicated one position for Fe2 +, while 2 different environments for O and As were observed. The O 1s at 530.3 eV and the As 3d 5/2 at 43.7 eV belonged to AsO4, while minor bands for O 1s at 531.3 eV and As 3d 5/2 at 44.8 eV were due to AsO4 groups exposed on the surface possibly forming OH-groups. Mansfieldite showed, besides Al, As and O, a trace of Co. The PO4 equivalent of mansfieldite is variscite. The change in crystal structure replacing As with P resulted in an increase in the binding energy (BE) of the Al 2p by 2.9 eV. The substitution of Fe3 + for Al3 + in the structure of strengite resulted in a Fe 2p at 710.8 eV. An increase in the Fe 2p BE of 4.8 eV was found between mansfieldite and strengite. The scorodite Raman OH-stretching region showed a sharp band at 3513 cm- 1 and a broad band around 3082 cm- 1. The spectrum of mansfieldite was like that of scorodite with a sharp band at 3536 cm- 1 and broader maxima at 3100 cm- 1 and 2888 cm- 1. Substituting Al in the arsenate structure instead of Fe resulted in a shift of the metal-OH-stretching mode by 23 cm- 1 towards higher wavenumbers due to a slightly longer H-bonding in mansfieldite compared to scorodite. The intense band for scorodite at 805 cm- 1 was ascribed to the symmetric stretching mode of the AsO4. The medium intensity bands at 890, 869, and 830 cm- 1 were ascribed to the internal modes. A significant shift towards higher wavenumbers was observed for mansfieldite. The strengite Raman spectrum in the 900-1150 cm- 1 shows a strong band at 981 cm- 1 accompanied by a series of less intense bands. The 981 cm- 1 band was assigned to the PO4 symmetric stretching mode, while the weak band at 1116 cm- 1 was the corresponding antisymmetric stretching mode. The remaining bands at 1009, 1023 and 1035 cm- 1

  17. Ultrafast dynamics in helium nanodroplets probed by femtosecond time-resolved EUV photoelectron imaging

    Energy Technology Data Exchange (ETDEWEB)

    Kornilov, Oleg; Wang, Chia C.; Buenermann, Oliver; Healy, Andrew T.; Leonard, Mathew; Peng, Chunte; Leone, Stephen R.; Neumark, Daniel M.; Gessner, Oliver

    2010-07-09

    The dynamics of electronically excited helium nanodroplets are studied by femtosecond time-resolved photoelectron imaging. EUV excitation into a broad absorption band centered around 23.8 eV leads to an indirect photoemission process that generates ultraslow photoelectrons. A 1.58 eV probe pulse transiently depletes the indirect photoemission signal for pump-probe time delays <200 fs and enhances the signal beyond this delay. The depletion is due to suppression of the indirect ionization process by the probe photon, which generates a broad, isotropically emitted photoelectron band. Similar time scales in the decay of the high energy photoelectron signal and the enhancement of the indirect photoemission signal suggest an internal relaxation process that populates states in the range of a lower energy droplet absorption band located just below the droplet ionization potential (IP {approx} 23.0 eV). A nearly 70% enhancement of the ultraslow photoelectron signal indicates that interband relaxation plays a more dominant role for the droplet de-excitation mechanism than photoemission.

  18. Modelling Photoelectron Production in the Enceladus Plume and Comparison with Observations by CAPS-ELS

    Science.gov (United States)

    Taylor, S. A.; Coates, A. J.; Jones, G.; Wellbrock, A.; Waite, J. H., Jr.

    2016-12-01

    The Electron Spectrometer (ELS) of the Cassini Plasma Spectrometer (CAPS) measures electrons in the energy range 0.6-28,000 eV with an energy resolution of 16.7%. ELS has observed photoelectrons produced in the plume of Enceladus. These photoelectrons are found during Enceladus encounters in the energetic particle shadow where the spacecraft is shielded from penetrating radiation by the moon [Coates et al, 2013]. Observable is a population of photoelectrons at 20-30eV, which are seen at other bodies in the solar system and are usually associated with ionisation by the strong solar He II (30.4 nm) line. We have identified secondary peaks at 40-50eV detected by ELS which are also interpreted as a warmer population of photoelectrons created through the ionisation of neutrals in the Enceladus torus. We have constructed a model of photoelectron production in the plume and compared it with ELS Enceladus flyby data using automated fitting procedures. This has yielded estimates for electron temperature and density as well as a spacecraft potential estimate which is corrected for.

  19. Adiabatic theory of strong-field photoelectron momentum distributions near a backward rescattering caustic

    Science.gov (United States)

    Morishita, Toru; Tolstikhin, Oleg I.

    2017-11-01

    We present a comprehensive treatise on the derivation of the factorization formula describing strong-field photoelectron momentum distributions near the outermost backward rescattering caustic within the adiabatic theory and its validation by calculations. The formula derived holds for ionization by linearly polarized laser pulses of sufficiently low frequency and becomes exact as the frequency tends to zero for a fixed pulse amplitude. The convergence of the results obtained from the formula to accurate photoelectron momentum distributions obtained by solving the time-dependent Schrödinger equation is demonstrated. The formula is shown to work quantitatively in both tunneling and over-the-barrier regimes of ionization for finite-range potentials as well as potentials with a Coulomb tail. This paves the way for future applications of the present theory in strong-field physics. In particular, the explicit analytical form of the returning photoelectron wave packet given here enables one to extract differential cross sections for elastic scattering of a photoelectron on the parent ion from experimental photoelectron momentum distributions.

  20. A quantum-classical simulation of a multi-surface multi-mode ...

    Indian Academy of Sciences (India)

    We have performed a nuclear dynamics simulation to calculate photoelectron spectra and population profiles of benzene radical cation (C6H 6 + ) employing the parallelized Time Dependent Discrete Variable Representation (TDDVR) approach. For this purpose, we have considered two multi-state multi-mode model ...

  1. Femtosecond photoelectron spectroscopy: a new tool for the study of anion dynamics

    Energy Technology Data Exchange (ETDEWEB)

    Greenblatt, Benjamin J. [Univ. of California, Berkeley, CA (United States)

    1999-02-01

    A new experimental technique for the time-resolved study of anion reactions is presented. Using femtosecond laser pulses, which provide extremely fast (~100 fs) time resolution, in conjunction with photoelectron spectroscopy, which reveals differences between anion and neutral potential energy surfaces, a complex anion reaction can be followed from its inception through the formation of asymptotic products. Experimental data can be modeled quantitatively using established theoretical approaches, allowing for the refinement of potential energy surfaces as well as dynamical models. After a brief overview, a detailed account of the construction of the experimental apparatus is presented. Documentation of the data acquisition program is contained in the Appendix. The first experimental demonstration of the technique is then presented for I2- photodissociation, modeled using a simulation program which is also detailed in the Appendix. The investigation of I2- photodissociation in several size-selected I2-(Ar)n (n = 6-20) and I2-(CO2)n (n = 4-16) clusters forms the heart of the dissertation. In a series of chapters, the numerous effects of solvation on this fundamental bond-breaking reaction are explored, the most notable of which is the recombination of I2- on the ground $\\tilde{X}$(2Σu+) state in sufficiently large clusters. Recombination and trapping of I2- on the excited $\\tilde{A}$(2π3/2,g) state is also observed in both types of clusters. The studies have revealed electronic state transitions, the first step in recombination, on a ~500 fs to ~10 ps timescale. Accompanying the changes in electronic state is solvent reorganization, which occurs on a similar timescale. Over longer periods (~1 ps to >200 ps), energy is transferred from vibrationally

  2. Photoelectron and photodissociation studies of free atoms and molecules, using synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Medhurst, L.J.

    1991-11-01

    High resolution synchrotron radiation and Zero-Kinetic-Energy Photoelectron spectroscopy were used to study two-electron transitions in atomic systems at their ionization thresholds. Using this same technique the core-ionized mainline and satellite states of N{sub 2} and CO were studied with vibrational resolution. Vibrationally resolved synchrotron radiation was used to study the dissociation of N{sub 2}, C{sub 2}H{sub 4}, and CH{sub 3}Cl near the N 1s and C 1s thresholds. The photoelectron satellites of the argon 3s, krypton 4s and xenon 4d subshells were studied with zero kinetic energy photoelectron spectroscopy at their ionization thresholds. In all of these cases, satellites with lower binding energies are enhanced at their thresholds while those closer to the double ionization threshold are suppressed relative to their intensities at high incident light energies.

  3. Photoelectron and photodissociation studies of free atoms and molecules, using synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Medhurst, Laura Jane [Univ. of California, Berkeley, CA (United States)

    1991-11-01

    High resolution synchrotron radiation and Zero-Kinetic-Energy Photoelectron spectroscopy were used to study two-electron transitions in atomic systems at their ionization thresholds. Using this same technique the core-ionized mainline and satellite states of N2 and CO were studied with vibrational resolution. Vibrationally resolved synchrotron radiation was used to study the dissociation of N2, C2H4, and CH3Cl near the N 1s and C 1s thresholds. The photoelectron satellites of the argon 3s, krypton 4s and xenon 4d subshells were studied with zero kinetic energy photoelectron spectroscopy at their ionization thresholds. In all of these cases, satellites with lower binding energies are enhanced at their thresholds while those closer to the double ionization threshold are suppressed relative to their intensities at high incident light energies.

  4. Molecular photoionisation using synchrotron radiation. Photoelectron photoion coincidence and circular dichroism

    CERN Document Server

    Garcia-Macias, G A

    2002-01-01

    The first ionisation potential of the CF sub 3 radical has been determined in this work from the appearance potential of the CF sub 3 sup + fragment, formed in the photofragmentation of CF sub 3 Br. In obtaining this value special care has been taken in removing the contributions from second order light and internal energy of the fragmenting parent ion. The resulting ionisation potential was found to be in very good agreement with a number of recent theoretical calculations. The valence photoelectron spectra of three monoterpenes such as limonene, carvone and camphor have been recorded along with their mass spectra taken in coincidence with energy selected photoelectrons, providing information about state selected parent ion fragmentation channels. A new photoelectron spectrometer based on the Alien box design has been studied by ray-tracing simulations. It will include a two dimensional position sensitive detector system consisting in two micro channel plates in a chevron stack and a delay-line anode to enco...

  5. Unraveling nonadiabatic ionization and Coulomb potential effects in strong-field photoelectron holography

    CERN Document Server

    Song, Xiaohong; Sheng, Zhihao; Liu, Peng; Chen, Zhangjin; Yang, Weifeng; Hu, Shilin; Lin, C D; Chen, Jing

    2016-01-01

    Strong field photoelectron holography has been proposed as a means for interrogating the spatial and temporal information of electrons and ions in a dynamic system. After ionization, part of the electron wave packet may directly go to the detector (the reference wave), while another part may be driven back to the ion where it scatters off (the signal wave). The interference hologram of the two waves may be used to retrieve the target information. However, unlike conventional optical holography, the propagations of electron wave packets are affected by the Coulomb potential as well as by the laser field. In addition, electrons are emitted over the whole laser pulse duration, thus multiple interferences may occur. In this work, we used a generalized quantum-trajectory Monte Carlo method to investigate the effect of Coulomb potential and the nonadiabatic subcycle ionization on the photoelectron hologram. We showed that photoelectron hologram can be well described only when the nonadiabatic effect in ionization i...

  6. Visible sub-band gap photoelectron emission from nitrogen doped and undoped polycrystalline diamond films

    Energy Technology Data Exchange (ETDEWEB)

    Elfimchev, S., E-mail: sergeyel@tx.technion.ac.il; Chandran, M.; Akhvlediani, R.; Hoffman, A.

    2017-07-15

    Highlights: • Nitrogen related centers in diamond film are mainly responsible for visible sub-band-gap photoelectron emission. • The influence of film thickness and substrate on the measured photoelectron emission yields was not found. • Nanocrystalline diamonds have low electron emission yields most likely because of high amount of defects. • Visible sub-band gap photoelectron emission may increase with temperature due to electron trapping/detrapping processes. - Abstract: In this study the origin of visible sub-band gap photoelectron emission (PEE) from polycrystalline diamond films is investigated. The PEE yields as a function of temperature were studied in the wavelengths range of 360–520 nm. Based on the comparison of electron emission yields from diamond films deposited on silicon and molybdenum substrates, with different thicknesses and nitrogen doping levels, we suggested that photoelectrons are generated from nitrogen related centers in diamond. Our results show that diamond film thickness and substrate material have no significant influence on the PEE yield. We found that nanocrystalline diamond films have low electron emission yields, compared to microcrystalline diamond, due to the presence of high amount of defects in the former, which trap excited electrons before escaping into the vacuum. However, the low PEE yield of nanocrystalline diamond films was found to increase with temperature. The phenomenon was explained by the trap assisted photon enhanced thermionic emission (ta-PETE) model. According to the ta-PETE model, photoelectrons are trapped by shallow traps, followed by thermal excitation at elevated temperatures and escape into the vacuum. Activation energies of trap levels were estimated for undoped nanocrystalline, undoped microcrystalline and N-doped diamond films using the Richardson-Dushman equation, which gives 0.13, 0.39 and 0.04 eV, respectively. Such low activation energy of trap levels makes the ta-PETE process very

  7. Photoelectron angular distributions from rotationally resolved autoionizing states of N2

    Science.gov (United States)

    Chartrand, A. M.; McCormack, E. F.; Jacovella, U.; Holland, D. M. P.; Gans, B.; Tang, Xiaofeng; Garcia, G. A.; Nahon, L.; Pratt, S. T.

    2017-12-01

    The single-photon, photoelectron-photoion coincidence spectrum of N2 has been recorded at high (˜1.5 cm-1) resolution in the region between the N2 + X Σ2g+, v+ = 0 and 1 ionization thresholds by using a double-imaging spectrometer and intense vacuum-ultraviolet light from the Synchrotron SOLEIL. This approach provides the relative photoionization cross section, the photoelectron energy distribution, and the photoelectron angular distribution as a function of photon energy. The region of interest contains autoionizing valence states, vibrationally autoionizing Rydberg states converging to vibrationally excited levels of the N2 + X Σ2g+ ground state, and electronically autoionizing states converging to the N2 +A 2Π and B 2Σu+ states. The wavelength resolution is sufficient to resolve rotational structure in the autoionizing states, but the electron energy resolution is insufficient to resolve rotational structure in the photoion spectrum. A simplified approach based on multichannel quantum defect theory is used to predict the photoelectron angular distribution parameters, β, and the results are in reasonably good agreement with experiment.

  8. Resonance enhanced multiphoton ionisation (REMPI) and REMPI-photoelectron spectroscopy of carbonyl sulphide and carbon disulphide

    NARCIS (Netherlands)

    Morgan, R.A.; Buma, W.J.; Baldwin, M.A.; Ascenzi, D.; Orr-Ewing, A.J.; Ashfold, M.N.R.; de Milan, J.B.; Scheper, C.R.; de Lange, C.A.

    1996-01-01

    The results of recent mass-resolved resonance enhanced multiphoton ionisation (REMPI) and REMPI-photoelectron spectroscopy (PES) studies of the sixteen valence electron molecules OCS and CS2 are used to illustrate some of the many opportunities offered by (and a few of the possible limitations

  9. Near surface composition of some alloys by X-ray photoelectron ...

    Indian Academy of Sciences (India)

    0.70Ni0.30) and BiSb (Bi0.80Sb0.20, Bi0.64Sb0.34, Bi0.55Sb0.45) are determined by X-ray photoelectron spectroscopy. The stoichiometries are determined and are compared with the bulk compositions. Possible sources of systematic errors ...

  10. Near surface composition of some alloys by X-ray photoelectron ...

    Indian Academy of Sciences (India)

    are determined by X-ray photoelectron spec- troscopy. The stoichiometries are determined and are compared with the bulk compositions. Possible sources of systematic errors contributing to the results are discussed. Errors arising out of preferen- tial etching in these alloys have been investigated. It has been inferred from ...

  11. A coupled bunch instability due to beam-photoelectron interactions in KEKB-LER

    Energy Technology Data Exchange (ETDEWEB)

    Ohmi, Kazuhito [National Lab. for High Energy Physics, Tsukuba, Ibaraki (Japan)

    1996-08-01

    LER of KEKB is designed to storage the positron beam of 2.6 A with multibunch operation. Nb = 3.3 x 10{sup 10} positrons are filled in a bunch and the bunch passes every 2ns through a beam chamber. The photoelectron instability may be serious for KEKB-LER. We consider a motion of photoelectrons produced by a bunch with a computer simulation technic. A cylindrical chamber with a diameter of 10 cm was used as a model chamber. About 15 times of the photoelectrons were produced by a bunch. The wake force was calculated for the loading bunches with displacements of 0.5 mm and 1 mm. The wake characteristics seems to be caused by the trapped electrons kicked by the loading bunch. The wake was saturated with the loading displacement of 0.5 mm. We obtained a growth rate by the wake force. It is very high rate, 2500s{sup -1} which exceeds damping rates of various mechanism, radiation, head-tail and feedback. Perhaps it is essential to remove the photoelectrons around the positron beam explicitly. If we apply magnetic field fo about 20 G, the growth rate will be reduced. (S.Y.)

  12. Pb 4f photoelectron spectroscopy on mass-selected anionic lead clusters at FLASH

    Science.gov (United States)

    Bahn, J.; Oelßner, P.; Köther, M.; Braun, C.; Senz, V.; Palutke, S.; Martins, M.; Rühl, E.; Ganteför, G.; Möller, T.; von Issendorff, B.; Bauer, D.; Tiggesbäumker, J.; Meiwes-Broer, K.-H.

    2012-07-01

    4f core level photoelectron spectroscopy has been performed on negatively charged lead clusters, in the size range of 10-90 atoms. We deploy 4.7 nm radiation from the free-electron laser FLASH, yielding sufficiently high photon flux to investigate mass-selected systems in a beam. A new photoelectron detection system based on a hemispherical spectrometer and a time-resolving delayline detector makes it possible to assign electron signals to each micro-pulse of FLASH. The resulting 4f binding energies show good agreement with the metallic sphere model, giving evidence for a fast screening of the 4f core holes. By comparing the present work with previous 5d and valence region data, the paper presents a comprehensive overview of the energetics of lead clusters, from atoms to bulk. Special care is taken to discuss the differences of the valence- and core-level anion cluster photoionizations. Whereas in the valence case the escaping photoelectron interacts with a neutral system near its ground state, core-level ionization leads to transiently highly excited neutral clusters. Thus, the photoelectron signal might carry information on the relaxation dynamics.

  13. Multidimensional electron-nuclear wavepacket dynamics via Time-, Energy- and Angle-resolved Photoelectron Spectroscopy

    Science.gov (United States)

    Veyrinas, K.; Makhija, V.; Boguslavskiy, A. E.; Forbes, R.; Wilkinson, I.; Moffatt, D.; Lausten, R.; Stolow, A.

    2017-04-01

    Generating and probing a coherent superposition of coupled vibrational-electronic (vibronic) states - a multidimensional wavepacket - remains a challenging problem in molecular dynamics. Here, we present recent results using time-resolved photoelectron velocity map imaging (VMI) of complex vibronic wavepacket dynamics in the NO molecule following femtosecond single photon excitation in the vacuum ultraviolet (VUV) range (λpump = 160 nm, 80 fs). The induced ultrafast dynamics, involving highly excited valence and Rydberg states, is probed by single photon ionization (λprobe = 400 nm, 40 fs). Varying the pump-probe time delay, the emitted photoelectrons are detected in a VMI spectrometer for time-, energy- and angle-resolved photoelectron spectroscopy. We observe that the different final vibrational states of the NO+ (X 1Σ+) cation, onto which this evolving vibronic wavepacket is projected, reveal different time dependences for the kinetic energy distribution and the laboratory frame photoelectron angular distribution (LFPAD). In particular, we observe unusually strong oscillations in the β4 asymmetry parameter, indicating sensitivity to the higher angular momentum components of the electronic aspect of this complex vibronic wavepacket.

  14. Optical and X-ray photoelectron spectroscopy of PbGeO 3 and Pb 5 ...

    Indian Academy of Sciences (India)

    Optical and X-ray photoelectron spectroscopy of PbGeO3 and Pb5Ge3O11 single crystals ... Optical Properties Volume 33 Issue 4 August 2010 pp 395-400 ... On gamma ray irradiation, the transmission of both the crystals is observed to deteriorate uniformly over the entire wavelength range, which has been attributed to the ...

  15. Photoelectronic properties of HgI 2 crystals for nuclear radiation ...

    Indian Academy of Sciences (India)

    Photoelectronic properties of red mercuric iodide single crystals, grown from its saturated solution in tetrahydrofuran, have been studied for the wavelength range 450-700 nm at temperatures 80, 110, 175, 235 and 300 K. Various aspects of the optical generation of charge carriers have been discussed. The computer ...

  16. Unraveling nonadiabatic ionization and Coulomb potential effect in strong-field photoelectron holography.

    Science.gov (United States)

    Song, Xiaohong; Lin, Cheng; Sheng, Zhihao; Liu, Peng; Chen, Zhangjin; Yang, Weifeng; Hu, Shilin; Lin, C D; Chen, Jing

    2016-06-22

    Strong field photoelectron holography has been proposed as a means for interrogating the spatial and temporal information of electrons and ions in a dynamic system. After ionization, part of the electron wave packet may directly go to the detector (the reference wave), while another part may be driven back and scatters off the ion(the signal wave). The interference hologram of the two waves may be used to extract target information embedded in the collision process. Unlike conventional optical holography, however, propagation of the electron wave packet is affected by the Coulomb potential as well as by the laser field. In addition, electrons are emitted over the whole laser pulse duration, thus multiple interferences may occur. In this work, we used a generalized quantum-trajectory Monte Carlo method to investigate the effect of Coulomb potential and the nonadiabatic subcycle ionization on the photoelectron hologram. We showed that photoelectron hologram can be well described only when the effect of nonadiabatic ionization is accounted for, and Coulomb potential can be neglected only in the tunnel ionization regime. Our results help paving the way for establishing photoelectron holography for probing spatial and dynamic properties of atoms and molecules.

  17. Photoelectron spectroscopy and modeling of interface properties related to organic photovoltaic cells

    NARCIS (Netherlands)

    Fahlman, Mats; Sehati, Parisa; Osikowicz, Wojciech; Braun, Slawomir; de Jong, Machiel Pieter; Brocks, Gerardus H.L.A.

    2013-01-01

    In this short review, we will give examples on how photoelectron spectroscopy (PES) assisted by models on interface energetics can be used to study properties important to bulk heterojunction type organic photovoltaic devices focusing on the well-known bulk heterojunction blend of

  18. Enzymatic Synthesis of Amylose Brushes Revisited : Details from X-Ray Photoelectron Spectroscopy and Spectroscopic Ellipsometry

    NARCIS (Netherlands)

    Mazzocchetti, Laura; Tsoufis, Theodorus; Rudolf, Petra; Loos, Katja

    The successful synthesis of amylose brushes via enzymatic ‘‘grafting from’’ polymerization and the detailed characterization of all synthetic steps by X-ray photoelectron spectroscopy (XPS) and spectroscopic ellipsometry measurements are reported. Au and Si surfaces are amino-functionalized with

  19. Hexamethylcyclopentadiene: time-resolved photoelectron spectroscopy and ab initio multiple spawning simulations

    DEFF Research Database (Denmark)

    Wolf, T. J. A.; Kuhlman, Thomas Scheby; Schalk, O.

    2014-01-01

    comparing time-resolved photoelectron spectroscopy (TRPES) with ab initio multiple spawning (AIMS) simulations on the MS-MR-CASPT2 level of theory. We disentangle the relationship between two phenomena that dominate the immediate molecular response upon light absorption: a spectrally dependent delay...

  20. Imaging photoelectron circular dichroism of chiral molecules by femtosecond multiphoton coincidence detection.

    Science.gov (United States)

    Lehmann, C Stefan; Ram, N Bhargava; Powis, Ivan; Janssen, Maurice H M

    2013-12-21

    Here, we provide a detailed account of novel experiments employing electron-ion coincidence imaging to discriminate chiral molecules. The full three-dimensional angular scattering distribution of electrons is measured after photoexcitation with either left or right circular polarized light. The experiment is performed using a simplified photoelectron-photoion coincidence imaging setup employing only a single particle imaging detector. Results are reported applying this technique to enantiomers of the chiral molecule camphor after three-photon ionization by circularly polarized femtosecond laser pulses at 400 nm and 380 nm. The electron-ion coincidence imaging provides the photoelectron spectrum of mass-selected ions that are observed in the time-of-flight mass spectra. The coincident photoelectron spectra of the parent camphor ion and the various fragment ions are the same, so it can be concluded that fragmentation of camphor happens after ionization. We discuss the forward-backward asymmetry in the photoelectron angular distribution which is expressed in Legendre polynomials with moments up to order six. Furthermore, we present a method, similar to one-photon electron circular dichroism, to quantify the strength of the chiral electron asymmetry in a single parameter. The circular dichroism in the photoelectron angular distribution of camphor is measured to be 8% at 400 nm. The electron circular dichroism using femtosecond multiphoton excitation is of opposite sign and about 60% larger than the electron dichroism observed before in near-threshold one-photon ionization with synchrotron excitation. We interpret our multiphoton ionization as being resonant at the two-photon level with the 3s and 3p Rydberg states of camphor. Theoretical calculations are presented that model the photoelectron angular distribution from a prealigned camphor molecule using density functional theory and continuum multiple scattering X alpha photoelectron scattering calculations

  1. Hard X-ray photoelectron and X-ray absorption spectroscopy characterization of oxidized surfaces of iron sulfides

    Energy Technology Data Exchange (ETDEWEB)

    Mikhlin, Yuri, E-mail: yumikh@icct.ru [Institute of Chemistry and Chemical Technology of the Siberian Branch of the Russian Academy of sciences, Akademgorodok, 50/24, Krasnoyarsk, 660036 (Russian Federation); Tomashevich, Yevgeny [Institute of Chemistry and Chemical Technology of the Siberian Branch of the Russian Academy of sciences, Akademgorodok, 50/24, Krasnoyarsk, 660036 (Russian Federation); Vorobyev, Sergey [Institute of Chemistry and Chemical Technology of the Siberian Branch of the Russian Academy of sciences, Akademgorodok, 50/24, Krasnoyarsk, 660036 (Russian Federation); Siberian Federal University, Svobodny pr. 79, Krasnoyarsk, 660041 (Russian Federation); Saikova, Svetlana [Siberian Federal University, Svobodny pr. 79, Krasnoyarsk, 660041 (Russian Federation); Romanchenko, Alexander [Institute of Chemistry and Chemical Technology of the Siberian Branch of the Russian Academy of sciences, Akademgorodok, 50/24, Krasnoyarsk, 660036 (Russian Federation); Félix, Roberto [Renewable Energy, Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Lise-Meitner-Campus, Hahn-Meitner-Platz 1, 14109 Berlin (Germany)

    2016-11-30

    Highlights: • Pyrite and pyrrhotite in-air abraded and etched in aqueous Fe{sup 3+} solution were studied. • HAXPES (2 keV-6 keV) and Fe K-, S K-edge XANES (TEY and PFY mode) were measured. • Outer “polysulfide”, strongly S-excessive layers are no more than 1–4 nm thick. • “Metal-depleted” layers depend on the treatment and differ for pyrite and pyrrhotite. • Extended nearly-stoichiometric “defective” underlayers were detected using TEY XANES. - Abstract: Hard X-ray photoelectron spectroscopy (HAXPES) using an excitation energy range of 2 keV to 6 keV in combination with Fe K- and S K-edge XANES, measured simultaneously in total electron (TEY) and partial fluorescence yield (PFY) modes, have been applied to study near-surface regions of natural polycrystalline pyrite FeS{sub 2} and pyrrhotite Fe{sub 1−x}S before and after etching treatments in an acidic ferric chloride solution. It was found that the following near-surface regions are formed owing to the preferential release of iron from oxidized metal sulfide lattices: (i) a thin, no more than 1–4 nm in depth, outer layer containing polysulfide species, (ii) a layer exhibiting less pronounced stoichiometry deviations and low, if any, concentrations of polysulfide, the composition and dimensions of which vary for pyrite and pyrrhotite and depend on the chemical treatment, and (iii) an extended almost stoichiometric underlayer yielding modified TEY XANES spectra, probably, due to a higher content of defects. We suggest that the extended layered structure should heavily affect the near-surface electronic properties, and processes involving the surface and interfacial charge transfer.

  2. High energy photoelectron spectroscopy in basic and applied science: Bulk and interface electronic structure

    Energy Technology Data Exchange (ETDEWEB)

    Knut, Ronny; Lindblad, Rebecka [Department of Physics and Astronomy, Uppsala University, SE-751 21 Uppsala (Sweden); Gorgoi, Mihaela [Helmholtz Zentrum Berlin für Materialien und Energie GmbH, Albert-Einstein-Str. 15, 12489 Berlin (Germany); Rensmo, Håkan [Department of Physics and Astronomy, Uppsala University, SE-751 21 Uppsala (Sweden); Karis, Olof, E-mail: olof.karis@physics.uu.se [Department of Physics and Astronomy, Uppsala University, SE-751 21 Uppsala (Sweden)

    2013-10-15

    Highlights: •We demonstrate how hard X-ray photoelectron spectroscopy can be used to investigate interface properties of multilayers. •By combining HAXPES and statistical methods we are able to provide quantitative analysis of the interface diffusion process. •We show how photoionization cross sections can be used to map partial density of states contributions to valence states. •We use HAXPES to provide insight into the valence electronic structure of e.g. multiferroics and dye-sensitized solar cells. -- Abstract: With the access of new high-performance electron spectrometers capable of analyzing electron energies up to the order of 10 keV, the interest for photoelectron spectroscopy has grown and many new applications of the technique in areas where electron spectroscopies were considered to have limited use have been demonstrated over the last few decades. The technique, often denoted hard X-ray photoelectron spectroscopy (HX-PES or HAXPES), to distinguish the experiment from X-ray photoelectron spectroscopy performed at lower energies, has resulted in an increasing interest in photoelectron spectroscopy in many areas. The much increased mean free path at higher kinetic energies, in combination with the elemental selectivity of the core level spectroscopies in general has led to this fact. It is thus now possible to investigate the electronic structure of materials with a substantially enhanced bulk sensitivity. In this review we provide examples from our own research using HAXPES which to date has been performed mainly at the HIKE facility at the KMC-1 beamline at HZB, Berlin. The review exemplifies the new opportunities using HAXPES to address both bulk and interface electronic properties in systems relevant for applications in magnetic storage, energy related research, but also in purely curiosity driven problems.

  3. Superthermal electrons at Mars: Photoelectrons, solar wind electrons, and dust storm influences

    Science.gov (United States)

    Xu, Shaosui

    Mars is unique in the solar system in terms of its interaction with solar wind because it lacks of a significant intrinsic global magnetic field but possesses localized strong crustal fields. This interaction results in a very complex magnetic topology at Mars so that superthermal electrons, mainly including photoelectrons and solar wind electrons, can be distinctively important for such a complicated planetary space environment. These energetic electrons (1-1000 electron volts) can carry and rapidly redistribute energy along the magnetic field lines. They are also a reliable tool to deduce the Martian magnetic topology, which is critical to understand the electromagnetic dynamics of the Martian space environment. The investigation methodology involves both data analysis and modeling. This dissertation mainly investigates three topics of superthermal electrons at Mars. (1) This dissertation confirms that the long-lived influence of Martian low-altitude dust storms on high-altitude photoelectron fluxes is common for a wide range of energy and pitch angles and determines that this effect originates from the thermosphere-ionosphere source region of the photoelectrons, rather than at exospheric altitudes at or above MGS. Through simulations, the results suggest that the global dust storm altered the photoelectron fluxes by causing CO2 to be the dominant species at a much larger altitude range than usual. (2) Because the integral of the production rate above the superthermal electron exobase is about the same for all solar zenith angles, quite counterintuitively, it is found, observationally and numerically/theoretically, that the high-altitude photoelectron fluxes are quite independent of solar zenith angle. (3) Based on the energy spectral (flux against energy) difference between photoelectrons and solar wind electrons, a statistical approach is taken to distinguish the two populations and also allows us to quantify the occurrence rate of solar wind electron

  4. Femtosecond dynamics of electronic states in the Mott insulator 1T-TaS{sub 2} by time resolved photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Perfetti, L; Loukakos, P A; Lisowski, M; Bovensiepen, U; Wolf, M [Fachbereich Physik, Freie Universitaet Berlin, Arnimallee 14, 14195 Berlin (Germany); Berger, H [Institut de Physique de la Matiere Complexe, EPFL, CH-1015 Lausanne (Switzerland); Biermann, S; Georges, A [Centre de Physique Theorique, Ecole Polytechnique, 91128 Palaiseau Cedex (France)], E-mail: perfetti@physik.fu-berlin.de

    2008-05-15

    Photoexcitation of the Mott insulator 1T-TaS{sub 2} by an intense laser pulse leads to an ultrafast transition toward a gapless phase. Besides the collapse of the electronic gap, the sudden excitation of the charge density wave (CDW) mode results in periodic oscillations of the electronic states. We employ time resolved photoelectron spectroscopy to monitor the rich dynamics of electrons and phonons during the relaxation toward equilibrium. The qualitative difference between the oscillatory dynamics of the CDW and the monotonic recovery of the electronic gap proves that 1T-TaS{sub 2} is indeed a Mott insulator. Moreover the quasi-instantaneous build-up of mid gap states is in contrast with the retarded response expected from a Peierls insulating phase. Interestingly, the photoinduced electronic states in the midgap spectral region display a weak resonance that is reminiscent of a quasiparticle peak.

  5. High-resolution electron-energy-loss spectroscopy and photoelectron-diffraction studies of the geometric structure of adsorbates on single-crystal metal surfaces

    Energy Technology Data Exchange (ETDEWEB)

    Rosenblatt, D.H.

    1982-11-01

    Two techniques which have made important contributions to the understanding of surface phenomena are high resolution electron energy loss spectroscopy (EELS) and photoelectron diffraction (PD). EELS is capable of directly measuring the vibrational modes of clean and adsorbate covered metal surfaces. In this work, the design, construction, and performance of a new EELS spectrometer are described. These results are discussed in terms of possible structures of the O-Cu(001) system. Recommendations for improvements in this EELS spectrometer and guidelines for future spectrometers are given. PD experiments provide accurate quantitative information about the geometry of atoms and molecules adsorbed on metal surfaces. The technique has advantages when used to study disordered overlayers, molecular overlayers, multiple site systems, and adsorbates which are weak electron scatterers. Four experiments were carried out which exploit these advantages.

  6. Photoelectron spectroscopy and modeling of interface properties related to organic photovoltaic cells

    Energy Technology Data Exchange (ETDEWEB)

    Fahlman, Mats, E-mail: mafah@ifm.liu.se [Department of Physics, Chemistry and Biology, Linkoping University, SE-581 83 Linkoping (Sweden); Sehati, Parisa; Osikowicz, Wojciech; Braun, Slawomir [Department of Physics, Chemistry and Biology, Linkoping University, SE-581 83 Linkoping (Sweden); Jong, Michel P. de [MESA Institute for Nanotechnology, University of Twente, P.O. Box 217, 7500 AE Enschede (Netherlands); Brocks, Geert [MESA Institute for Nanotechnology, University of Twente, P.O. Box 217, 7500 AE Enschede (Netherlands); Computational Materials Science, Faculty of Science and Technology, University of Twente, P.O. Box 217, 7500 AE Enschede (Netherlands)

    2013-10-15

    Highlights: ► Photoelectron spectroscopy measurements of properties in organic solar cells. ► Advantages and limitations are discussed. ► Theoretical modeling of interface properties is presented. -- Abstract: In this short review, we will give examples on how photoelectron spectroscopy (PES) assisted by models on interface energetics can be used to study properties important to bulk heterojunction type organic photovoltaic devices focusing on the well-known bulk heterojunction blend of poly(3-hexylthiophene):[6,6]-phenyl-C61-butyric acid methyl ester (P3HT:PCBM) and its model system P3HT:C{sub 60}. We also will discuss some of the limitations of PES as applied to organic semiconductors (OS) and photovoltaic devices and finish with reviewing recent theoretical advances that now enable calculation of relevant parameters at (hybrid) interfaces measured by PES.

  7. Photoelectron angular distribution in two-pathway ionization of neon with femtosecond XUV pulses

    CERN Document Server

    Douguet, Nicolas; Staroselskaya, Ekaterina I; Bartschat, Klaus; Grum-Grzhimailo, Alexei N

    2016-01-01

    We analyze the photoelectron angular distribution in two-pathway interference between non\\-resonant one-photon and resonant two-photon ionization of neon. We consider a bichromatic femtosecond XUV pulse whose fundamental frequency is tuned near the $2p^5 3s$ atomic states of neon. The time-dependent Schr\\"odinger equation is solved and the results are employed to compute the angular distribution and the associated anisotropy parameters at the main photoelectron line. We also employ a time-dependent perturbative approach, which allows obtaining information on the process for a large range of pulse parameters, including the steady-state case of continuous radiation, i.e., an infinitely long pulse. The results from the two methods are in relatively good agreement over the domain of applicability of perturbation theory.

  8. Direct imaging of three-dimensional atomic arrangement by stereophotography using two-dimensional photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Daimon, H., E-mail: daimon@ms.naist.jp [Graduate School of Materials Science, Nara Institute of Science and Technology (NAIST), 8916-5 Takayama, Ikoma, Nara 630-0192 (Japan); Matsui, F.; Goto, K.; Matsumoto, T. [Graduate School of Materials Science, Nara Institute of Science and Technology (NAIST), 8916-5 Takayama, Ikoma, Nara 630-0192 (Japan); Kato, Y.; Matsushita, T. [SPring-8/JASRI, Kouto 1-1-1, Mikazuki, Sayo, Hyogo 679-5198 (Japan)

    2011-08-21

    We have developed a new method, 'stereo-atomscope', to obtain a stereophotograph of the three-dimensional atomic arrangement around a specific atom at the surface, with which one can view the three-dimensional atomic arrangement directly by naked eyes. The azimuthal shifts of forward focusing peaks in the photoelectron angular distribution pattern obtained with left and right helicity lights are the same as the parallax in a stereo-view. Taking advantage of this phenomenon of circular dichroism in the photoelectron angular distribution, one can realize a stereoscope of atomic arrangement. A display-type spherical-mirror analyzer has been used to obtain stereoscopic photographs directly on the screen without any computer-aided conversion process.

  9. Single photoelectron trapping, storage, and detection in a field effect transistor

    Science.gov (United States)

    Kosaka, Hideo; Rao, Deepak S.; Robinson, Hans D.; Bandaru, Prabhakar; Makita, Kikuo; Yablonovitch, Eli

    2003-01-01

    We have demonstrated that a single photoelectron can be trapped, stored, and its photoelectric charge detected by a source/drain channel in a transistor. The electron trap can be photoionized and repeatedly reset for the arrival of successive individual photons. This single-photoelectron transistor, operating in the λ=1.3 μm telecommunication band, was demonstrated by using a window-gate double-quantum-well InGaAs/InAlAs/InP heterostructure that was designed to provide near-zero electron g factor. In general, g-factor engineering allows selection rules that would convert a photon polarization to an electron-spin polarization. Such a transistor photodetector could be useful for flagging the safe arrival of a photon in a quantum repeater. In the future, the safe arrival of a photoelectric charge would trigger the commencement of the teleportation algorithm in a quantum repeater to be used for quantum telecommunications.

  10. Photoelectron scattering and acid release in EUV lithography: a simulation study (Conference Presentation)

    Science.gov (United States)

    Biafore, John J.

    2017-03-01

    Abstract BACKGROUND: The ionizing wavelength in extreme ultraviolet (EUV) resist exposure leads to photoelectron scattering and uncertainty in the resulting acid image, producing line-edge roughness (LER) and poor CD uniformity of the printed features. GOALS: Try to determine how photoelectron and acid exposure blur effects affect EUV lithography and how they might be better controlled. Try to determine whether or not, and if so under what conditions, high resist quantum yields are beneficial to EUV lithography. METHODS: Using a stochastic resist simulator, we study the effects of resist properties upon photoelectric scattering, the uncertainty in the acid release and the properties of the after-development photoresist image in high NA EUV lithography. Uncertainty in the release of acids is the fundamental cause of LER and the ultimate limiter of optical lithography technology.

  11. An X-ray photoelectron spectroscopy study of uranyl-chitosan interaction

    Directory of Open Access Journals (Sweden)

    Veleshko Alexander N.

    2008-01-01

    Full Text Available An X-ray photoelectron spectroscopy study of uranium sorption by spherically-granulated chitosan in sulphate solutions, as well as the study of the nature of the U(VI - chitosan interaction was carried out in this work. The X-ray photoelectron spectroscopy analysis showed that the uranyl - chitosan interaction results in the formation of complexes with aminogroup nitrogen, and possibly chitin ring oxygens and free hydroxyl groups in the equatorial plane. Under the UHV in the spectrometer chamber, the uranyl-amin and uranyl-hyroxide bonds were shown to break and tetravalent uranium compounds were shown to form on the sample surface. Hydroxyl groups were shown to evaporate. The calculated DG0 = -1,3 kJ/mol can be an evidence of several concurrent processes, some of which require energy, as well as of the formation of a surface chemical compound.

  12. High-throughput Toroidal Grating Beamline for Photoelectron Spectroscopy at CAMD.

    Science.gov (United States)

    Kizilkaya, O; Jiles, R W; Patterson, M C; Thibodeaux, C A; Poliakoff, E D; Sprunger, P T; Kurtz, R L; Morikawa, E

    A 5 meter toroidal grating (5m-TGM) beamline has been commissioned to deliver 28 mrad of bending magnet radiation to an ultrahigh vacuum endstation chamber to facilitate angle resolved photoelectron spectroscopy. The 5m-TGM beamline is equipped with Au-coated gratings with 300, 600 and 1200 lines/mm providing monochromatized synchrotron radiation in the energy ranges 25-70 eV, 50-120 eV and 100-240 eV, respectively. The beamline delivers excellent flux (~1014-1017 photons/sec/100mA) and a combined energy resolution of 189 meV for the beamline (at 1.0 mm slit opening) and HA-50 hemispherical analyzer was obtained at the Fermi level of polycrystalline gold crystal. Our preliminary photoelectron spectroscopy results of phenol adsorption on TiO2 (110) surface reveals the metal ion (Ti) oxidation.

  13. Enantiomeric Excess Sensitivity to Below One Percent by Using Femtosecond Photoelectron Circular Dichroism.

    Science.gov (United States)

    Kastner, Alexander; Lux, Christian; Ring, Tom; Züllighoven, Stefanie; Sarpe, Cristian; Senftleben, Arne; Baumert, Thomas

    2016-04-18

    Photoelectron circular dichroism (PECD) is experimentally investigated with chiral specimens with varying amounts of enantiomeric excess (ee). As a prototype, we measure and analyze the photoelectron angular distribution from randomly oriented fenchone molecules in the gas phase that result from ionization with circularly polarized femtosecond laser pulses. The quantification of these measurements shows a linear dependence with respect to the ee values. In addition, differences in the ee values (denoted as detection limit) of below one percent can be distinguished for nearly enantiopure samples, as well as for almost racemates. In combination with the use of a reference, the assignment of absolute ee values is possible. The present measurement time is a few minutes, but this could be reduced. This table-top laser-based approach should facilitate widespread implementation in chiral analysis. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  14. A novel method for resonant inelastic soft X-ray scattering via photoelectron spectroscopy detection.

    Science.gov (United States)

    Dakovski, Georgi L; Lin, Ming Fu; Damiani, Daniel S; Schlotter, William F; Turner, Joshua J; Nordlund, Dennis; Ogasawara, Hirohito

    2017-11-01

    A method for measuring resonant inelastic X-ray scattering based on the conversion of X-ray photons into photoelectrons is presented. The setup is compact, relies on commercially available detectors, and offers significant flexibility. This method is demonstrated at the Linac Coherent Light Source with ∼0.5 eV resolution at the cobalt L3-edge, with signal rates comparable with traditional grating spectrometers.

  15. Transition absorption as a mechanism of surface photoelectron emission from metals

    DEFF Research Database (Denmark)

    Zhukovsky, Sergei; Protsenko, Igor E.; Ikhsanov, Renat Sh

    2015-01-01

    Transition absorption of a photon by an electron passingthrough a boundary between two media with different permit-tivities is described both classically and quantum mechani-cally. Transition absorption is shown to make a substantialcontribution to photoelectron emission at a metal/semicon-ductor....../semicon-ductor interface in nanoplasmonic systems, and is put forth asa possible microscopic mechanism of the surface photoelec-tric effect in photodetectors and solar cells containing plas-monic nanoparticles....

  16. Disentangling Intracycle Interferences in Photoelectron Momentum Distributions Using Orthogonal Two-Color Laser Fields

    Science.gov (United States)

    Xie, Xinhua; Wang, Tian; Yu, ShaoGang; Lai, XuanYang; Roither, Stefan; Kartashov, Daniil; Baltuška, Andrius; Liu, XiaoJun; Staudte, André; Kitzler, Markus

    2017-12-01

    We use orthogonally polarized two-color (OTC) laser pulses to separate quantum paths in the multiphoton ionization of Ar atoms. Our OTC pulses consist of 400 and 800 nm light at a relative intensity ratio of 10 ∶1 . We find a hitherto unobserved interference in the photoelectron momentum distribution, which exhibits a strong dependence on the relative phase of the OTC pulse. Analysis of model calculations reveals that the interference is caused by quantum pathways from nonadjacent quarter cycles.

  17. Influence of photoelectrons on the structure and dynamics of the upper atmosphere of a hot Jupiter

    Science.gov (United States)

    Ionov, D. E.; Shematovich, V. I.; Pavlyuchenkov, Ya. N.

    2017-05-01

    A self-consistent, aeronomic model of the upper atmosphere of a "hot Jupiter" including reactions involving suprathermal photoelectrons is presented. This model is used to compute the height profiles of the gas density, velocity, and temperature in the atmosphere of the exoplanet HD 209458b. It is shown that including suprathermal electrons when computing the heating and cooling functions reduces the mass loss rate of the atmosphere by a factor of five.

  18. An instrument for the investigation of actinides with spin resolved photoelectron spectroscopy and bremsstrahlung isochromat spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Yu, S.-W. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Tobin, J. G. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Chung, B. W. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)

    2011-01-01

    A new system for spin resolved photoelectron spectroscopy and bremsstrahlung isochromat spectroscopy has been built and commissioned at Lawrence Livermore National Laboratory for the investigation of the electronic structure of the actinides.Actinide materials are very toxic and radioactive and therefore cannot be brought to most general user facilities for spectroscopic studies. The technical details of the new system and preliminary data obtained therein will be presented and discussed.

  19. A photoelectron-photoion coincidence method for the investigation of decay probabilities after innershell photoionization

    CERN Document Server

    Kanngiesser, B; Godehusen, K; Gerth, C; Malzer, W; Richter, M; Zimmermann, P

    2001-01-01

    The photoelectron-photoion method presented is shown to be very successful for the quantitative investigation of decay probabilities after innershell photoionization. Especially for the determination of K-shell fluorescence yields of light elements, where only scarce data exist up to now, this method opens up new ways. For all elements we present a general approach to determine fluorescence yields. As an example the investigation of the 1 s decay of free sodium atoms is presented.

  20. Measurement of actinides in environmental samples by Photo-Electron Rejecting Alpha Liquid Scintillation

    Energy Technology Data Exchange (ETDEWEB)

    Cadieux, J.R. [Westinghouse Savannah River Co., Aiken, SC (United States); Clark, S. [Savannah River Ecology Lab., Univ. of Georgia (United States); Fjeld, R.A.; Reboul, S.; Sowder, A. [Clemson Univ., SC (United States). Dept. of Environmental Systems Engineering

    1994-05-01

    This work describes the adaptation of extractive scintillation with a Photo-Electron Rejecting Alpha Liquid Scintillation (PERALS) (ORDELA, Inc.) spectrometer to the analysis of actinides in environmental samples from the Savannah River Site (SRS). Environmental quality assurance standards and actual water samples were treated by one of two methods; either a two step direct extraction, or for more complex samples, pretreatment by an extraction chromatographic separation prior to measurement of the alpha activity by PERALS.

  1. An ultra cold photoelectron gun for the Heidelberg TSR target section

    Energy Technology Data Exchange (ETDEWEB)

    Krantz, C; Orlov, D A; Hoffmann, J; Lestinsky, M; Novotny, O; Wolf, A [Max Planck Institute of Nuclear Physics, Saupfercheckweg 1, 69117 Heidelberg (Germany); Jaroshevich, A S; Terekhov, A S, E-mail: claude.krantz@mpi-hd.mpg.d [Institute of Semiconductor Physics, Lavrenteva 13, 630090 Novosibirsk (Russian Federation)

    2009-11-15

    We present a cryogenic photoelectron gun, developed for the target section of the Test Storage Ring (TSR) of the Max Planck Institute of Nuclear Physics (MPIK). Cooled to cryogenic temperatures by liquid nitrogen, the photocathode source provides an electron gas with an initial thermal energy spread of around 10 meV. The beam optics of the target section reduce the electron temperatures to much lower values in the comoving frame of the beam. Recently the photocathode source has seen significant improvements regarding its reliability. By controlling several cathode degradation mechanisms, including cryosorption, vacuum degrading leak electron currents, and backstream of ionised restgas particles, cathode lifetime and currents have been subject to substantial improvements. Presently the photoelectron gun can deliver currents of up to 1 mA at lifetimes of about 24h. The ability of the photoelectron beam to cool slow, heavy molecular ion beams was demonstrated by cooling a 3 MeV CF{sup +} beam in the TSR. At an electron cooling energy of only 53 eV and a perveance-limited current of 0.34 mA, a cooling time below 2 s has been achieved, with a very small transverse relative momentum spread of 2.5 {center_dot} 10{sup -5} and final ion beam cross-section of 0.5x0.1 mm{sup 2}.

  2. Conformation-selective resonant photoelectron imaging from dipole-bound states of cold 3-hydroxyphenoxide

    Science.gov (United States)

    Zhu, Guo-Zhu; Huang, Dao-Ling; Wang, Lai-Sheng

    2017-07-01

    We report a photoelectron imaging and photodetachment study of cryogenically cooled 3-hydroxyphenoxide (3HOP) anions, m-HO(C6H4)O-. In a previous preliminary study, two conformations of the cold 3HOP anions with different dipole bound states were observed [D. L. Huang et al., J. Phys. Chem. Lett. 6, 2153 (2015)]. Five near-threshold vibrational resonances were revealed in the photodetachment spectrum from the dipole-bound excited states of the two conformations. Here, we report a more extensive investigation of the two conformers with observation of thirty above-threshold vibrational resonances in a wide spectral range between 18 850 and 19 920 cm-1 (˜1000 cm-1 above the detachment thresholds). By tuning the detachment laser to the vibrational resonances in the photodetachment spectrum, high-resolution conformation-selective resonant photoelectron images are obtained. Using information of the autodetachment channels and theoretical vibrational frequencies, we are able to assign the resonant peaks in the photodetachment spectrum: seventeen are assigned to vibrational levels of anti-3HOP, eight to syn-3HOP, and five to overlapping vibrational levels of both conformers. From the photodetachment spectrum and the conformation-selective resonant photoelectron spectra, we have obtained fourteen fundamental vibrational frequencies for the neutral syn- and anti-m-HO(C6H4)Oṡ radicals. The possibility to produce conformation-selected neutral beams using resonant photodetachment via dipole-bound excited states of anions is discussed.

  3. Model independent approach to the single photoelectron calibration of photomultiplier tubes

    Energy Technology Data Exchange (ETDEWEB)

    Saldanha, R.; Grandi, L.; Guardincerri, Y.; Wester, T.

    2017-08-01

    The accurate calibration of photomultiplier tubes is critical in a wide variety of applications in which it is necessary to know the absolute number of detected photons or precisely determine the resolution of the signal. Conventional calibration methods rely on fitting the photomultiplier response to a low intensity light source with analytical approximations to the single photoelectron distribution, often leading to biased estimates due to the inability to accurately model the full distribution, especially at low charge values. In this paper we present a simple statistical method to extract the relevant single photoelectron calibration parameters without making any assumptions about the underlying single photoelectron distribution. We illustrate the use of this method through the calibration of a Hamamatsu R11410 photomultiplier tube and study the accuracy and precision of the method using Monte Carlo simulations. The method is found to have significantly reduced bias compared to conventional methods and works under a wide range of light intensities, making it suitable for simultaneously calibrating large arrays of photomultiplier tubes.

  4. Visible sub-band gap photoelectron emission from nitrogen doped and undoped polycrystalline diamond films

    Science.gov (United States)

    Elfimchev, S.; Chandran, M.; Akhvlediani, R.; Hoffman, A.

    2017-07-01

    In this study the origin of visible sub-band gap photoelectron emission (PEE) from polycrystalline diamond films is investigated. The PEE yields as a function of temperature were studied in the wavelengths range of 360-520 nm. Based on the comparison of electron emission yields from diamond films deposited on silicon and molybdenum substrates, with different thicknesses and nitrogen doping levels, we suggested that photoelectrons are generated from nitrogen related centers in diamond. Our results show that diamond film thickness and substrate material have no significant influence on the PEE yield. We found that nanocrystalline diamond films have low electron emission yields, compared to microcrystalline diamond, due to the presence of high amount of defects in the former, which trap excited electrons before escaping into the vacuum. However, the low PEE yield of nanocrystalline diamond films was found to increase with temperature. The phenomenon was explained by the trap assisted photon enhanced thermionic emission (ta-PETE) model. According to the ta-PETE model, photoelectrons are trapped by shallow traps, followed by thermal excitation at elevated temperatures and escape into the vacuum. Activation energies of trap levels were estimated for undoped nanocrystalline, undoped microcrystalline and N-doped diamond films using the Richardson-Dushman equation, which gives 0.13, 0.39 and 0.04 eV, respectively. Such low activation energy of trap levels makes the ta-PETE process very effective at elevated temperatures.

  5. Photoelectron Holographic Atomic Arrangement Imaging of Cleaved Bimetal-intercalated Graphite Superconductor Surface.

    Science.gov (United States)

    Matsui, Fumihiko; Eguchi, Ritsuko; Nishiyama, Saki; Izumi, Masanari; Uesugi, Eri; Goto, Hidenori; Matsushita, Tomohiro; Sugita, Kenji; Daimon, Hiroshi; Hamamoto, Yuji; Hamada, Ikutaro; Morikawa, Yoshitada; Kubozono, Yoshihiro

    2016-11-04

    From the C 1s and K 2p photoelectron holograms, we directly reconstructed atomic images of the cleaved surface of a bimetal-intercalated graphite superconductor, (Ca, K)C 8 , which differed substantially from the expected bulk crystal structure based on x-ray diffraction (XRD) measurements. Graphene atomic images were collected in the in-plane cross sections of the layers 3.3 Å and 5.7 Å above the photoelectron emitter C atom and the stacking structures were determined as AB- and AA-type, respectively. The intercalant metal atom layer was found between two AA-stacked graphenes. The K atomic image revealing 2 × 2 periodicity, occupying every second centre site of C hexagonal columns, was reconstructed, and the Ca 2p peak intensity in the photoelectron spectra of (Ca, K)C 8 from the cleaved surface was less than a few hundredths of the K 2p peak intensity. These observations indicated that cleavage preferentially occurs at the KC 8 layers containing no Ca atoms.

  6. Photoelectron imaging, probe of the dynamics: from atoms... to clusters; Imagerie de photoelectrons, sonde de la dynamique: des atomes... aux agregats

    Energy Technology Data Exchange (ETDEWEB)

    Lepine, F

    2003-06-15

    This thesis concerns the study of the deexcitation of clusters and atoms by photoelectron imaging. The first part is dedicated to thermionic emission of a finite size system. A 3-dimensional imaging setup allows us to measure the time evolution of the kinetic energy spectrum of electrons emitted from different clusters (W{sub n}{sup -}, C{sub n}{sup -}, C{sub 60}). Then we have a direct access to the fundamental quantities which characterize this statistical emission: the temperature of the finite heat bath and the decay rate. The second part concerns the ionization of atomic Rydberg states placed in a static electric field. We performed the first experiment of photoionization microscopy which allows us to obtain a picture which is the macroscopic projection of the electronic wave function. Then we have access to the detail of the photoionization and particularly to the quantum properties of the electron usually confined at the atomic scale. (author)

  7. SNV's modes of ordering

    NARCIS (Netherlands)

    Hummel, John; Duim, van der Rene

    2016-01-01

    This article adopts an aidnographic approach to examine how internal organizational modes of ordering have influenced tourism development practices of SNV Netherlands Development Organisation (SNV). Our research revealed six modes of ordering: administration, project management, enterprising,

  8. High-Resolution Photoionization, Photoelectron and Photodissociation Studies. Determination of Accurate Energetic and Spectroscopic Database for Combustion Radicals and Molecules

    Energy Technology Data Exchange (ETDEWEB)

    Ng, Cheuk-Yiu [Univ. of California, Davis, CA (United States)

    2016-04-25

    The main goal of this research program was to obtain accurate thermochemical and spectroscopic data, such as ionization energies (IEs), 0 K bond dissociation energies, 0 K heats of formation, and spectroscopic constants for radicals and molecules and their ions of relevance to combustion chemistry. Two unique, generally applicable vacuum ultraviolet (VUV) laser photoion-photoelectron apparatuses have been developed in our group, which have used for high-resolution photoionization, photoelectron, and photodissociation studies for many small molecules of combustion relevance.

  9. Modes of log gravity

    NARCIS (Netherlands)

    Bergshoeff, Eric A.; Hohm, Olaf; Rosseel, Jan; Townsend, Paul K.

    2011-01-01

    The physical modes of a recently proposed D-dimensional "critical gravity'', linearized about its anti-de Sitter vacuum, are investigated. All "log mode'' solutions, which we categorize as "spin-2'' or "Proca'', arise as limits of the massive spin-2 modes of the noncritical theory. The linearized

  10. Surface Plasmonic Lens Driven Photoelectron Source for Multi-beam Applications

    Science.gov (United States)

    Choi, Heon J.

    Surface plasmon polariton (SPP) assisted photoelectron source array is proposed for use in distributed multiple electron beam lithography applications. Individual source is composed of a metal/dielectric surface structure with concentric circular grooves of subwavelength width surrounding a sub-wavelength aperture. Such optical power concentrators, called "plasmonic lenses", collect light incident over a broad area by converting it to surface electromagnetic waves, specifically SPP's, through diffraction by the sub-wavelength grooves surrounding the aperture. Through constructive interference of the generated SPPs between neighboring grooves, controlled by the periodicity of the grooves, high optical power densities can be achieved at the center of the lens near the aperture. This facilitates high transmission of optical power through the aperture which results in more light being transmitted than is incident on the aperture itself. Such an approach results in a focal spot at the exit side of the aperture with highly enhanced optical power density compared to the incident light. Optimization of the circular groove-aperture plasmonic lens is demonstrated through finite-difference-in-time-domain simulations that focus on the overall performance of the optical power density enhancement at the operating wavelength of 266 nm. The basic method for the fabrication of plasmonic lenses based on electron beam lithography and reactive ion etching techniques is demonstrated. Additionally, the fabricated structures are tested by the measurement of plasmonic lens facilitated photoemission current driven by a 266 nm laser. Experimental results of the performance of the fabricated structures, composed of Al and a-SiO2, is measured and analyzed. The plasmonic lens fabricated with the optimized design exhibit ˜15 enhancement of the incident optical power density. The plasmonic lens arrays are designed to drive photoelectron emission from nanodots with diamters in the sub-100 nm

  11. CRF-PEPICO: Double velocity map imaging photoelectron photoion coincidence spectroscopy for reaction kinetics studies

    Science.gov (United States)

    Sztáray, Bálint; Voronova, Krisztina; Torma, Krisztián G.; Covert, Kyle J.; Bodi, Andras; Hemberger, Patrick; Gerber, Thomas; Osborn, David L.

    2017-07-01

    Photoelectron photoion coincidence (PEPICO) spectroscopy could become a powerful tool for the time-resolved study of multi-channel gas phase chemical reactions. Toward this goal, we have designed and tested electron and ion optics that form the core of a new PEPICO spectrometer, utilizing simultaneous velocity map imaging for both cations and electrons, while also achieving good cation mass resolution through space focusing. These optics are combined with a side-sampled, slow-flow chemical reactor for photolytic initiation of gas-phase chemical reactions. Together with a recent advance that dramatically increases the dynamic range in PEPICO spectroscopy [D. L. Osborn et al., J. Chem. Phys. 145, 164202 (2016)], the design described here demonstrates a complete prototype spectrometer and reactor interface to carry out time-resolved experiments. Combining dual velocity map imaging with cation space focusing yields tightly focused photoion images for translationally cold neutrals, while offering good mass resolution for thermal samples as well. The flexible optics design incorporates linear electric fields in the ionization region, surrounded by dual curved electric fields for velocity map imaging of ions and electrons. Furthermore, the design allows for a long extraction stage, which makes this the first PEPICO experiment to combine ion imaging with the unimolecular dissociation rate constant measurements of cations to detect and account for kinetic shifts. Four examples are shown to illustrate some capabilities of this new design. We recorded the threshold photoelectron spectrum of the propargyl and the iodomethyl radicals. While the former agrees well with a literature threshold photoelectron spectrum, we have succeeded in resolving the previously unobserved vibrational structure in the latter. We have also measured the bimolecular rate constant of the CH2I + O2 reaction and observed its product, the smallest Criegee intermediate, CH2OO. Finally, the second

  12. Variable Mixed Orbital Character in the Photoelectron Angular Distribution of NO_{2}

    Science.gov (United States)

    Laws, Benjamin A.; Cavanagh, Steven J.; Lewis, Brenton R.; Gibson, Stephen T.

    2017-06-01

    NO_{2} a key component of photochemical smog and an important species in the Earth's atmosphere, is an example of a molecule which exhibits significant mixed orbital character in the HOMO. In photoelectron experiments the geometric properties of the parent anion orbital are reflected in the photoelectron angular distribution (PAD), an area of research that has benefited largely from the ability of velocity-map imaging (VMI) to simultaneously record both the energetic and angular information, with 100% collection efficiency. Photoelectron spectra of NO_{2}^{-}, taken over a range of wavelengths (355nm-520nm) with the ANU's VMI spectrometer, reveal an anomalous jump in the anisotropy parameter near threshold. Consequently, the orbital behavior of NO_{2}^{-} appears to be quite different near threshold compared to detachment at higher photon energies. This surprising effect is due to the Wigner Threshold law, which causes p orbital character to dominate the photodetachment cross-section near threshold, before the mixed s/d orbital character becomes significant at higher electron kinetic energies. By extending recent work on binary character models to form a more general expression, the variable mixed orbital character of NO_{2}^{-} is able to be described. This study provides the first multi-wavelength NO_{2} anisotropy data, which is shown to be in decent agreement with much earlier zero-core model predictions of the anisotropy parameter. K. J. Reed, A. H. Zimmerman, H. C. Andersen, and J. I. Brauman, J. Chem. Phys. 64, 1368, (1976). doi:10.1063/1.432404 D. Khuseynov, C. C. Blackstone, L. M. Culberson, and A. Sanov, J. Chem. Phys. 141, 124312, (2014). doi:10.1063/1.4896241 W. B. Clodius, R. M. Stehman, and S. B. Woo, Phys. Rev. A. 28, 760, (1983). doi:10.1103/PhysRevA.28.760 Research supported by the Australian Research Council Discovery Project Grant DP160102585

  13. Photoelectron counting autoguiding system with variable accumulating time and variable corrective value.

    Science.gov (United States)

    Zheng, Yi-Jin

    1990-12-01

    This paper discusses three variants of a photoelectron counting autoguiding system based on half-disc light modulator. The first variant operates with constant accumulating time. The second variant operates with variable accumulating time but constant corrective value, which equals the allowable error of the guiding system. The third variant operates with both variable accumulating time and variable corrective value. Guiding errors and time responses of these three variants are compared. Guiders based on the third variant have been successfully used at the 1.56 m astrometrical telescope and the double-tube 40 cm telescope in Shanghai Observatory. The guiding error measured from the plate is about 0″11.

  14. Final Version: Orbital Specificity in the Unoccupied States of UO2 from Resonant Inverse Photoelectron Spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Tobin, J G; Yu, S W

    2012-03-12

    One of the crucial questions of all actinide electronic structure determinations is the issue of 5f versus 6d character and the distribution of these components across the density of states. Here, a break-though experiment is discussed, which has allowed the direct determination of the U5f and U6d contributions to the unoccupied density of states (UDOS) in Uranium Dioxide. A novel Resonant Inverse Photoelectron (RIPES) and X-ray Emission Spectroscopy (XES) investigation of UO{sub 2} is presented. It is shown that the U5f and U6d components are isolated and identified unambiguously.

  15. Structure of TiO2 (011) revealed by photoelectron diffraction

    Science.gov (United States)

    Dupont, C.; Bourgeois, S.; Le Fèvre, P.; Verdini, A.; Floreano, L.; Domenichini, B.

    2016-12-01

    The combination of photoelectron diffraction, density functional theory, and multiple scattering calculations is used for a quantitative analysis of the widely debated structure of TiO2 (011). The modeling of the diffraction patterns for different surface reconstructions allows one to discriminate the key structural constraints required or, on the contrary, prohibited in the reconstruction of this termination. In particular, photodiffraction rules out previously proposed reconstructions while it evidences the key feature of the TiO2 (011) termination: an oxygen splitting induced by missing rows.

  16. Ionization energies of aqueous nucleic acids: Photoelectron spectroscopy of pyridine nucleosides and ab initio calculations

    Czech Academy of Sciences Publication Activity Database

    Slavíček, Petr; Winter, B.; Faubel, M.; Bradforth, S. E.; Jungwirth, Pavel

    2009-01-01

    Roč. 131, č. 18 (2009), s. 6460-6467 ISSN 0002-7863 R&D Projects: GA MŠk LC512; GA ČR GA203/08/0114 Grant - others:GA ČR(CZ) GP203/07/P449 Institutional research plan: CEZ:AV0Z40550506; CEZ:AV0Z40400503 Keywords : DNA bases * photoelectron spectroscopy * ab initio calculations Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 8.580, year: 2009

  17. Photoelectron Yields of Scintillation Counters with Embedded Wavelength-Shifting Fibers Read Out With Silicon Photomultipliers

    Energy Technology Data Exchange (ETDEWEB)

    Artikov, Akram; et al.

    2017-09-19

    Photoelectron yields of extruded scintillation counters with titanium dioxide coating and embedded wavelength shifting fibers read out by silicon photomultipliers have been measured at the Fermilab Test Beam Facility using 120\\,GeV protons. The yields were measured as a function of transverse, longitudinal, and angular positions for a variety of scintillator compositions and reflective coating mixtures, fiber diameters, and photosensor sizes. Timing performance was also studied. These studies were carried out by the Cosmic Ray Veto Group of the Mu2e collaboration as part of their R\\&D program.

  18. Ionization in elliptically polarized pulses: Multielectron polarization effects and asymmetry of photoelectron momentum distributions

    DEFF Research Database (Denmark)

    Shvetsov-Shilovskiy, Nikolay; Dimitrovski, Darko; Madsen, Lars Bojer

    2012-01-01

    in close to circularly polarized light, and it is validated by comparison with ab initio results and experiments. The momentum distributions are shown to be highly sensitive to the tunneling exit point, the Coulomb force, and the dipole potential from the induced dipole in the atomic core......In the tunneling regime we present a semiclassical model of above-threshold ionization with inclusion of the Stark shift of the initial state, the Coulomb potential, and a polarization induced dipole potential. The model is used for the investigation of the photoelectron momentum distributions...

  19. Photoelectron angular distributions from aligned molecules using the R-matrix method

    CERN Document Server

    Harvey, Alex G; Morales, Felipe; Smirnova, Olga

    2014-01-01

    We present a new extension of the UKRmol electron-molecule scattering code suite, which allows one to compute ab initio photoionization and photorecombination amplitudes for complex molecules, resolved both on the molecular alignment (orientation) and the emission angle and energy of the photoelectron. We illustrate our approach using CO$_2$ as an example, and analyze the importance of multi-channel effects by performing our calculations at different, increasing levels of complexity. We benchmark our method by comparing the results of our calculations with experimental data and with theoretical calculations available in the literature.

  20. X-ray photoelectron spectroscopy study of synchrotron radiation irradiation of a polytetrafluoroethylene surface

    CERN Document Server

    Haruyama, Y; Matsui, S; Ideta, T; Ishigaki, H

    2003-01-01

    The effect of synchrotron radiation (SR) irradiation of a polytetrafluoroethylene (PTFE) surface was investigated using X-ray photoelectron spectroscopy (XPS). After the SR irradiation, the relative intensity of the F ls peak to the C ls peak decreased markedly. The chemical composition ratio to the F atoms to C atoms was estimated to be 0.29. From the curve fitting analysis of C ls and F ls XPS spectra, the chemical components and their intensity ratio were determined. The reason for the chemical composition change by the SR irradiation was discussed. (author)

  1. Molecular-Frame 3D Photoelectron Momentum Distributions by Tomographic Reconstruction

    DEFF Research Database (Denmark)

    Maurer, Jochen; Dimitrovski, Darko; Christensen, Lauge

    2012-01-01

    momentum distribution is obtained by tomographic reconstruction from all 90 projections. It reveals an anisotropic electron distribution, angularly shifted in the polarization plane, that is not accessible by the 2D momentum images. Our theoretical analysis shows that the magnitude of the angular shift......Naphthalene molecules are fixed in space by a laser field and rotated, in 2° steps, over 180°. For each orientation, they are ionized by an intense, circularly polarized femtosecond laser pulse, and the 2D projection of the photoelectron momentum distribution is recorded. The molecular-frame 3D...

  2. In situ photoelectron spectroscopy of molecular-beam-epitaxy grown surfaces

    CERN Document Server

    Oshima, M; Okabayashi, J; Ono, K

    2003-01-01

    Two in situ high-resolution synchrotron radiation photoelectron spectroscopy (SRPES) systems combined with a molecular beam epitaxy (MBE) chamber for III-V compound semiconductors and a laser MBE chamber for strongly correlated oxide films, respectively, have been designed and fabricated to analyze intrinsic and surface/interface electronic structures of these unique materials. The importance of the in situ SRPES has been demonstrated by the results of 1) Si surface nanostructures, 2) GaAs surfaces/interfaces and nanostructures, 3) MnAs magnetic nanostructures, and 4) strongly-correlated La sub 1 sub - sub x Sr sub x MnO sub 3 surfaces/interfaces and superstructures.

  3. Single-order laser high harmonics in XUV for ultrafast photoelectron spectroscopy of molecular wavepacket dynamics

    Directory of Open Access Journals (Sweden)

    Mizuho Fushitani

    2016-11-01

    Full Text Available We present applications of extreme ultraviolet (XUV single-order laser harmonics to gas-phase ultrafast photoelectron spectroscopy. Ultrashort XUV pulses at 80 nm are obtained as the 5th order harmonics of the fundamental laser at 400 nm by using Xe or Kr as the nonlinear medium and separated from other harmonic orders by using an indium foil. The single-order laser harmonics is applied for real-time probing of vibrational wavepacket dynamics of I2 molecules in the bound and dissociating low-lying electronic states and electronic-vibrational wavepacket dynamics of highly excited Rydberg N2 molecules.

  4. X-ray Photoelectron Spectroscopy Investigation on Electrochemical Degradation of Proton Exchange Membrane Fuel Cell Electrodes

    DEFF Research Database (Denmark)

    Andersen, Shuang Ma; Dhiman, Rajnish; Skou, Eivind Morten

    2015-01-01

    X-ray photoelectron spectroscopy studies were systematically carried out on the electrodes before and after the electrochemical stress tests in an aqueous electrolyte at 20 °C and 70 °C. The electrodes have different ionomer structures (no ionomer, only ionomer, physically mixed ionomer and hot...... pressed ionomer) but have identical, commercial catalyst and catalyst loading. A significant degree of carbon corrosion, platinum migration and ionomer degradation were observed in the electrodes after the treatment. The degradation of the ionomer in the electrode is more severe than that of membrane...

  5. High resolution spin- and angle-resolved photoelectron spectroscopy for 3D spin vectorial analysis

    Science.gov (United States)

    Okuda, Taichi; Miyamoto, Koji; Kimura, Akio; Namatame, Hirofumi; Taniguchi, Masaki

    2013-03-01

    Spin- and angle-resolved photoelectron spectroscopy (SARPES) is the excellent tool which can directly observe the band structure of crystals with separating spin-up and -down states. Recent findings of new class of materials possessing strong spin orbit interaction such as Rashba spin splitting systems or topological insulators stimulate to develop new SARPES apparatuses and many sophisticated techniques have been reported recently. Here we report our newly developed a SARPES apparatus for spin vectorial analysis with high precision at Hiroshima Synchrotron Radiation Center. Highly efficient spin polarimeter utilizing very low energy electron diffraction (VLEED) makes high resolution (ΔE Japan Society for the Promotion of Science.

  6. Streaming tearing mode

    Science.gov (United States)

    Shigeta, M.; Sato, T.; Dasgupta, B.

    1985-01-01

    The magnetohydrodynamic stability of streaming tearing mode is investigated numerically. A bulk plasma flow parallel to the antiparallel magnetic field lines and localized in the neutral sheet excites a streaming tearing mode more strongly than the usual tearing mode, particularly for the wavelength of the order of the neutral sheet width (or smaller), which is stable for the usual tearing mode. Interestingly, examination of the eigenfunctions of the velocity perturbation and the magnetic field perturbation indicates that the streaming tearing mode carries more energy in terms of the kinetic energy rather than the magnetic energy. This suggests that the streaming tearing mode instability can be a more feasible mechanism of plasma acceleration than the usual tearing mode instability.

  7. Mode selection laser

    DEFF Research Database (Denmark)

    2014-01-01

    The invention relates to a semiconductor mode selection laser, particularly to a VCSEL laser (200) having mode selection properties. The mode selection capability of the laser is achieved by configuring one of the reflectors (15,51) in the resonance cavity so that a reflectivity of the reflector...... (15) varies spatially in one dimension or two dimensions. Accordingly, the reflector (15) with spatially varying reflectivity is part both of the resonance cavity and the mode selection functionality of the laser. A plurality of the lasers configured with different mode selectors, i.e. different...... spatial reflector variations, may be combined to generate a laser beam containing a plurality of orthogonal modes. The laser beam may be injected into a few- mode optical fiber, e.g. for the purpose of optical communication. The VCSEL may have intra-cavity contacts (31,37) and a Tunnel junction (33...

  8. Temperature-dependent Raman and ultraviolet photoelectron spectroscopy studies on phase transition behavior of VO{sub 2} films with M1 and M2 phases

    Energy Technology Data Exchange (ETDEWEB)

    Okimura, Kunio, E-mail: okifn@keyaki.cc.u-tokai.ac.jp; Hanis Azhan, Nurul [Graduate School of Engineering, Tokai University, Hiratsuka 259-1292 (Japan); Hajiri, Tetsuya [UVSOR Facility, Institute for Molecular Science, Okazaki 444-8585 (Japan); Graduate School of Engineering, Nagoya University, Nagoya 464-8603 (Japan); Kimura, Shin-ichi [UVSOR Facility, Institute for Molecular Science, Okazaki 444-8585 (Japan); Graduate School of Frontier Biosciences, Osaka University, Suita 565-0871 (Japan); Zaghrioui, Mustapha; Sakai, Joe [GREMAN, UMR 7347 CNRS, Université François Rabelais de Tours, Parc de Grandmont, 37200 Tours (France)

    2014-04-21

    Structural and electronic phase transitions behavior of two polycrystalline VO{sub 2} films, one with pure M1 phase and the other with pure M2 phase at room temperature, were investigated by temperature-controlled Raman spectroscopy and ultraviolet photoelectron spectroscopy (UPS). We observed characteristic transient dynamics in which the Raman modes at 195 cm{sup −1} (V-V vibration) and 616 cm{sup −1} (V-O vibration) showed remarkable hardening along the temperature in M1 phase film, indicating the rearrangements of V-V pairs and VO{sub 6} octahedra. It was also shown that the M1 Raman mode frequency approached those of invariant M2 peaks before entering rutile phase. In UPS spectra with high energy resolution of 0.03 eV for the M2 phase film, narrower V{sub 3d} band was observed together with smaller gap compared to those of M1 phase film, supporting the nature of Mott insulator of M2 phase even in the polycrystalline film. Cooperative behavior of lattice rearrangements and electronic phase transition was suggested for M1 phase film.

  9. [Real-time analysis of polyvinyl chloride thermal decomposition/combustion products with single photon ionization/photoelectron ionization online mass spectrometer].

    Science.gov (United States)

    Chen, Wen-Dong; Hou, Ke-Yong; Chen, Ping; Li, Fang-Long; Zhao, Wu-Duo; Cui, Hua-Peng; Hua, Lei; Xie, Yuan-Yuan; Li, Hai-Yang

    2013-01-01

    With the features of a broad range of ionizable compounds, reduced fragments and simple mass spectrum, a homemade magnetic field enhanced photoelectron ionization (MEPEI) source combined with single photon ionization (SPI) for time-of-flight mass spectrometer was built and applied to analyze thermal decomposition/combustion products of polyvinyl chloride (PVC). The combined ion source can be switched very fast between SPI mode and SPI-MEPEI mode for detecting different targeted compounds, and only adjusting the voltage of the electrode in the ionization region to trigger the switch. Among the PVC thermal decomposition/combustion products, HCl and CO2, which ionization energies (12.74 eV, 13.77 eV respectively) were higher than the energy of photon (10.60 eV), were ionized by MEPEI, while alkenes, dichloroethylene, benzene and its homologs, monochlorobenzene, styrene, indane, naphthalene and its homologs were ionized by SPI and MEPEI simultaneously. Spectra of interested products as a function of temperatures indicated that products are formed via two main mechanisms: (1) dechlorination and intramolecular cyclization can lead to the formation of HCl, benzene and naphthalene at 250-370 degrees C; (2) intermolecular crosslinking leads to the formation of alkyl aromatics such as toluene and xylene/ethylbenzene at 380-510 degrees C. The experimental results show that the combined ion source of SPI/ SPI-MEPEI for TOF-MS has broad application prospects in the online analysis field.

  10. In situ X-ray photoelectron spectroscopy study of complex oxides under gas and vacuum environments

    Science.gov (United States)

    Paloukis, F.; Papazisi, K. M.; Balomenou, S. P.; Tsiplakides, D.; Bournel, F.; Gallet, J.-J.; Zafeiratos, S.

    2017-11-01

    For several decades an open question in many X-ray photoelectron spectroscopy (XPS) studies was whether or not the results obtained in ultra-high vacuum conditions (UHV) were representative of the sample state in gas atmospheres. As a consequence, near ambient pressure X-ray photoelectron spectroscopy (NAP-XPS) was received by surface scientists as an important tool for in situ characterization of the gas-solid interactions. However, it is not yet clear how, if at all, the surface state formed in contact with the gas is modified when this gas is evacuated. In this work we compare synchrotron-based XPS results recorded at 300 °C on Ni/yttria- stabilized zirconia cermet and La0.75Sr0.25Cr0.9Fe0.1O3 perovskite, under 3.5 mbar O2 and UHV environments. We found that the surface state formed in O2 is maintained to a large extent under vacuum. In addition, we demonstrate that the correlation of XPS spectra recorded in the two conditions can provide information regarding the electrical conductivity of the specific surface sites of these complex oxides. Our findings suggest that comparison of XPS measurements in gas and in vacuum environments might be particularly useful in applications where the electronic conductivity at the surface plays a crucial role, as for example in solid oxide electrochemical devices.

  11. Photoelectron spectroscopy and thermochemistry of tert-butylisocyanide-substituted cobalt tricarbonyl nitrosyl.

    Science.gov (United States)

    Gengeliczki, Zsolt; Szepes, Laszló; Sztaray, Balint; Baer, Tomas

    2007-08-09

    A new organometallic complex, Co(CO)2NOtBuNC, was synthesized and investigated by photoelectron spectroscopy (PES) and threshold photoelectron photoion coincidence (TPEPICO) spectrometry in order to determine its ionization energy as well as the bond energies in the ionic forms. The assignment of the nine peaks in the PES was based on Kohn-Sham molecular orbital energies, and an adiabatic ionization energy of 7.30 +/- 0.05 eV was determined. In the TPEPICO experiment, the following 0 K onsets were determined for the various fragment ions: CoCONOtBuNC+ (8.17 +/- 0.05 eV); CoNOtBuNC+ (9.01 +/- 0.05 eV); and CotBuNC+ (10.42 +/- 0.05 eV). Because the photon source did not extend above 14 eV, we could not observe the bare Co+ ion in the experiment. The heat of formation of the CotBuNC+ ion was estimated by ab initio and DFT calculations of the CoL+ + tBuNC --> CotBuNC+ + L (L = CO, NO, NH3, H2O, PMe3) substitution enthalpies.

  12. Reactive ZnO/Ti/ZnO interfaces studied by hard x-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Knut, Ronny, E-mail: Ronny.Knut@physics.gu.se; Lindblad, Rebecka; Rensmo, Håkan; Karis, Olof [Department of Physics and Astronomy, Uppsala University, Box 516, 75120 Uppsala (Sweden); Grachev, Sergey; Faou, Jean-Yvon; Søndergård, Elin [Unité Mixte CNRS/Sain-Gobain Recherche, 39 Quai Lucien Lefranc, 93303 Aubervilliers (France); Gorgoi, Mihaela [Helmholtz-Zentrum Berlin für Materialien und Energie, Albert-Einstein-Str. 15, D-12489 Berlin (Germany)

    2014-01-28

    The chemistry and intermixing at buried interfaces in sputter deposited ZnO/Ti/ZnO thin layers were studied by hard x-ray photoelectron spectroscopy. The long mean free path of the photoelectrons allowed for detailed studies of the oxidation state, band bending effects, and intrinsic doping of the buried interfaces. Oxidation of the Ti layer was observed when ZnO was deposited on top. When Ti is deposited onto ZnO, Zn Auger peaks acquire a metallic character indicating a strong reduction of ZnO at the interface. Annealing of the stack at 200 °C results in further reduction of ZnO and oxidation of Ti. Above 300 °C, oxygen transport from the bulk of the ZnO layer takes place, leading to re-oxidation of ZnO at the interface and further oxidation of Ti layer. Heating above 500 °C leads to an intermixing of the layers and the formation of a Zn{sub x}TiO{sub y} compound.

  13. Ambipolar Electric Field, Photoelectrons, and Their Role in Atmospheric Escape From Hot Jupiters

    Science.gov (United States)

    Cohen, O.; Glocer, A.

    2012-01-01

    Atmospheric mass loss from Hot Jupiters can be large due to the close proximity of these planets to their host star and the strong radiation the planetary atmosphere receives. On Earth, a major contribution to the acceleration of atmospheric ions comes from the vertical separation of ions and electrons, and the generation of the ambipolar electric field. This process, known as the "polar wind," is responsible for the transport of ionospheric constituents to Earth's magnetosphere, where they are well observed. The polar wind can also be enhanced by a relatively small fraction of super-thermal electrons (photoelectrons) generated by photoionization.We formulate a simplified calculation of the effect of the ambipolar electric field and the photoelectrons on the ion scale height in a generalized manner. We find that the ion scale height can be increased by a factor of 2-15 due to the polar wind effects. We also estimate a lower limit of an order of magnitude increase of the ion density and the atmospheric mass-loss rate when polar wind effects are included.

  14. Electronic structures of melatonin and related compounds studied by photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Kubota, Mari. E-mail: marik@hc.cc.keio.ac.jp; Kobayashi, Tsunetoshi

    2003-02-01

    Melatonin is a hormone structurally regarded as being composed of a 5-methoxyindole group and an N-ethylacetamide group; its various physiological activities have attracted a great deal of attention recently. The gas phase He(I) photoelectron spectra of melatonin (M) and its related compounds including N-acetylserotonin have been studied with the aid of molecular orbital calculations. The first photoelectron spectral band group of compound M is ascribed to ionizations from the two {pi} orbitals localized on the methoxyindole group. The second band group is quite complicated and is regarded as being composed of several bands. The lower energy part of the second band group is ascribed to the three orbitals relevant to the third highest occupied {pi} orbital of 5-methoxyindole and the highest occupied {pi} and the n{sub C=0} orbitals of N-ethylacetamide. The interactions among the three orbitals have been found to operate on the basis of the molecular orbital calculations; these interactions depend strongly on the conformations. The high energy end of the second band group is relevant to the {pi} orbital mainly localized on the 5-methoxyindole group and is ascribed to the fourth highest occupied {pi} orbital of 5-methoxyindole.

  15. A high-resolution photoelectron imaging and theoretical study of CP- and C2P.

    Science.gov (United States)

    Czekner, Joseph; Cheung, Ling Fung; Johnson, Eric L; Fortenberry, Ryan C; Wang, Lai-Sheng

    2018-01-28

    The discovery of interstellar anions has been a milestone in astrochemistry. In the search for new interstellar anions, CP- and C2P- are viable candidates since their corresponding neutrals have already been detected astronomically. However, scarce data exist for these negatively charged species. Here we report the electron affinities of CP and C2P along with the vibrational frequencies of their anions using high-resolution photoelectron imaging. These results along with previous spectroscopic data of the neutral species are used further to benchmark very accurate quartic force field quantum chemical methods that are applied to CP, CP-, C2P, and two electronic states of C2P-. The predicted electron affinities, vibrational frequencies, and rotational constants are in excellent agreement with the experimental data. The electron affinities of CP (2.8508 ± 0.0007 eV) and C2P (2.6328 ± 0.0006 eV) are measured accurately and found to be quite high, suggesting that the CP- and C2P- anions are thermodynamically stable and possibly observable. The current study suggests that the combination of high-resolution photoelectron imaging and quantum chemistry can be used to determine accurate molecular constants for exotic radical species of astronomical interest.

  16. Post-mortem analysis of radiation grafted fuel cell membrane using X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Nasef, M. M. [Technological University PETRONAS, Chemical Engineering Program, Perak (Malaysia); Saidi, H. [Technological University of Malaysia, Membrane Research Unit, Kuala Lumpur (Malaysia)

    2002-07-01

    Post-mortem analysis of poly(tetrafluoroethylene-co-perfluorovinyl ether)-graft-polystyrene sulfonic acid (PFAS-g-PSSA) membrane was carried out at the end of a polymer electrolyte membrane (PEM) fuel cell test using X-ray photoelectron spectroscopy. The data obtained when the membrane was initially analyzed in its virgin state was used as a reference. Substantial structural changes were shown by the X-ray photoelectron spectroscopy, especially in terms of chemical composition and the concentration of its basic elemental components. The used membrane was found to have no sulfur and less oxygen compared to the virgin one, providing strong evidence for the complete elimination of the sulfonic acid groups from the membrane. Overall, the results suggests that membrane oxidative degradation during PEM fuel cell test is due to the decomposition of sulfonated polystyrene located in the hydrocarbon fraction. The chemical attack mostly occurs on the vulnerable tertiary hydrogen of the alpha-carbon causing a termination of the whole sulfonated polystyrene grafts. 22 refs., 7 figs.

  17. Structural studies of sputtered MOS(2) films by angle-resolved photoelectron spectroscopy

    Science.gov (United States)

    Fleischauer, P. D.; Tolentino, L. U.

    1984-09-01

    Molybdenum disulfide films were deposited by sputtering on both single-crystal molybdenite and steel substrates to assess the effects of varying preparation conditions on film properties. They were then examined by angle-resolved X-ray photoelectron spectroscopy, which provided information on the orientation of the layered crystal substrate, on the film layers immediately adjacent to the substrate (within 1-10 nm), and on thicker, macroscopic films composed of relatively large crystallites (approximately 70-200 nm). For the 4.3-nm-thick films deposited on the crystal's basal-plane surface, the angular dependence of the photoelectron emission is the same as the substrate's, indicating preferred orientation within such films. Angular distribution studies for thicker films on steel substrates are consistent with previous Auger electron spectroscopy results and confirm the presence of oxide films of different thickness of lubricant films with varying orientations. The angle-dependence data were fit to models that describe the structure and composition of the films' surfaces.

  18. Expansion dynamics of supercritical water probed by picosecond time-resolved photoelectron spectroscopy.

    Science.gov (United States)

    Gladytz, Thomas; Abel, Bernd; Siefermann, Katrin R

    2015-02-21

    Vibrational excitation of liquid water with femtosecond laser pulses can create extreme states of water. Yet, the dynamics directly after initial sub-picosecond delocalization of molecular vibrations remain largely unclear. We study the ultrafast expansion dynamics of an accordingly prepared supercritical water phase with a picosecond time resolution. Our experimental setup combines vacuum-compatible liquid micro-jet technology and a table top High Harmonic light source driven by a femtosecond laser system. An ultrashort laser pulse centered at a wavelength of 2900 nm excites the OH-stretch vibration of water molecules in the liquid. The deposited energy corresponds to a supercritical phase with a temperature of about 1000 K and a pressure of more than 1 GPa. We use a time-delayed extreme ultraviolet pulse centered at 38.6 eV, and obtained via High Harmonic generation (HHG), to record valence band photoelectron spectra of the expanding water sample. The series of photoelectron spectra is analyzed with noise-corrected target transform fitting (cTTF), a specifically developed multivariate method. Together with a simple fluid dynamics simulation, the following picture emerges: when a supercritical phase of water expands into vacuum, temperature and density of the first few nanometers of the expanding phase drop below the critical values within a few picoseconds. This results in a supersaturated phase, in which condensation seeds form and grow from small clusters to large clusters on a 100 picosecond timescale.

  19. High resolution surface scanning of Thick-GEM for single photo-electron detection

    Science.gov (United States)

    Hamar, G.; Varga, D.

    2012-12-01

    An optical system for high resolution scanning of TGEM UV photon detection systems is introduced. The structure exploits the combination of a single Au-coated TGEM under study, and an asymmetric MWPC (Close Cathode Chamber) as post-amplification stage. A pulsed UV LED source with emission down to 240 nm has been focused to a spot of 0.07 mm on the TGEM surface, and single photo-electron charge spectra has been recorded over selected two dimensional regions. This way, the TGEM gain (order of 10-100) and TGEM photo-electron detection efficiency is clearly separated, unlike in case of continuous illumination. The surface structure connected to the TGEM photon detection is well observable, including inefficiencies in the holes and at the symmetry points between holes. The detection efficiency as well as the gas gain are fluctuating from hole to hole. The gain is constant in the hexagon around any hole, pointing to the fact that the gain depends on hole geometry, and less on the position where the electron enters. The detection probability map strongly changes with the field strength above the TGEM surface, in relation to the change of the actual surface field configuration. The results can be confronted with position-dependent simulations of TGEM electron transfer and gas multiplication.

  20. Multi-reference approach to the calculation of photoelectron spectra including spin-orbit coupling

    CERN Document Server

    Grell, Gilbert; Winter, Bernd; Seidel, Robert; Aziz, Emad F; Aziz, Saadullah G; Kühn, Oliver

    2015-01-01

    X-ray photoelectron spectra provide a wealth of information on the electronic structure. The extraction of molecular details requires adequate theoretical methods, which in case of transition metal complexes has to account for effects due to the multi-configurational and spin-mixed nature of the many-electron wave function. Here, the Restricted Active Space Self-Consistent Field method including spin-orbit coupling is used to cope with this challenge and to calculate valence and core photoelectron spectra. The intensities are estimated within the frameworks of the Dyson orbital formalism and the sudden approximation. Thereby, we utilize an efficient computational algorithm that is based on a biorthonormal basis transformation. The approach is applied to the valence photoionization of the gas phase water molecule and to the core ionization spectrum of the $\\text{[Fe(H}_2\\text{O)}_6\\text{]}^{2+}$ complex. The results show good agreement with the experimental data obtained in this work, whereas the sudden approx...

  1. Interpretation of the photoelectron spectra of FeS(2)(-) by a multiconfiguration computational approach.

    Science.gov (United States)

    Clima, Sergiu; Hendrickx, Marc F A

    2007-11-01

    The ground states of FeS(2) and FeS(2)(-), and several low-lying excited electronic states of FeS(2) that are responsible for the FeS(2)(-) photoelectron spectrum, are calculated. At the B3LYP level an open, quasi-linear [SFeS](-) conformation is found as the most stable structure, which is confirmed at the ab initio CASPT2 computational level. Both the neutral and the anionic unsaturated complexes possess high-spin electronic ground states. For the first time a complete assignment of the photoelectron spectrum of FeS(2)(-) is proposed. The lowest energy band in this spectrum is ascribed to an electron detachment from the two highest-lying 3dpi antibonding orbitals (with respect to the iron-sulfur bonding) of iron. The next-lowest experimental band corresponds to an electron removal from nonbonding, nearly pure sulfur orbitals. The two highest bands in the spectra are assigned as electron detachments from pi and sigma bonding mainly sulfur orbitals.

  2. X-ray and photoelectron spectroscopy of the structure, reactivity, and electronic structure of semiconductor nanocrystals

    Energy Technology Data Exchange (ETDEWEB)

    Hamad, Kimberly Sue [Univ. of California, Berkeley, CA (United States)

    2000-01-01

    Semiconductor nanocrystals are a system which has been the focus of interest due to their size dependent properties and their possible use in technological applications. Many chemical and physical properties vary systematically with the size of the nanocrystal and thus their study enables the investigation of scaling laws. Due to the increasing surface to volume ratio as size is decreased, the surfaces of nanocrystals are expected to have a large influence on their electronic, thermodynamic, and chemical behavior. In spite of their importance, nanocrystal surfaces are still relatively uncharacterized in terms of their structure, electronic properties, bonding, and reactivity. Investigation of nanocrystal surfaces is currently limited by what techniques to use, and which methods are suitable for nanocrystals is still being determined. This work presents experiments using x-ray and electronic spectroscopies to explore the structure, reactivity, and electronic properties of semiconductor (CdSe, InAs) nanocrystals and how they vary with size. Specifically, x-ray absorption near edge spectroscopy (XANES) in conjunction with multiple scattering simulations affords information about the structural disorder present at the surface of the nanocrystal. X-ray photoelectron spectroscopy (XPS) and ultra-violet photoelectron spectroscopy (UPS) probe the electronic structure in terms of hole screening, and also give information about band lineups when the nanocrystal is placed in electric contact with a substrate. XPS of the core levels of the nanocrystal as a function of photo-oxidation time yields kinetic data on the oxidation reaction occurring at the surface of the nanocrystal.

  3. Quantitative spectromicroscopy from inelastically scattered photoelectrons in the hard X-ray range

    Energy Technology Data Exchange (ETDEWEB)

    Renault, O., E-mail: olivier.renault@cea.fr; Zborowski, C.; Risterucci, P. [Univ. Grenoble Alpes, F-38000 Grenoble, France and CEA, LETI, MINATEC Campus, F-38054 Grenoble (France); Wiemann, C.; Schneider, C. M. [Peter Grünberg Institute (PGI-6) and JARA-FIT, Research Center Jülich, D-52425 Jülich (Germany); Grenet, G. [Institut des Nanotechnologies de Lyon, Ecole Centrale, 69134 Ecully Cedex (France); Tougaard, S. [Department of Physics, Chemistry and Pharmacy, University of Southern Denmark, DK-5230 Odense M (Denmark)

    2016-07-04

    We demonstrate quantitative, highly bulk-sensitive x-ray photoelectron emission microscopy by analysis of inelastically scattered photoelectrons in the hard X-ray range, enabling elemental depth distribution analysis in deeply buried layers. We show results on patterned structures used in electrical testing of high electron mobility power transistor devices with an epitaxial Al{sub 0.25}Ga{sub 0.75}N channel and a Ti/Al metal contact. From the image series taken over an energy range of up to 120 eV in the Ti 1s loss feature region and over a typical 100 μm field of view, one can accurately retrieve, using background analysis together with an optimized scattering cross-section, the Ti depth distribution from 14 nm up to 25 nm below the surface. The method paves the way to multi-elemental, bulk-sensitive 3D imaging and investigation of phenomena at deeply buried interfaces and microscopic scales by photoemission.

  4. X-ray photoelectron spectroscopy of graphitic carbon nanomaterials doped with heteroatoms.

    Science.gov (United States)

    Susi, Toma; Pichler, Thomas; Ayala, Paola

    2015-01-01

    X-ray photoelectron spectroscopy (XPS) is one of the best tools for studying the chemical modification of surfaces, and in particular the distribution and bonding of heteroatom dopants in carbon nanomaterials such as graphene and carbon nanotubes. Although these materials have superb intrinsic properties, these often need to be modified in a controlled way for specific applications. Towards this aim, the most studied dopants are neighbors to carbon in the periodic table, nitrogen and boron, with phosphorus starting to emerge as an interesting new alternative. Hundreds of studies have used XPS for analyzing the concentration and bonding of dopants in various materials. Although the majority of works has concentrated on nitrogen, important work is still ongoing to identify its precise atomic bonding configurations. In general, care should be taken in the preparation of a suitable sample, consideration of the intrinsic photoemission response of the material in question, and the appropriate spectral analysis. If this is not the case, incorrect conclusions can easily be drawn, especially in the assignment of measured binding energies into specific atomic configurations. Starting from the characteristics of pristine materials, this review provides a practical guide for interpreting X-ray photoelectron spectra of doped graphitic carbon nanomaterials, and a reference for their binding energies that are vital for compositional analysis via XPS.

  5. Electronic structures of melatonin and related compounds studied by photoelectron spectroscopy

    CERN Document Server

    Kubota, M

    2003-01-01

    Melatonin is a hormone structurally regarded as being composed of a 5-methoxyindole group and an N-ethylacetamide group; its various physiological activities have attracted a great deal of attention recently. The gas phase He(I) photoelectron spectra of melatonin (M) and its related compounds including N-acetylserotonin have been studied with the aid of molecular orbital calculations. The first photoelectron spectral band group of compound M is ascribed to ionizations from the two pi orbitals localized on the methoxyindole group. The second band group is quite complicated and is regarded as being composed of several bands. The lower energy part of the second band group is ascribed to the three orbitals relevant to the third highest occupied pi orbital of 5-methoxyindole and the highest occupied pi and the n sub C sub = sub 0 orbitals of N-ethylacetamide. The interactions among the three orbitals have been found to operate on the basis of the molecular orbital calculations; these interactions depend strongly o...

  6. X-ray photoelectron spectroscopy of graphitic carbon nanomaterials doped with heteroatoms

    Directory of Open Access Journals (Sweden)

    Toma Susi

    2015-01-01

    Full Text Available X-ray photoelectron spectroscopy (XPS is one of the best tools for studying the chemical modification of surfaces, and in particular the distribution and bonding of heteroatom dopants in carbon nanomaterials such as graphene and carbon nanotubes. Although these materials have superb intrinsic properties, these often need to be modified in a controlled way for specific applications. Towards this aim, the most studied dopants are neighbors to carbon in the periodic table, nitrogen and boron, with phosphorus starting to emerge as an interesting new alternative. Hundreds of studies have used XPS for analyzing the concentration and bonding of dopants in various materials. Although the majority of works has concentrated on nitrogen, important work is still ongoing to identify its precise atomic bonding configurations. In general, care should be taken in the preparation of a suitable sample, consideration of the intrinsic photoemission response of the material in question, and the appropriate spectral analysis. If this is not the case, incorrect conclusions can easily be drawn, especially in the assignment of measured binding energies into specific atomic configurations. Starting from the characteristics of pristine materials, this review provides a practical guide for interpreting X-ray photoelectron spectra of doped graphitic carbon nanomaterials, and a reference for their binding energies that are vital for compositional analysis via XPS.

  7. Dual-Mode Combustor

    Science.gov (United States)

    Trefny, Charles J (Inventor); Dippold, Vance F (Inventor)

    2013-01-01

    A new dual-mode ramjet combustor used for operation over a wide flight Mach number range is described. Subsonic combustion mode is usable to lower flight Mach numbers than current dual-mode scramjets. High speed mode is characterized by supersonic combustion in a free-jet that traverses the subsonic combustion chamber to a variable nozzle throat. Although a variable combustor exit aperture is required, the need for fuel staging to accommodate the combustion process is eliminated. Local heating from shock-boundary-layer interactions on combustor walls is also eliminated.

  8. Electron band bending and surface sensitivity: X-ray photoelectron spectroscopy of polar GaN surfaces

    Science.gov (United States)

    Bartoš, I.; Romanyuk, O.; Paskova, T.; Jiříček, P.

    2017-10-01

    The role of electron band bending and surface sensitivity in determining the core level binding energies by X-ray photoelectron spectroscopy is investigated. A dominating contribution of surface atomic layers to photoemission intensity is confirmed for normal photoemission. The energy of the photoelectron core level peak does not deviate from core level peak energies of electrons photoemitted from the surface atomic layers of the crystal. The higher surface sensitivity regime, achieved e.g. at off-normal photoelectron detection angle, can be used to study the surface potential barrier in just a few topmost atomic layers. In addition, it is demonstrated that core level binding energy measured by angle-resolved X-ray photoelectron spectroscopy reflect the electron attenuation anisotropy. In particular, core level binding energy changes with emission angle and correlates with the forward focusing directions in a crystal. This effect is demonstrated by measuring the polar angle dependence of Ga 3d core levels on clean GaN(0001) and GaN(000 1 bar) surfaces with a higher and a lower band bending, respectively. The effect is explained by variation of emission depth in a crystal for normal and off-normal photoelectron emission angles.

  9. Vibronic coupling in the superoxide anion: the vibrational dependence of the photoelectron angular distribution.

    Science.gov (United States)

    Van Duzor, Matthew; Mbaiwa, Foster; Wei, Jie; Singh, Tulsi; Mabbs, Richard; Sanov, Andrei; Cavanagh, Steven J; Gibson, Stephen T; Lewis, Brenton R; Gascooke, Jason R

    2010-11-07

    We present a comprehensive photoelectron imaging study of the O(2)(X  (3)Σ(g)(-),v(')=0-6)←O(2)(-)(X  (2)Π(g),v(")=0) and O(2)(a (1)Δ(g),v(')=0-4)←O(2)(-)(X  (2)Π(g),v(")=0) photodetachment bands at wavelengths between 900 and 455 nm, examining the effect of vibronic coupling on the photoelectron angular distribution (PAD). This work extends the v(')=1-4 data for detachment into the ground electronic state, presented in a recent communication [R. Mabbs, F. Mbaiwa, J. Wei, M. Van Duzor, S. T. Gibson, S. J. Cavanagh, and B. R. Lewis, Phys. Rev. A 82, 011401(R) (2010)]. Measured vibronic intensities are compared to Franck-Condon predictions and used as supporting evidence of vibronic coupling. The results are analyzed within the context of the one-electron, zero core contribution (ZCC) model [R. M. Stehman and S. B. Woo, Phys. Rev. A 23, 2866 (1981)]. For both bands, the photoelectron anisotropy parameter variation with electron kinetic energy, β(E), displays the characteristics of photodetachment from a d-like orbital, consistent with the π(g)(∗) 2p highest occupied molecular orbital of O(2)(-). However, differences exist between the β(E) trends for detachment into different vibrational levels of the X  (3)Σ(g)(-) and a (1)Δ(g) electronic states of O(2). The ZCC model invokes vibrational channel specific "detachment orbitals" and attributes this behavior to coupling of the electronic and nuclear motion in the parent anion. The spatial extent of the model detachment orbital is dependent on the final state of O(2): the higher the neutral vibrational excitation, the larger the electron binding energy. Although vibronic coupling is ignored in most theoretical treatments of PADs in the direct photodetachment of molecular anions, the present findings clearly show that it can be important. These results represent a benchmark data set for a relatively simple system, upon which to base rigorous tests of more sophisticated models.

  10. Investigating Surface and Interface Phenomena in LiFeBO3 Electrodes Using Photoelectron Spectroscopy Depth Profiling

    DEFF Research Database (Denmark)

    Maibach, Julia; Younesi, Reza; Schwarzburger, Nele

    2014-01-01

    The formation of surface and interface layers at the electrodes is highly important for the performance and stability of lithium ion batteries. To unravel the surface composition of electrode materials, photoelectron spectroscopy (PES) is highly suitable as it probes chemical surface and interface...... properties with high surface sensitivity. Additionally, by using synchrotron-generated hard x-rays as excitation source, larger probing depths compared to in-house PES can be achieved. Therefore, the combination of in-house soft x-ray photoelectron spectroscopy and hard x-ray photoelectron spectroscopy...... (HAXPES) enables reliable and non-destructive depth profiling. Thus, detailed investigation of compositional gradients at electrode surfaces and interfaces from a sub-monolayer to several nanometer length scales can be performed. As this depth region is especially relevant for both electronic and ionic...

  11. Electronic structure simulation of chromium aluminum oxynitride by discrete variational-X alpha method and X-ray photoelectron spectroscopy

    CERN Document Server

    Choi, Y; Lee, J D; Kim, E; No, K

    2002-01-01

    We use a first-principles discrete variational (DV)-X alpha method to investigate the electronic structure of chromium aluminum oxynitride. When nitrogen is substituted for oxygen in the Cr-Al-O system, the N2p level appears in the energy range between O2p and Cr3d levels. Consequently, the valence band of chromium aluminum oxynitride becomes broader and the band gap becomes smaller than that of chromium aluminum oxide, which is consistent with the photoelectron spectra for the valence band using X-ray photoelectron spectroscopy (XPS) and ultraviolet photoelectron spectroscopy (UPS). We expect that this valence band structure of chromium aluminum oxynitride will modify the transmittance slope which is a requirement for photomask application.

  12. Microbubble Surface Modes

    NARCIS (Netherlands)

    Versluis, Michel; Palanchon, P.; Goertz, D.; van der Meer, S.M.; Chin, C.T.; Lohse, Detlef; de Jong, N.

    2004-01-01

    We have investigated surface vibrations generated by ultrasound excitation of individual unencapsulated micron-sized bubbles. In addition, we present surface modes (n=2 and 3) observed for phospholipid-coated ultrasound contrast agents excited through excitation of radial modes at frequencies

  13. Mode decomposition evolution equations.

    Science.gov (United States)

    Wang, Yang; Wei, Guo-Wei; Yang, Siyang

    2012-03-01

    Partial differential equation (PDE) based methods have become some of the most powerful tools for exploring the fundamental problems in signal processing, image processing, computer vision, machine vision and artificial intelligence in the past two decades. The advantages of PDE based approaches are that they can be made fully automatic, robust for the analysis of images, videos and high dimensional data. A fundamental question is whether one can use PDEs to perform all the basic tasks in the image processing. If one can devise PDEs to perform full-scale mode decomposition for signals and images, the modes thus generated would be very useful for secondary processing to meet the needs in various types of signal and image processing. Despite of great progress in PDE based image analysis in the past two decades, the basic roles of PDEs in image/signal analysis are only limited to PDE based low-pass filters, and their applications to noise removal, edge detection, segmentation, etc. At present, it is not clear how to construct PDE based methods for full-scale mode decomposition. The above-mentioned limitation of most current PDE based image/signal processing methods is addressed in the proposed work, in which we introduce a family of mode decomposition evolution equations (MoDEEs) for a vast variety of applications. The MoDEEs are constructed as an extension of a PDE based high-pass filter (Europhys. Lett., 59(6): 814, 2002) by using arbitrarily high order PDE based low-pass filters introduced by Wei (IEEE Signal Process. Lett., 6(7): 165, 1999). The use of arbitrarily high order PDEs is essential to the frequency localization in the mode decomposition. Similar to the wavelet transform, the present MoDEEs have a controllable time-frequency localization and allow a perfect reconstruction of the original function. Therefore, the MoDEE operation is also called a PDE transform. However, modes generated from the present approach are in the spatial or time domain and can be

  14. Shaft mode shape demonstration

    Science.gov (United States)

    Grissom, R.

    1985-01-01

    The dynamic response of a rotating machine is directly influenced by its geometric configuration and all aspects of the rotor construction. These determine two significant parameters, mass distribution and stiffness, which yield a spectrum of natural frequencies and mode shapes. The mode shapes can be presented as snapshots of the characteristic amplitude/phase reponse patterns of the shaft, due to the major forcing function of unbalance, at different rotative speeds. To demonstrate the three shaft mode shapes of the rotor rig using the Shaft Mode Demonstrator and oscilloscopes. The synchronous (1X) amplitude and phase of the rotor vibration in the vertical direction from several points along the shaft is displayed on corresponding points of the demonstrator. Unfiltered vibration from vertical and horizontal probe pairs is displayed on the oscilloscopes in orbit format for a dynamic presentation of the mode shape.

  15. Higher Order Mode Fibers

    DEFF Research Database (Denmark)

    Israelsen, Stine Møller

    This PhD thesis considers higher order modes (HOMs) in optical fibers. That includes their excitation and characteristics. Within the last decades, HOMs have been applied both for space multiplexing in optical communications, group velocity dispersion management and sensing among others....... The research presented in this thesis falls in three parts. In the first part, a first time demonstration of the break of the azimuthal symmetry of the Bessel-like LP0X modes is presented. This effect, known as the bowtie effect, causes the mode to have an azimuthal dependence as well as a quasi......-radial polarization as opposed to the linear polarization of the LP0X modes. The effect is investigated numerically in a double cladding fiber with an outer aircladding using a full vectorial modesolver. Experimentally, the bowtie modes are excited using a long period grating and their free space characteristics...

  16. Pseudo-bimolecular [2+2] cycloaddition studied by time-resolved photoelectron spectroscopy

    DEFF Research Database (Denmark)

    Brogaard, Rasmus Y; Boguslavskiy, Andrey E; Schalk, Oliver

    2011-01-01

    The first study of pseudo-bimolecular cycloaddition reaction dynamics in the gas phase is presented. We used femtosecond time-resolved photoelectron spectroscopy (TRPES) to study the [2+2] photocycloaddition in the model system pseudo-gem-divinyl[2.2]paracyclophane. From X-ray crystal diffraction...... measurements we found that the ground-state molecule can exist in two conformers; a reactive one in which the vinyl groups are immediately situated for [2+2] cycloaddition and a nonreactive conformer in which they point in opposite directions. From the measured S(1) lifetimes we assigned a clear relation...... between the conformation and the excited-state reactivity; the reactive conformer has a lifetime of 13 ps, populating the ground state through a conical intersection leading to [2+2] cycloaddition, whereas the nonreactive conformer has a lifetime of 400 ps. Ab initio calculations were performed to locate...

  17. Thermal oxidation of vanadium-free Ti alloys: An X-ray photoelectron spectroscopy study

    Energy Technology Data Exchange (ETDEWEB)

    Lopez, Maria Francisca, E-mail: mflopez@icmm.csic.es [Department of Surfaces and Coatings, ICMM-CSIC, Sor Juana Ines de la Cruz, 3, Cantoblanco, 28049 Madrid (Spain); Gutierrez, Alejandro [Departamento de Fisica Aplicada and Instituto Nicolas Cabrera, Universidad Autonoma de Madrid, Cantoblanco, E-28049 Madrid (Spain); Jimenez, Jose Antonio [Centro Nacional de Investigaciones Metalurgicas, CSIC, Avda. Gregorio del Amo 8, E-28040 Madrid (Spain); Martinesi, Maria; Stio, Maria; Treves, Cristina [Department of Biochemical Sciences of University of Florence, Viale Morgagni 50, 50134 Florence (Italy)

    2010-04-06

    In the present work, X-ray photoelectron spectroscopy (XPS) was used to study the surface chemical composition of three alloys for biomedical applications: Ti-7Nb-6Al, Ti-13Nb-13Zr and Ti-15Zr-4Nb. The surface of these alloys was modified by annealing in air at 750 deg. C for different times with the aim of developing an oxide thick layer on top. The evolution of surface composition with annealing time was studied by XPS, and compared with the composition of the native oxide layer present on the samples before annealing. Two different oxidation trends were observed depending on the alloying elements and their corresponding diffusion kinetics, which give rise to different chemical species at the topmost layers. These results were linked with an evaluation of the biological response of the alloys by bringing them in contact with human peripheral blood mononuclear cells (PBMC).

  18. Optical and x-ray photoelectron spectroscopy studies of α-Al2O3

    Science.gov (United States)

    Prakash, Ram; Kumar, Sandeep; Kumar, Vinay; Choudhary, R. J.; Phase, D. M.

    2016-05-01

    α-Al2O3 powder sample was synthesized at 550 °C via solution combustion synthesis (SCS) method using urea as an organic fuel. The sample was characterized by X-ray diffraction (XRD), Optical spectroscopy and X-ray photoelectron spectroscopy (XPS) without any further thermal treatment. XRD study reveals that the powder crystallized directly in the hexagons α-Al2O3 phase. A band gap of 5.7 eV was estimated using diffuse reflectance spectra. For surface investigation X-ray photo electron spectroscopy (XPS) was carried out. The XPS survey scan study of α-Al2O3 powder reveals that the sample is free from impurity. The core levels of Al-2s and O-1s are also reported.

  19. FAST TRACK COMMUNICATION: Origin of species dependence of high-energy plateau photoelectron spectra

    Science.gov (United States)

    Chen, Zhangjin; Le, Anh-Thu; Morishita, Toru; Lin, C. D.

    2009-03-01

    We analysed the energy and momentum distributions of high-energy 'plateau' photoelectrons. These electrons, with energies above 4Up (Up is the ponderomotive energy), have been understood qualitatively as due to the backscattering of laser-induced returning electrons by the target ion. Here, we establish a quantitative rescattering (QRS) theory to show that the species and laser-intensity dependence of the 'flatness' of the plateau electrons is entirely determined by the energy and angular dependence of the elastic scattering cross sections between target ions with free electrons. This accurate QRS theory can be used to obtain energy and momentum distributions of plateau electrons without the need of solving the time-dependent Schrödinger equation.

  20. Origin of species dependence of high-energy plateau photoelectron spectra

    Energy Technology Data Exchange (ETDEWEB)

    Chen Zhangjin; Le, A-T; Lin, C D [J R Macdonald Laboratory, Physics Department, Kansas State University, Manhattan, KS 66506-2604 (United States); Morishita, Toru [Department of Applied Physics and Chemistry, University of Electro-Communications, 1-5-1 Chofu-ga-oka, Chofu-shi, Tokyo 182-8585 (Japan)

    2009-03-28

    We analysed the energy and momentum distributions of high-energy 'plateau' photoelectrons. These electrons, with energies above 4U{sub p} (U{sub p} is the ponderomotive energy), have been understood qualitatively as due to the backscattering of laser-induced returning electrons by the target ion. Here, we establish a quantitative rescattering (QRS) theory to show that the species and laser-intensity dependence of the 'flatness' of the plateau electrons is entirely determined by the energy and angular dependence of the elastic scattering cross sections between target ions with free electrons. This accurate QRS theory can be used to obtain energy and momentum distributions of plateau electrons without the need of solving the time-dependent Schroedinger equation. (fast track communication)

  1. X-ray photoelectron spectroscopic analysis of rice kernels and flours: Measurement of surface chemical composition.

    Science.gov (United States)

    Nawaz, Malik A; Gaiani, Claire; Fukai, Shu; Bhandari, Bhesh

    2016-12-01

    The objectives of this study were to evaluate the ability of X-ray photoelectron spectroscopy (XPS) to differentiate rice macromolecules and to calculate the surface composition of rice kernels and flours. The uncooked kernels and flours surface composition of the two selected rice varieties, Thadokkham-11 (TDK11) and Doongara (DG) demonstrated an over-expression of lipids and proteins and an under-expression of starch compared to the bulk composition. The results of the study showed that XPS was able to differentiate rice polysaccharides (mainly starch), proteins and lipids in uncooked rice kernels and flours. Nevertheless, it was unable to distinguish components in cooked rice samples possibly due to complex interactions between gelatinized starch, denatured proteins and lipids. High resolution imaging methods (Scanning Electron Microscopy and Confocal Laser Scanning Microscopy) were employed to obtain complementary information about the properties and location of starch, proteins and lipids in rice kernels and flours. Copyright © 2016. Published by Elsevier Ltd.

  2. Double photo-electron momentum spectra of Helium at infrared wavelength

    CERN Document Server

    Zielinski, Alejandro; Scrinzi, Armin

    2015-01-01

    Double photo-electron momentum spectra of the Helium atom are calculated \\textit{ab initio} at extreme ultra-violet and near infrared wavelengths. At short wavelengths two-photon double ionization yields, two-electron energy spectra, and triply differential cross sections agree with results from recent literature. At the near infrared wavelength of $780\\,nm$ the experimental single-to-double ionization ratio is reproduced up to intensities of $4\\times 10^{14}W/cm^2$, and two-electron energy spectra and joint angular distributions are presented. The time-dependent surface flux (tSurff) approach is extended to full 3+3 spatial dimensions and systematic error control is demonstrated. We analyze our differential spectra in terms of an experimentally accessible quantitative measure of correlation.

  3. The parent anion of the RGD tripeptide: Photoelectron spectroscopy and quantum chemistry calculations

    Science.gov (United States)

    Li, Xiang; Wang, Haopeng; Bowen, Kit H.; Grégoire, G.; Lecomte, F.; Schermann, Jean-Pierre; Desfrançois, Charles

    2009-06-01

    The gas-phase conformation of the intact (parent) unprotected RGD- peptide anion has been investigated using a combination of anion photoelectron spectroscopy and quantum chemistry calculations of its low-energy stable structures. The experimentally observed RGD- species correspond to a conformation in which the guanidinium group is protonated, the C-terminus is neutral, the aspartic acid carboxyl is deprotonated, and the anion's excess electron orbital is localized on the protonated guanidinium. This structure is reminiscent of the RGD loop, which is the peptide motif recognized by trans-membrane integrins. The parent RGD- radical anion was generated using a unique infrared desorption-photoemission-helium jet ion source, whose ability to produce radical anions of peptides may also have analytical mass spectrometric implications.

  4. Electrostatic immobilization of polyoxometallates on silicon: X-ray Photoelectron Spectroscopy and electrochemical studies

    Energy Technology Data Exchange (ETDEWEB)

    Fleury, Benoit [INAC/LCIB/RICC (UMR E3 CEA-UJF, FRE CNRS 3200), CEA-Grenoble 17 rue des martyrs, 38054 Grenoble cedex 9 (France); Billon, Martial [INAC/SPrAM/CREAB (UMR 5819 CEA-CNRS-UJF), CEA-Grenoble 17 rue des martyrs, 38054 Grenoble cedex 9 (France); Duclairoir, Florence, E-mail: florence.duclairoir@cea.f [INAC/LCIB/RICC (UMR E3 CEA-UJF, FRE CNRS 3200), CEA-Grenoble 17 rue des martyrs, 38054 Grenoble cedex 9 (France); Dubois, Lionel [INAC/LCIB/RICC (UMR E3 CEA-UJF, FRE CNRS 3200), CEA-Grenoble 17 rue des martyrs, 38054 Grenoble cedex 9 (France); Fanton, Aurelien [LETI/DPTS/SCPIO/LCPO, CEA-Grenoble 17 rue des martyrs, 38054 Grenoble cedex 9 (France); Bidan, Gerard [INAC/DIR, CEA-Grenoble 17 rue des martyrs, 38054 Grenoble cedex 9 (France)

    2011-03-31

    Keggin-type dodecatungstosilicates polyoxometallates (POMs) ([SiW{sub 12}O{sub 40}]{sup 4-}) were immobilized in a straightforward manner by electrostatic interactions on ammonium layers covalently grafted on silicon. This method does not require any POM modification synthetical steps. The presence of [SiW{sub 12}O{sub 40}]{sup 4-} on the surface is demonstrated by X-ray Photoelectron Spectroscopy from a specific modification of the tungsten 4f{sub 7/2} signal. Moreover the surface coverage of [SiW{sub 12}O{sub 40}]{sup 4-} has been improved by 35% upon changing the nature of the anchoring ammonium groups from protonated to methylated amino groups. The organic-inorganic composite films have also been characterized by cyclic voltammetry showing that POMs have a specific behavior on silicon surfaces. In addition the use of a polyallylamine capping layer proved to stabilize efficiently the POM electrochemical response.

  5. Materials characterization by photoelectron spectroscopy; Caracterizacao de materiais por espectroscopia de fotoeletrons

    Energy Technology Data Exchange (ETDEWEB)

    Nascente, P.A.P., E-mail: nascente@ufscar.b [Universidade Federal de Sao Carlos (DEMa/UFSCar), SP (Brazil). Dept. de Engenharia de Materiais

    2010-07-01

    Low energy electrons are suitable for investigating surfaces due to their low mean free path in solids, which correspond to a few atomic layers (0.5 to 3.0 nm), and could be used in one of the following ways: incident electrons cause the emission of backscattered and secondary electrons and the electrons are excited by irradiated photons. The first case includes the emission of Auger electrons, while photoemission corresponds to the second case. X-ray photoelectron spectroscopy (XPS) is one of the most used surface analysis techniques since it is able to identify not only the surface constituents but also their chemical states. XPS can be employed in several areas of science and engineering, but in this report it will be presented only few examples of its use in the characterization of metallic materials, with an emphasis on thin films of noble and transition metals. (author)

  6. Functional materials for information and energy technology: Insights by photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Müller, Martina [Peter Grünberg Institut (PGI-6), Forschungszentrum Jülich, 52425 Jülich (Germany); JARA Jülich-Aachen Research Alliance, Forschungszentrum Jülich, 52425 Jülich (Germany); Fakultät für Physik, Universität Duisburg-Essen, 47048 Duisburg (Germany); Nemšák, Slavomír; Plucinski, Lukasz [Peter Grünberg Institut (PGI-6), Forschungszentrum Jülich, 52425 Jülich (Germany); JARA Jülich-Aachen Research Alliance, Forschungszentrum Jülich, 52425 Jülich (Germany); Schneider, Claus M., E-mail: c.m.schneider@fz-juelich.de [Peter Grünberg Institut (PGI-6), Forschungszentrum Jülich, 52425 Jülich (Germany); JARA Jülich-Aachen Research Alliance, Forschungszentrum Jülich, 52425 Jülich (Germany); Fakultät für Physik, Universität Duisburg-Essen, 47048 Duisburg (Germany)

    2016-04-15

    Highlights: • Photoemission spectro/microscopy studies of functional material systems. • Hard X-ray photoemission spectroscopy from magnetic semiconductors and insulators. • Information depth studies in hard X-ray photoemission microscopy. • Soft X-ray standing wave ambient pressure photoemission spectroscopy from liquid films. - Abstract: The evolution of both information and energy technology is intimately connected to complex condensed matter systems, the properties of which are determined by electronic and chemical interactions and processes on a broad range of length and time scales. Dedicated photoelectron spectroscopy and spectromicroscopy experiments can provide important insights into fundamental phenomena and applied functionalities. We discuss some recent methodological developments with application to relevant questions in spintronics, and towards operando studies of resistive switching and electrochemical processes.

  7. Multielectron effects in strong-field ionization of CO2: Impact on differential photoelectron spectra

    Science.gov (United States)

    Majety, Vinay Pramod; Scrinzi, Armin

    2017-11-01

    We report fully differential photoelectron spectra from an ab initio coupled-channels treatment of CO2. Photoionization by laser pulses centered at wavelengths of 400 and 800 nm is considered, with arbitrary molecular alignment and polarization (linear and elliptic). Calculations reveal significant excited-state channel contributions that are, at certain molecular orientations, an order of magnitude larger than the ground-state channel in the rescattering plateau. A partial washout of the multiphoton structure in the above threshold ionization spectra and of the nodal features in angle-resolved spectra is observed due to ionization to excited-state channels. The qualitative nature of the spectra is determined by ionization thresholds, orbital symmetries, and interchannel coupling, in order of precedence.

  8. Quantum coherent control of the photoelectron angular distribution in bichromatic-field ionization of atomic neon

    Science.gov (United States)

    Gryzlova, E. V.; Grum-Grzhimailo, A. N.; Staroselskaya, E. I.; Douguet, N.; Bartschat, K.

    2018-01-01

    We investigate the coherent control of the photoelectron angular distribution in bichromatic atomic ionization. Neon is selected as target since it is one of the most popular systems in current gas-phase experiments with free-electron lasers (FELSs). In particular, we tackle practical questions, such as the role of the fine-structure splitting, the pulse length, and the intensity. Time-dependent and stationary perturbation theory are employed, and we also solve the time-dependent Schrödinger equation in a single-active electron model. We consider neon ionized by a FEL pulse whose fundamental frequency is in resonance with either 2 p -3 s or 2 p -4 s excitation. The contribution of the nonresonant two-photon process and its potential constructive or destructive role for quantum coherent control is investigated.

  9. Room temperature oxidation kinetics of Si nanoparticles in air, determined by x-ray photoelectron spectroscopy

    Science.gov (United States)

    Yang, D.-Q.; Gillet, Jean-Numa; Meunier, M.; Sacher, E.

    2005-01-01

    The air oxidation kinetics of low coverages of ˜5nm Si nanoparticles, deposited by pulsed excimer laser ablation (KrF, 248 nm) in He, have been characterized by x-ray photoelectron spectroscopy. A simple model, based on the evolution of the Si 2p spectral components during oxidation, has been developed to determine the nanoparticle oxide thickness. It is found that the short-term oxide thickness is greater, and the long-term room-temperature air oxidization rate of these nanoparticles is less, than those reported for bulk a-Si and c-Si. The results are also consistent with an earlier transmission electron microscope observation of the oxidation of larger Si particles at higher temperatures. The greater short-term oxide thickness may be attributed to surface defects on the prepared Si nanoparticles, and lower long-term oxidation rate is due to the nonlinear decrease of oxygen diffusion in spherical systems.

  10. Photoelectron spectroscopy of hexachloroplatinate-nucleobase complexes: Nucleobase excited state decay observed via delayed electron emission

    Science.gov (United States)

    Sen, Ananya; Matthews, Edward M.; Hou, Gao-Lei; Wang, Xue-Bin; Dessent, Caroline E. H.

    2015-11-01

    We report low-temperature photoelectron spectra of isolated gas-phase complexes of the hexachloroplatinate dianion bound to the nucleobases uracil, thymine, cytosine, and adenine. The spectra display well-resolved, distinct peaks that are consistent with complexes where the hexachloroplatinate dianion is largely intact. Adiabatic electron detachment energies for the hexachloroplatinate-nucleobase complexes are measured as 2.26-2.36 eV. The magnitudes of the repulsive Coulomb barriers (RCBs) of the complexes are all ˜1.7 eV, values that are lower than the RCB of the uncomplexed PtCl62- dianion as a result of charge solvation by the nucleobases. In addition to the resolved spectral features, broad featureless bands indicative of delayed electron detachment are observed in the 193 nm photoelectron spectra of the four clusters. The 266 nm spectra of the PtCl62- ṡ thymine and PtCl62- ṡ adenine complexes also display very prominent delayed electron emission bands. These results mirror recent results on the related Pt(CN)42- ṡ nucleobase complexes [A. Sen et al., J. Phys. Chem. B 119, 11626 (2015)]. The observation of delayed electron emission bands in the PtCl62- ṡ nucleobase spectra obtained in this work, as for the previously studied Pt(CN)42- ṡ nucleobase complexes, is attributed to one-photon excitation of nucleobase-centred excited states that can effectively couple to the electron detachment continuum, producing strong electron detachment. Moreover, the selective, strong excitation of the delayed emission bands in the 266 nm spectra is linked to fundamental differences in the individual nucleobase photophysics at this excitation energy. This strongly supports our previous suggestion that the dianion within these clusters can be viewed as a "dynamic tag" which has the propensity to emit electrons when the attached nucleobase decays over a time scale long enough to allow autodetachment.

  11. Study of radicals, clusters and transition state species by anion photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Arnold, Don Wesley [Univ. of California, Berkeley, CA (United States)

    1994-08-01

    Free radicals, elemental and van der Waals clusters and transition state species for bimolecular chemical reactions are investigated using anion photoelectron spectroscopy. Several low-lying electronic states of ozone have been identified via photoelectron spectroscopy of O3-. A characterization of these states is important to models for atmospheric ozone reaction kinetics. The fluoroformyloxyl radical, FCO2, has been investigated, providing vibrational frequencies and energies for two electronic states. The technique has also been employed to make the first direct observation and characterization of the NNO2 molecule. Several electronic states are observed for this species which is believed to play a role as a reactive intermediate in the N + NO2 reaction. The experimental results for all three of these radicals are supplemented by ab initio investigations of their molecular properties. The clusters investigations include studies of elemental carbon clusters (C2- - C11-), and van der Waals clusters (X-(CO2)n, X = I, Br, Cl; n {le} 13 and I- (N2O)n=1--11). Primarily linear clusters are observed for the smaller carbon clusters, while the spectra of the larger clusters contain contribution from cyclic anion photodetachment. Very interesting ion-solvent interactions are observed in the X-(CO2)n clusters. The transition state regions for several bimolecular chemical reactions have also been investigated by photodetachment of a negative ion precursor possessing a geometry similar to that of the transition state species. These spectra show features which are assigned to motions of the unstable neutral complex existing between reactants and products.

  12. What can we Learn on Gas Phase Chiral Compounds by Photoelectron Circular Dichroism ?

    Science.gov (United States)

    Nahon, Laurent

    2017-06-01

    Since 15 years, a new type of chiroptical effect has been the subject of a large array of both theoretical and experimental studies: Photoelectron Circular Dichroism (PECD) in the angular distribution of photoelectrons produced by CPL-ionization of pure enantiomers in the gas phase observed as a very intense (up to 35 %) forward/backward asymmetry with respect to the photon axis and which reveals the chirality of the molecule (configuration). PECD happens to be an orbital-specific, photon energy dependent effect and is a very subtle probe of the molecular potential being very sensitive to static molecular structures such as conformers, chemical substitution, clusters, as well as to vibrational motion, much more so than other observables in photoionization such as the cross section or the β asymmetry parameter (for a recent review see L. Nahon, G. A. Garcia, and I. Powis, J. Elec. Spec. Rel. Phen. 204, 322 (2015)). Therefore PECD studies have both a fundamental interest as well and analytical interest, especially since chiral species are ubiquitous in the biosphere, food and medical industry. This last aspect is probably the driving force for the recent extension of PECD studies by the laser community using UV REMPI schemes. After a large introduction to the PECD process itself, and a description of our double imaging electron/ion coincidence set-up, several recent results on one-photon VUV PECD will be presented, including: - Sensitivity to chemical substitutions, isomerism and conformation - Case of floppy biomolecules such as amino acids alanine and proline with a conformer analysis and possible consequences for the origin of life's homochirality - Analytical capabilities in terms of enantiomeric excess determination on a pure molecule as well as on a mixture of compounds. Future trends for PECD studies will be given regarding the case of more complex/structured chiral systems as well as opportunities for time-resolved PECD opened by the recent first performance

  13. Comment on "Non-linear photoelectron effect contributes to the formation of negative matrix ions in UV-MALDI".

    Science.gov (United States)

    Knochenmuss, Richard

    2017-06-21

    Alonso and Zenobi (AZ) recently claimed "a comprehensive theoretical description of negative ion formation in UV-MALDI" (Phys. Chem. Chem. Phys., 2016, 18, 19574). Emphasizing photoelectrons, it is found to be unphysical in several respects, including violation of charge and mass conservation, and in the treatment of ablation, expansion and electron capture. It is not internally consistent, and ions created by the photoelectron mechanism are given artificial preference. Although AZ claimed the "first proposal for a comprehensive theoretical description of negative ion formation in UV-MALDI", the Coupled Physical and Chemical Dynamics model has successfully reproduced a number of phenomena relevant to negative ion production over many years.

  14. Electronic states localized at surface defects on Cu(755) studied by angle-resolved ultraviolet photoelectron spectroscopy using synchrotron radiation

    CERN Document Server

    Ogawa, K; Namba, H

    2003-01-01

    'Regularly stepped' and 'defective' surfaces of Cu(755) were prepared by low- and high-temperature annealing, respectively, of a clean specimen. Electronic states on both surfaces were studied by angle-resolved ultraviolet photoelectron spectroscopy using synchrotron radiation. On the defective Cu(755), we found a new photoelectron peak due to surface defects just below the Fermi level. The dispersion profile of the defect state is derived to be almost flat, which demonstrates the localized nature of the defects. High activity to oxygen adsorption of the defect state was revealed. (author)

  15. Mode choice model parameters estimation

    OpenAIRE

    Strnad, Irena

    2010-01-01

    The present work focuses on parameter estimation of two mode choice models: multinomial logit and EVA 2 model, where four different modes and five different trip purposes are taken into account. Mode choice model discusses the behavioral aspect of mode choice making and enables its application to a traffic model. Mode choice model includes mode choice affecting trip factors by using each mode and their relative importance to choice made. When trip factor values are known, it...

  16. Surface modes in physics

    CERN Document Server

    Sernelius, Bo E

    2011-01-01

    Electromagnetic surface modes are present at all surfaces and interfaces between material of different dielectric properties. These modes have very important effects on numerous physical quantities: adhesion, capillary force, step formation and crystal growth, the Casimir effect etc. They cause surface tension and wetting and they give rise to forces which are important e.g. for the stability of colloids.This book is a useful and elegant approach to the topic, showing how the concept of electromagnetic modes can be developed as a unifying theme for a range of condensed matter physics. The

  17. Mode Gaussian beam tracing

    Science.gov (United States)

    Trofimov, M. Yu.; Zakharenko, A. D.; Kozitskiy, S. B.

    2016-10-01

    A mode parabolic equation in the ray centered coordinates for 3D underwater sound propagation is developed. The Gaussian beam tracing in this case is constructed. The test calculations are carried out for the ASA wedge benchmark and proved an excellent agreement with the source images method in the case of cross-slope propagation. But in the cases of wave propagation at some angles to the cross-slope direction an account of mode interaction becomes necessary.

  18. Atomic Layer Deposition of Hafnium(IV) Oxide on Graphene Oxide: Probing Interfacial Chemistry and Nucleation by using X-ray Absorption and Photoelectron Spectroscopies.

    Science.gov (United States)

    Alivio, Theodore E G; De Jesus, Luis R; Dennis, Robert V; Jia, Ye; Jaye, Cherno; Fischer, Daniel A; Singisetti, Uttam; Banerjee, Sarbajit

    2015-07-27

    Interfacing graphene with metal oxides is of considerable technological importance for modulating carrier density through electrostatic gating as well as for the design of earth-abundant electrocatalysts. Herein, we probe the early stages of the atomic layer deposition (ALD) of HfO2 on graphene oxide using a combination of C and O K-edge near-edge X-ray absorption fine structure spectroscopies and X-ray photoelectron spectroscopy. Dosing with water is observed to promote defunctionalization of graphene oxide as a result of the reaction between water and hydroxyl/epoxide species, which yields carbonyl groups that further react with migratory epoxide species to release CO2 . The carboxylates formed by the reaction of carbonyl and epoxide species facilitate binding of Hf precursors to graphene oxide surfaces. The ALD process is accompanied by recovery of the π-conjugated framework of graphene. The delineation of binding modes provides a means to rationally assemble 2D heterostructures. © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  19. Photoelectron diffraction k-space volumes of the c(2x2) Mn/Ni(100) structure

    Energy Technology Data Exchange (ETDEWEB)

    Banerjee, S.; Denlinger, J.; Chen, X. [Univ. of Wisconsin, Milwaukee, WI (United States)] [and others

    1997-04-01

    Traditionally, x-ray photoelectron diffraction (XPD) studies have either been done by scanning the diffraction angle for fixed kinetic energy (ADPD), or scanning the kinetic energy at fixed exit angle (EDPD). Both of these methods collect subsets of the full diffraction pattern, or volume, which is the intensity of photoemission as a function of momentum direction and magnitude. With the high density available at the Spectromicroscopy Facility (BL 7.0) {open_quotes}ultraESCA{close_quotes} station, the authors are able to completely characterize the photoelectron diffraction patterns of surface structures, up to several hundred electron volts kinetic energy. This large diffraction `volume` can then be analyzed in many ways. The k-space volume contains as a subset the energy dependent photoelectron diffraction spectra along all emission angles. It also contains individual, hemispherical, diffraction patterns at specific kinetic energies. Other `cuts` through the data set are also possible, revealing new ways of viewing photoelectron diffraction data, and potentially new information about the surface structure being studied. In this article the authors report a brief summary of a structural study being done on the c(2x2) Mn/Ni(100) surface alloy. This system is interesting for both structural and magnetic reasons. Magnetically, the Mn/Ni(100) surface alloy exhibits parallel coupling of the Mn and Ni moments, which is opposite to the reported coupling for the bulk, disordered, alloy. Structurally, the Mn atoms are believed to lie well above the surface plane.

  20. Numerical study of the photoelectron cloud in KEKB Low Energy Ring with a three-dimensional particle in cell method

    Directory of Open Access Journals (Sweden)

    L. F. Wang

    2002-12-01

    Full Text Available A three-dimensional particle in cell simulation code has been developed to study the photoelectron cloud instabilities in KEKB LER. In this report, the program is described in detail. In particular, typical simulation results are presented for the photoelectron motion in various kinds of magnetic fields. The simulation shows that a solenoid is very effective in confining the photoelectrons to the vicinity of the vacuum chamber wall and in creating a region free of photoelectrons at the vacuum pipe center. The more uniform the solenoid field is, the more effectively does it suppress the electron-cloud buildup. Multipacting can occur both in a drift region and in a dipole magnet, and the heat load deposited on the chamber wall due to the lost electrons is important in these two cases. Electron trapping by the beam field as well as by various magnetic fields is an important phenomenon, especially inside quadrupole and sextupole magnets. Our numerical results qualitatively agree with the experimental studies.

  1. Photoelectron angular distributions for states of any mixed character: An experiment-friendly model for atomic, molecular, and cluster anions

    Energy Technology Data Exchange (ETDEWEB)

    Khuseynov, Dmitry; Blackstone, Christopher C.; Culberson, Lori M.; Sanov, Andrei, E-mail: sanov@u.arizona.edu [Department of Chemistry and Biochemistry, University of Arizona, Tucson, Arizona 85721 (United States)

    2014-09-28

    We present a model for laboratory-frame photoelectron angular distributions in direct photodetachment from (in principle) any molecular orbital using linearly polarized light. A transparent mathematical approach is used to generalize the Cooper-Zare central-potential model to anionic states of any mixed character. In the limit of atomic-anion photodetachment, the model reproduces the Cooper-Zare formula. In the case of an initial orbital described as a superposition of s and p-type functions, the model yields the previously obtained s-p mixing formula. The formalism is further advanced using the Hanstorp approximation, whereas the relative scaling of the partial-wave cross-sections is assumed to follow the Wigner threshold law. The resulting model describes the energy dependence of photoelectron anisotropy for any atomic, molecular, or cluster anions, usually without requiring a direct calculation of the transition dipole matrix elements. As a benchmark case, we apply the p-d variant of the model to the experimental results for NO{sup −} photodetachment and show that the observed anisotropy trend is described well using physically meaningful values of the model parameters. Overall, the presented formalism delivers insight into the photodetachment process and affords a new quantitative strategy for analyzing the photoelectron angular distributions and characterizing mixed-character molecular orbitals using photoelectron imaging spectroscopy of negative ions.

  2. Above-threshold ionization of noble gases in elliptically polarized fields: Effects of atomic polarization on photoelectron angular distributions

    Science.gov (United States)

    Wang, YanLan; Yu, ShaoGang; Lai, XuanYang; Liu, XiaoJun; Chen, Jing

    2017-06-01

    We theoretically investigate the atomic polarization effect on photoelectron angular distributions (PADs) in above-threshold ionization of noble gases with elliptically polarized laser fields at wavelength of 800 nm, ellipticity of 0.25, and intensity of 1.5 ×1014W/cm2 . Simulations based on a semiclassical model that includes both the ionic Coulomb potential and the atomic polarization effect show surprisingly little difference between PADs for Ar, Kr, and Xe, which is in good agreement with recent experimental observations. Our calculations reveal that the atomic polarization effect increases the distance of the tunnel exit point of the photoelectron to the parent ion and weakens the strength of the interaction between the parent ion and the photoelectron on its subsequent classical propagation. As a result, the forward-scattering electrons which contribute to the main lobes in PADs are substantially suppressed. Our results indicate that the insensitivity of PADs for Ar, Kr, and Xe may be closely related to the influence of the atomic polarization effect on the photoelectron dynamics in the strong laser field.

  3. Photoelectron Spectroscopy Study of [Ta2B6]-: a Hexagonal Bipyramdial Cluster

    Science.gov (United States)

    Jian, Tian; Li, Weili; Romanescu, Constantin; Wang, Lai-Sheng

    2014-06-01

    It has been a long-sought goal in cluster science to discover stable atomic clusters as building blocks for cluster-assembled nanomaterials, as exemplified by the fullerenes and their subsequent bulk syntheses.[1,2] Clusters have also been considered as models to understand bulk properties, providing a bridge between molecular and solid-state chemistry.[3] Herein we report a joint photoelectron spectroscopy and theoretical study on the [Ta2B6]- and [Ta2B6] clusters.[4] The photoelectron spectrum of [Ta2B6]- displays a simple spectral pattern and a large HOMO-LUMO gap, suggesting its high symmetry. Theoretical calculations show that both the neutral and anion are D6h pyramidal. The chemical bonding analyses for [Ta2B6] revealed the nature of the B6 and Ta interactions and uncovered strong covalent bonding between B6 and Ta. The D6h-[TaB6Ta] gaseous cluster is reminiscent of the structural pattern in the ReB6X6Re core in the [(Cp*Re)2B6H4Cl2] and the TiB6Ti motif in the newly synthesized Ti7Rh4Ir2B8 solid-state compound.[5,6] The current work provides an intrinsic link between a gaseous cluster and motifs for solid materials. Continued investigations of the transition-metal boron clusters may lead to the discovery of new structural motifs involving pure boron clusters for the design of novel boride materials. Reference [1] H.W. Kroto, J. R. Heath, S. C. OBrien, R. F. Curl, R. E. Smalley, Nature 1985, 318, 162 - 163. [2] W. Krtschmer, L. D. Lamb, K. Fostiropoulos, D. R. Huffman, Nature 1990, 347, 354 - 358. [3] T. P. Fehlner, J.-F. Halet, J.-Y. Saillard, Molecular Clusters: A Bridge to Solid-State Chemitry, Cambridge University Press, UK, 2007. [4] W. L. Li, L. Xie, T. Jian, C. Romanescu, X. Huang, L.-S. Wang, Angew. Chem. Int. Ed. 2014, 126, 1312 - 1316. [5] B. Le Guennic, H. Jiao, S. Kahlal, J.-Y. Saillard, J.-F. Halet, S. Ghosh, M. Shang, A. M. Beatty, A. L. Rheingold, T. P. Fehlner, J. Am. Chem. Soc. 2004, 126, 3203 - 3217. [6] B. P. T. Fokwa, M. Hermus, Angew

  4. The growth of epitaxial iron oxides on platinum (111) as studied by X-ray photoelectron diffraction, scanning tunneling microscopy, and low energy electron diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Yong -Joo [Univ. of California, Berkeley, CA (United States)

    1995-05-01

    Three complementary surface structure probes, x-ray photoelectron diffraction (XPD), scanning tunneling microscopy (STM), and low-energy electron diffraction (LEED) have been combined in a single instrument. This experimental system has been utilized to study the structure and growth mechanisms of iron oxide films on Pt(111); these films were formed by first depositing a single overlayer of Fe with a certain coverage in monolayers (ML`s), and then thermally oxidizing it in an oxygen atmosphere. For films up to ~1 ML in thickness, a bilayer of Fe and O similar to those in FeO(111) is found to form. In agreement with prior studies, STM and LEED show this to be an incommensurate oxide film forming a lateral superlattice with short- and long-range periodicities of ~3.1 Å and ~26.0 Å. XPD in addition shows a topmost oxygen layer to be relaxed inward by -0.6 Å compared to bulk FeO(111), and these are new structural conclusions. The oxygen stacking in the FeO(111) bilayer is dominated by one of two possible binding sites. For thicker iron oxide films from 1.25 ML to 3.0 ML, the growth mode is essentially Stranski-Krastanov: iron oxide islands form on top of the FeO(111) bilayer mentioned above. For iron oxide films of 3.0 ML thickness, x-ray photoelectron spectroscopy (XPS) yields an Fe 2p3/2 binding energy and an Fe:O stoichiometry consistent with the presence of Fe3O4. Our XPD data further prove this overlayer to be Fe3O4(111)-magnetite in two almost equally populated domains with a 180° rotation between them. The structural parameters for this Fe3O4 overlayer generally agree with those of a previous LEED study, except that we find a significant difference in the first Fe-O interplanar spacing. This work demonstrates the considerable benefits to be derived by using this set of complementary surface structure probes in such epitaxial growth studies.

  5. A X-ray photoelectron spectroscopy study of HDTMAB distribution within organoclays

    Science.gov (United States)

    He, Hongping; Zhou, Qin; Frost, Ray L.; Wood, Barry J.; Duong, Loc V.; Kloprogge, J. Theo

    2007-04-01

    X-ray photoelectron spectroscopy (XPS) in combination with X-ray diffraction (XRD) and high-resolution thermogravimetric analysis (HRTG) has been used to investigate the surfactant distribution within the organoclays prepared at different surfactant concentrations. This study demonstrates that the surfactant distribution within the organoclays depends strongly on the surfactant loadings. In the organoclays prepared at relative low surfactant concentrations, the surfactant cations mainly locate in the clay interlayer, whereas the surfactants occupy both the clay interlayer space and the interparticle pores in the organoclays prepared at high surfactant concentrations. This is in accordance with the dramatic pore volume decrease of organoclays compared to those of starting clays. XPS survey scans show that, at low surfactant concentration (organoclays prepared at high concentrations (>1.0 CEC). High-resolution XPS spectra show that the modification of clay with surfactants has prominent influences on the binding energies of the atoms in both clays and surfactants, and nitrogen is the most sensitive to the surfactant distribution within the organoclays.

  6. Ultrafast x-ray photoelectron spectroscopy in the microsecond time domain

    Energy Technology Data Exchange (ETDEWEB)

    Höfert, O.; Gleichweit, C.; Steinrück, H.-P.; Papp, C. [Lehrstuhl für Physikalische Chemie II, Universität Erlangen-Nürnberg, Egerlandstr. 3, 91058 Erlangen (Germany)

    2013-09-15

    We introduce a new approach for ultrafast in situ high-resolution X-ray photoelectron spectroscopy (XPS) to study surface processes and reaction kinetics on the microsecond timescale. The main idea is to follow the intensity at a fixed binding energy using a commercial 7 channeltron electron analyzer with a modified signal processing setup. This concept allows for flexible switching between measuring conventional XP spectra and ultrafast XPS. The experimental modifications are described in detail. As an example, we present measurements for the adsorption and desorption of CO on Pt(111), performed at the synchrotron radiation facility BESSY II, with a time resolution of 500 μs. Due to the ultrafast measurements, we are able to follow adsorption and desorption in situ at pressures of 2 × 10{sup −6} mbar and temperatures up to 500 K. The data are consistently analyzed using a simple model in line with data obtained with conventional fast XPS at temperatures below 460 K. Technically, our new approach allows measurement on even shorter timescales, down to 20 μs.

  7. Photoelectron Spectroscopy and Electronic Structure of Heavy GroupIV-VI Diatomics

    Energy Technology Data Exchange (ETDEWEB)

    Wang, L.-S.; Niu, B.; Lee, Yuan T.; Shirley, D.A.; Balasubramanian, K.

    1989-09-01

    Vibrationally-resolved HeI (584{angstrom}) photoelectron spectra of the heavy group IV-VI diatomics SnSe, SnTe, PbSe, and PbTe were obtained with a new high temperature molecular beam source. Ionization potentials and spectroscopic constants are reported for all the ionic states observed. Relativistic complete active space MCSCF followed by multireference singles + doubles relativistic CI calculations which included up to 200,000 configurations were made on both the neutral diatomics and their positive ions. Ionization potentials and spectroscopic constants were calculated and were in good agreement with the experimentally-measured values. Relativistic CI potential energy curves were calculated for all the neutral ground states and the ionic states involved. Relativistic effects were shown to play an important role in these heavy diatomics. The {sup 2}{Sigma}{sub 1/2}{sup +} and {sup 2}{Pi}{sub 1/2} states for all four molecular ions showed avoided curve crossings, which resulted in pronounced shoulders in the {Omega} = 1/2 potential energy curves of PbTe{sup +}. Experimentally, autoionization transitions were also observed for the PbTe{sup +} spectrum. The importance of the relativistic effect and chemical bonding in the heavy diatomics are discussed.

  8. Recent progress of soft X-ray photoelectron spectroscopy studies of uranium compounds

    Energy Technology Data Exchange (ETDEWEB)

    Fujimori, Shin-ichi; Takeda, Yukiharu; Okane, Tetsuo; Saitoh, Yuji [Condensed Matter Science Divisions, Japan Atomic Energy Agency, Sayo, Hyogo (Japan); Fujimori, Atsushi [Condensed Matter Science Divisions, Japan Atomic Energy Agency, Sayo, Hyogo (Japan); Department of Physics, University of Tokyo, Hongo, Tokyo 113-0033 (Japan); Yamagami, Hiroshi [Condensed Matter Science Divisions, Japan Atomic Energy Agency, Sayo, Hyogo (Japan); Department of Physics, Faculty of Science, Kyoto Sangyo University, Kyoto 603-8555 (Japan); Yamamoto, Etsuji; Haga, Yoshinori [Advanced Science Research Center, Japan Atomic Energy Agency, Tokai, Ibaraki 319-1195 (Japan); Ōnuki, Yoshichika [Advanced Science Research Center, Japan Atomic Energy Agency, Tokai, Ibaraki 319-1195 (Japan); Faculty of Science, University of the Ryukyus, Nishihara, Okinawa 903-0213 (Japan)

    2016-04-15

    Recent progresses in the soft X-ray photoelectron spectroscopy (PES) studies (hν ≳ 100 eV) for uranium compounds are briefly reviewed. The soft X-ray PES has enhanced sensitivities for the bulk U 5f electronic structure, which is essential to understand the unique physical properties of uranium compounds. In particular, the recent remarkable improvement in energy resolutions from an order of 1 eV to 100 meV made it possible to observe fine structures in U 5f density of states. Furthermore, soft X-ray ARPES becomes available due to the increase of photon flux at beamlines in third generation synchrotron radiation facilities.The technique made it possible to observe bulk band structures and Fermi surfaces of uranium compounds and therefore, the results can be directly compared with theoretical models such as band-structure calculations. The core-level spectra of uranium compounds show a systematic behavior depending on their electronic structures, suggesting that they can be utilized to determine basic physical parameters such as the U 5f-ligand hybridizations or Comlomb interaction between U 5f electrons. It is shown that soft X-ray PES provides unique opportunities to understand the electronic structures of uranium compounds.

  9. X-ray photoelectron spectroscopy studies on single crystalline β-FeSi{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Mao, Wei, E-mail: mao@nuclear.jp [The Micro Analysis Laboratory, Tandem Accelerator, The University Museum, The University of Tokyo, 2-11-16 Yayoi, Bunkyo-ku, Tokyo 113-0032 (Japan); Department of Nuclear Engineering and Management, School of Engineering, The University of Tokyo, 7-3-1 Hongo, Bunkyo-ku, Tokyo 113-8656 (Japan); Udono, Haruhiko [Department of Electrical and Electronic Engineering, Ibaraki University, Hitachi, Ibaraki 316-8511 (Japan); Yamaguchi, Kenji [Quantum Beam Science Directorate, Japan Atomic Energy Agency, 2-4 Shirakata-shirane, Tokai, Naka, Ibaraki 319-1195 (Japan); Terai, Takayuki [Department of Nuclear Engineering and Management, School of Engineering, The University of Tokyo, 7-3-1 Hongo, Bunkyo-ku, Tokyo 113-8656 (Japan); Matsuzaki, Hiroyuki [The Micro Analysis Laboratory, Tandem Accelerator, The University Museum, The University of Tokyo, 2-11-16 Yayoi, Bunkyo-ku, Tokyo 113-0032 (Japan); Department of Nuclear Engineering and Management, School of Engineering, The University of Tokyo, 7-3-1 Hongo, Bunkyo-ku, Tokyo 113-8656 (Japan)

    2016-05-01

    In order to realize the photoluminescence of semiconducting β-FeSi{sub 2} homoepitaxial films, surface preparation of single crystalline β-FeSi{sub 2} is of critical importance. An atomically flat and clean substrate surface of β-FeSi{sub 2} was prepared by sputtering with 2 keV Ar{sup +} ions or by heating at 850 °C. The structure of the native surface oxide and the removal of this layer were investigated though X-ray photoelectron spectroscopy measurements. No significant deviation of the stoichiometry was detected in the surface region. Our results suggest that a surface prepared in this way is an eligible substrate for homoepitaxy of β-FeSi{sub 2}. - Highlights: • A clean surface of single crystalline (beta)-FeSi{sub 2} was prepared by Ar{sup +} sputtering or by heating. • The removal of surface oxide during the surface treatment is elucidated. • The native surface oxides are identified as SiO{sub 2} on top and SiO{sub x} as the inner layer. • There is no significant deviation of surface stoichiometry on the clean surface.

  10. Insight into ethylene interactions with molybdenum suboxide cluster anions from photoelectron spectra of chemifragments

    Science.gov (United States)

    Schaugaard, Richard N.; Topolski, Josey E.; Ray, Manisha; Raghavachari, Krishnan; Jarrold, Caroline Chick

    2018-02-01

    Recent studies on reactions between MoxOy- cluster anions and H2O/C2H4 mixtures revealed a complex web of addition, hydrogen evolution, and chemifragmentation reactions, with chemifragments unambiguously connected to cluster reactions with C2H4. To gain insight into the molecular-scale interactions along the chemifragmentation pathways, the anion photoelectron (PE) spectra of MoC2H2-, MoC4H4-, MoOC2H2-, and MoO2C2H2- formed directly in MoxOy- + C2H4 (x > 1; y ≥ x) reactions, along with supporting CCSD(T) and density functional theory calculations, are presented and analyzed. The complexes have spectra that are all consistent with η2-acetylene complexes, though for all but MoC4H4-, the possibility that vinylidene complexes are also present cannot be definitively ruled out. Structures that are consistent with the PE spectrum of MoC2H2- differ from the lowest energy structure, suggesting that the fragment formation is under kinetic control. The PE spectrum of MoO2C2H2- additionally exhibits evidence that photodissociation to MoO2- + C2H2 may be occurring. The results suggest that oxidative dehydrogenation of ethylene is initiated by Lewis acid/base interactions between the Mo centers in larger clusters and the π orbitals in ethylene.

  11. Imaging the Ultrafast Photoelectron Transfer Process in Alizarin-TiO2

    Directory of Open Access Journals (Sweden)

    Tatiana Gomez

    2015-07-01

    Full Text Available In this work, we adopt a quantum mechanical approach based on time-dependent density functional theory (TDDFT to study the optical and electronic properties of alizarin supported on TiO2 nano-crystallites, as a prototypical dye-sensitized solar cell. To ensure proper alignment of the donor (alizarin and acceptor (TiO2 nano-crystallite levels, static optical excitation spectra are simulated using time-dependent density functional theory in response. The ultrafast photoelectron transfer from the dye to the cluster is simulated using an explicitly time-dependent, one-electron TDDFT ansatz. The model considers the δ-pulse excitation of a single active electron localized in the dye to the complete set of energetically accessible, delocalized molecular orbitals of the dye/nano-crystallite complex. A set of quantum mechanical tools derived from the transition electronic flux density is introduced to visualize and analyze the process in real time. The evolution of the created wave packet subject to absorbing boundary conditions at the borders of the cluster reveal that, while the electrons of the aromatic rings of alizarin are heavily involved in an ultrafast charge redistribution between the carbonyl groups of the dye molecule, they do not contribute positively to the electron injection and, overall, they delay the process.

  12. Functional group analysis of coal and coal products by X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Perry, D.L.; Grint, A.

    1986-04-01

    In a number of technologies such as polymers and carbon fibres, where there is a similar interest in the nature of organic functional groups and their effect on material performance, the technique of x-ray photoelectron spectroscopy (XPS), also known as electron spectroscopy for chemical analysis (ESCA), has been applied successfully to a wide range of problems. However XPS is a technique which is little used in coal science. Since it has high surface sensitivity and the specific surfaces properties of coals play an important role in a number of coal technologies, e.g. flotation and agglomeration, it is perhaps surprising that XPS is not used more extensively. The reasons for this may lie in some of the discouraging references in the literature. For example early work by Frost et al found no relationship between oxygen concentrations determined by XPS and the bulk analysis of a series of float-sink fractions. More recently Huffmann et al observed that oxidation of bituminous coals for up to 383 days at 50/sup 0/C in air completely destroyed Geiseler fluidity but neither XPS nor DRIFT (Diffuse Reflectance FTIR) spectroscopy could detect any parallel changes in the functional group composition of the coal. This paper describes the application of XPS to coal, coal reactions and coal products. The aim is to present a critical evaluation in the context of other techniques which are applied to coal.

  13. Closing the pressure gap in x-ray photoelectron spectroscopy by membrane hydrogenation

    Energy Technology Data Exchange (ETDEWEB)

    Delmelle, Renaud; Borgschulte, Andreas, E-mail: andreas.borgschulte@empa.ch [Laboratory for Advanced Analytical Technologies, Swiss Federal Laboratories for Materials Science and Technology (Empa), Überlandstrasse 129, CH-8600 Dübendorf (Switzerland); Laboratory for Hydrogen and Energy, Swiss Federal Laboratories for Materials Science and Technology (Empa), Überlandstrasse 129, CH-8600 Dübendorf (Switzerland); Probst, Benjamin; Alberto, Roger [Department of Chemistry, University of Zürich (UZH), CH-8057 Zürich (Switzerland); Züttel, Andreas [Laboratory for Hydrogen and Energy, Swiss Federal Laboratories for Materials Science and Technology (Empa), Überlandstrasse 129, CH-8600 Dübendorf (Switzerland); Ecole Polytechnique Fédérale de Lausanne (EPFL), SB, ISIC, LMER, CH-1015 Lausanne (Switzerland); Bleiner, Davide [Laboratory for Advanced Analytical Technologies, Swiss Federal Laboratories for Materials Science and Technology (Empa), Überlandstrasse 129, CH-8600 Dübendorf (Switzerland)

    2015-05-15

    Comprehensive studies of gas-solid reactions require the in-situ interaction of the gas at a pressure beyond the operating pressure of ultrahigh vacuum (UHV) X-ray photoelectron spectroscopy (XPS). The recent progress of near ambient pressure XPS allows to dose gases to the sample up to a pressure of 20 mbar. The present work describes an alternative to this experimental challenge, with a focus on H{sub 2} as the interacting gas. Instead of exposing the sample under investigation to gaseous hydrogen, the sample is in contact with a hydrogen permeation membrane, through which hydrogen is transported from the outside to the sample as atomic hydrogen. Thereby, we can reach local hydrogen concentrations at the sample inside an UHV chamber, which is equipped with surface science tools, and this corresponds to a hydrogen pressure up to 1 bar without affecting the sensitivity or energy resolution of the spectrometer. This experimental approach is validated by two examples, that is, the reduction of a catalyst precursor for CO{sub 2} hydrogenation and the hydrogenation of a water reduction catalyst for photocatalytic H{sub 2} production, but it opens the possibility of the new in situ characterisation of energy materials and catalysts.

  14. Soft X-ray photoelectron spectroscopy of the ultrathin Ba/InGaN interface

    Science.gov (United States)

    Benemanskaya, G. V.; Pronin, V. P.; Timoshnev, S. N.; Nelyubov, A. V.

    2017-11-01

    Electronic structure of the clean In0.22Ga0.78N surface and the ultrathin Ba/In0.22Ga0.78N interface has been studied in situ by the synchrotron-based photoelectron spectroscopy during excitation in the photon energy range of 100-650 eV. Changes in the valence band and surface states spectra and in the In 3d, In 4d, N 1s, Ga 3d, Ba 4d, Ba 5p core levels spectra have been investigated under the step-by-step Ba submonolayer deposition. Changes in the surface electronic structure of the InGaN caused by Ba adsorption are found to originate predominantly from the local interaction of the Ga and In dangling bonds and Ba adatoms that results in effect of the suppression of the two intrinsic surface states and appearance of a new induced state. The Ba atomic layer deposition is revealed to induce the charge transfer between the Ba adatoms and the N surface atoms with increasing N-ionicity.

  15. Chemically doped fluorescent carbon and graphene quantum dots for bioimaging, sensor, catalytic and photoelectronic applications.

    Science.gov (United States)

    Du, Yan; Guo, Shaojun

    2016-02-07

    Doping fluorescent carbon dots (DFCDs) with heteroatoms have recently become of great interest compared to traditional fluorescent materials because it provides a feasible and new way to tune the intrinsic properties of carbon quantum dots (CQDs) and graphene quantum dots (GQDs) to achieve new applications for them in different fields. Since the first report on nitrogen (N) doped GQDs in 2012, more effort is being focused on exploring different procedures for making new types of DFCDs with different heteroatoms. This mini review will summarize recent research progress on DFCDs. It first reviews various doping categories achieved up to now, looking back on the synthesis method and comparing the differences in synthesis approaches between the DFCDs and the undoped ones. Then it focuses on the advances on how the doping affects the optical properties, especially DFCDs doped with N, which have been investigated the most. Finally, different applications of DFCDs involving bio-imaging, sensing, catalysis and photoelectronic devices will be discussed. This review will give new insights into how to use different synthetic methods for tuning the structure of DFCDs, understanding the correlation between the doping and properties, and achieving new applications.

  16. Calculation of photoelectron spectra of molybdenum and tungsten complexes using Green's functions methods.

    Science.gov (United States)

    Bayse, Craig A; Ortwine, Kristine N

    2007-08-16

    Green's functions calculations are presented for several complexes of molybdenum and tungsten, two metals that are similar structurally but display subtle, but significant, differences in electronic structure. Outer valence Green's functions IPs for M(CO)6, M(Me)6, MH6, [MCl4O](-), and [MO4](-) (M = Mo, W) are generally within +/-0.2 eV of available experimental photoelectron spectra. The calculations show that electrons in M-L bonding orbitals are ejected at lower energies for Mo while the detachment energy for electrons in d orbitals varies with metal and complex. For the metal carbonyls, the quasiparticle picture assumed in OVGF breaks down for the inner valence pi CO molecular orbitals due to the coupling of two-hole-one-particle charge transfer states to the one-hole states. Incorporation of the 2h1p states through a Tamm-Dancoff approximation calculation accurately represents the band due to detachment from these molecular orbitals. Though the ordering of IPs for Green's functions methods and DFT Koopmans' theorem IPs is similar for the highest IPs for most compounds considered, the breakdown of the quasiparticle picture for the metal carbonyls suggests that scaling of the latter values may result in a fortuitous or incorrect assignment of experimental VDEs.

  17. High-resolution photoelectron spectroscopy analysis of sulfidation of brass at the rubber/brass interface

    Energy Technology Data Exchange (ETDEWEB)

    Ozawa, Kenichi, E-mail: ozawa.k.ab@m.titech.ac.jp [Department of Chemistry and Materials Science, Tokyo Institute of Technology, Ookayama, Meguro-ku, Tokyo 152-8551 (Japan); Kakubo, Takashi; Shimizu, Katsunori; Amino, Naoya [Yokohama Rubber Co., Ltd., Oiwake, Hiratsuka 254-8601 (Japan); Mase, Kazuhiko [Institute of Materials Structure Science, High Energy Accelerator Research Organization (KEK), Tsukuba 305-0801 (Japan); Komatsu, Takayuki [Department of Chemistry and Materials Science, Tokyo Institute of Technology, Ookayama, Meguro-ku, Tokyo 152-8551 (Japan)

    2013-01-01

    Highlights: Black-Right-Pointing-Pointer Chemical composition at the rubber/brass interface is investigated. Black-Right-Pointing-Pointer The 2-min vulcanization reaction is enough to convert the interface composition. Black-Right-Pointing-Pointer Five S-containing species are identified at the interface. Black-Right-Pointing-Pointer Strong rubber-brass adhesion is related to the Cu{sub 2}S/CuS ratio. Black-Right-Pointing-Pointer Degradation of adhesion proceeds along with desulfidation of the interface. - Abstract: High resolution photoelectron spectroscopy is utilized to investigate the chemical composition at the rubber/brass interface to elucidate the origin of strong adhesion as well as the degradation between rubber and brass. Special attention has been given to copper sulfides formed at the interface during the vulcanization reaction at 170 Degree-Sign C. At least five sulfur-containing species are identified in the adhesive interlayer including crystalline CuS and amorphous Cu{sub x}S (x Asymptotically-Equal-To 2). These copper sulfide species are not uniformly distributed within the layer, but there exits the concentration gradation; the concentration of Cu{sub x}S is high in the region on the rubber side and is diminished in the deeper region, while vice versa for that of CuS. Degradation of the interface adhesive strength by prolonged vulcanization arises from the decrease in the Cu{sub x}S/CuS ratio accompanying desulfurization of the adhesive layer.

  18. Behavior of oxygen doped SiC thin films: An x-ray photoelectron spectroscopy study

    Science.gov (United States)

    Avila, A.; Montero, I.; Galán, L.; Ripalda, J. M.; Levy, R.

    2001-01-01

    Thin silicon carbide films have been deposited by chemical vapor deposition on p-type (100) silicon substrates. The composition and bonds formed in these films have been analyzed by x-ray photoelectron spectroscopy (XPS) and infrared spectroscopy. The native surface oxide on the silicon carbide surface induced by air exposure has also been studied. Several phases are detected in the near-surface region: elemental Si, Si oxides (mainly SiO2), Si carbide (SiC) and Si oxicarbides (SiOxCy). Quantitative XPS analysis results indicate that, for atomic oxygen fractions silicon oxicarbide is observed, but a multiphase material formed by elemental Si, Si oxides and Si carbides is observed. In spite of the film being a complex phase mixture, a simple relationship is found between the overall carbon and oxygen compositions. The carbon atomic fraction in the film decreases quasilinearly as the oxygen content increases, with a slope of about -1. An overall composition of SiOxC3-x in the 0.5silicon carbide obtained by CHn+ ion implantation into monocrystalline silicon is made.

  19. The surface of 1-euro coins studied by X-ray photoelectron spectroscopy

    Science.gov (United States)

    Gou, F.; Gleeson, M. A.; Villette, J.; Kleyn, S. E. F.; Kleyn, A. W.

    2004-03-01

    The two alloy surfaces (pill and ring) that are present on 1-euro coins have been studied by X-ray photoelectron spectroscopy (XPS). Comparison is made between coins from general circulation and coin surfaces that have been subjected to a variety of cleaning and oxidation treatments. The concentrations and possible oxidation states of the metals (nickel, copper and zinc) at the surface were derived from analysis of the 2p 3/2 core levels. The surface atomic ratios measured for the pill and the ring parts of the euro coins were compared to the official bulk ratios. This study shows a clear nickel enrichment of both pill and ring surfaces. Nickel at surface seems to be present mainly in hydroxide form although the chloride form cannot be excluded. A small concentration of zinc was present on the surface of the pill, even though it is not present in the bulk alloy. Evidence of both nickel and zinc surface enrichment is observed for the ring. No surface enrichment is observed for the atomically clean or oxidized alloy surfaces over a 60-h time scale.

  20. The surface of 1-euro coins studied by X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Gou, F.; Gleeson, M.A.; Villette, J.; Kleyn, S.E.F.; Kleyn, A.W

    2004-03-30

    The two alloy surfaces (pill and ring) that are present on 1-euro coins have been studied by X-ray photoelectron spectroscopy (XPS). Comparison is made between coins from general circulation and coin surfaces that have been subjected to a variety of cleaning and oxidation treatments. The concentrations and possible oxidation states of the metals (nickel, copper and zinc) at the surface were derived from analysis of the 2p{sub 3/2} core levels. The surface atomic ratios measured for the pill and the ring parts of the euro coins were compared to the official bulk ratios. This study shows a clear nickel enrichment of both pill and ring surfaces. Nickel at surface seems to be present mainly in hydroxide form although the chloride form cannot be excluded. A small concentration of zinc was present on the surface of the pill, even though it is not present in the bulk alloy. Evidence of both nickel and zinc surface enrichment is observed for the ring. No surface enrichment is observed for the atomically clean or oxidized alloy surfaces over a 60-h time scale.

  1. Oxidation mechanism of chalcopyrite revealed by X-ray photoelectron spectroscopy and first principles studies

    Science.gov (United States)

    Xiong, Xiaolu; Hua, Xiaoming; Zheng, Yongfei; Lu, Xionggang; Li, Shenggang; Cheng, Hongwei; Xu, Qian

    2018-01-01

    X-ray photoelectron spectroscopic (XPS) studies revealed that the iron site on the chalcopyrite (CuFeS2) surface was preferably oxidized to the Cu site when exposed to an oxidizing environment. Extensive density functional theory calculations were performed to investigate the surface structure of chalcopyrite and its reaction with both molecular oxygen (O2) and water. The adsorption and dissociation of a single O2 molecule, a single H2O molecule, as well as both molecules at the Fe and Cu sites on the CuFeS2 (001) surface were studied. Consistent with our experimental observation, the Fe site was found to be preferred for the adsorption and dissociation of O2 due to its lower energy barrier and greater exothermicity. The dissociation of H2O on the CuFeS2 (001) surface by itself was found to be unfavorable both thermodynamically and kinetically. However, the surface formed upon O2 dissociation was predicted to be much more reactive with H2O, which was attributed to favorable hydrogen transfer to the O site formed upon O2 dissociation to hydrogen transfer to the S site due to the much weaker Ssbnd H bond than the Osbnd H bond.

  2. Investigation of the surface composition of electrodeposited black chromium by X-ray photoelectron spectroscopy

    Science.gov (United States)

    Survilienė, S.; Češūnienė, A.; Jasulaitienė, V.; Jurevičiūtė, I.

    2015-01-01

    The paper reviews black chromium electrodeposited from a trivalent chromium bath containing ZnO as a second main component. The chemical compositions of the top layers of the black chromium coatings were studied by the X-ray photoelectron spectroscopy method. The surface of black chromium was found to be almost entirely covered with organic substances. To gain information on the state of each element in the deposit bulk, the layer-by-layer etching of the black chromium surface with argon gas was used. Analysis of XPS spectra has shown that the top layers of black chromium without zinc are composed of various Cr(III) components, organic substances and metallic Cr, whereas metallic Cr is almost absent in black chromium containing some amount of Zn(II) compounds. The ratios of metal/oxide phases were found to be 10/27 and 2/28 for black chromium without and with zinc, respectively. It has been determined that owing to the presence of ZnO in the Cr(III) bath, the percentage of metallic chromium is substantially reduced in black chromium which is quite important for good solar selective characteristics of the coating. The results confirm some of earlier observations and provide new information on the composition of the near-surface layers.

  3. Detection of suspended nanoparticles with near-ambient pressure x-ray photoelectron spectroscopy

    Science.gov (United States)

    Kjærvik, Marit; Hermanns, Anja; Dietrich, Paul; Thissen, Andreas; Bahr, Stephan; Ritter, Benjamin; Kemnitz, Erhard; Unger, Wolfgang E. S.

    2017-11-01

    Two systems of suspended nanoparticles have been studied with near-ambient pressure x-ray photoelectron spectroscopy: silver nanoparticles in water and strontium fluoride—calcium fluoride core-shell nanoparticles in ethylene glycol. The corresponding dry samples were measured under ultra high vacuum for comparison. The results obtained under near-ambient pressure were overall comparable to those obtained under ultra high vacuum, although measuring silver nanoparticles in water requires a high pass energy and a long acquisition time. A shift towards higher binding energies was found for the silver nanoparticles in aqueous suspension compared to the corresponding dry sample, which can be assigned to a change of surface potential at the water-nanoparticle interface. The shell-thickness of the core-shell nanoparticles was estimated based on simulated spectra from the National Institute of Standards and Technology database for simulation of electron spectra for surface analysis. With the instrumental set-up presented in this paper, nanoparticle suspensions in a suitable container can be directly inserted into the analysis chamber and measured without prior sample preparation.

  4. Characterizing Edge and Stacking Structures of Exfoliated Graphene by Photoelectron Diffraction

    Science.gov (United States)

    Matsui, Fumihiko; Ishii, Ryo; Matsuda, Hiroyuki; Morita, Makoto; Kitagawa, Satoshi; Matsushita, Tomohiro; Koh, Shinji; Daimon, Hiroshi

    2013-11-01

    The two-dimensional C 1s photoelectron intensity angular distributions (PIADs) and spectra of exfoliated graphene flakes and crystalline graphite were measured using a focused soft X-ray beam. Suitable graphene samples were selected by thickness characterization using Raman spectromicroscopy after transferring mechanically exfoliated graphene flakes onto a 90-nm-thick SiO2 film. In every PIAD, a Kagomé interference pattern was observed, particularly clearly in the monolayer graphene PIAD. Its origin is the overlap of the diffraction rings formed by an in-plane C-C bond honeycomb lattice. Thus, the crystal orientation of each sample can be determined. In the case of bilayer graphene, PIAD was threefold-symmetric, while those of monolayer graphene and crystalline graphite were sixfold-symmetric. This is due to the stacking structure of bilayer graphene. From comparisons with the multiple scattering PIAD simulation results, the way of layer stacking as well as the termination types in the edge regions of bilayer graphene flakes were determined. Furthermore, two different C 1s core levels corresponding to the top and bottom layers of bilayer graphene were identified. A chemical shift to a higher binding energy by 0.25 eV for the bottom layer was attributed to interfacial interactions.

  5. Femtosecond photoelectron imaging of transient electronic states and Rydberg atom emission from electronically excited he droplets.

    Science.gov (United States)

    Kornilov, Oleg; Bünermann, Oliver; Haxton, Daniel J; Leone, Stephen R; Neumark, Daniel M; Gessner, Oliver

    2011-07-14

    Ultrafast relaxation of electronically excited pure He droplets is investigated by femtosecond time-resolved photoelectron imaging. Droplets are excited by extreme ultraviolet (EUV) pulses with photon energies below 24 eV. Excited states and relaxation products are probed by ionization with an infrared (IR) pulse with 1.6 eV photon energy. An initially excited droplet state decays on a time scale of 220 fs, leading predominantly to the emission of unaligned 1s3d Rydberg atoms. In a second relaxation channel, electronically aligned 1s4p Rydberg atoms are emitted from the droplet within less than 120 fs. The experimental results are described within a model that approximates electronically excited droplet states by localized, atomic Rydberg states perturbed by the local droplet environment in which the atom is embedded. The model suggests that, below 24 eV, EUV excitation preferentially leads to states that are localized in the surface region of the droplet. Electronically aligned 1s4p Rydberg atoms are expected to originate from excitations in the outermost surface regions, while nonaligned 1s3d Rydberg atoms emerge from a deeper surface region with higher local densities. The model is used to simulate the He droplet EUV absorption spectrum in good agreement with previously reported fluorescence excitation measurements.

  6. A multi-plate velocity-map imaging design for high-resolution photoelectron spectroscopy

    Science.gov (United States)

    Kregel, Steven J.; Thurston, Glen K.; Zhou, Jia; Garand, Etienne

    2017-09-01

    A velocity map imaging (VMI) setup consisting of multiple electrodes with three adjustable voltage parameters, designed for slow electron velocity map imaging applications, is presented. The motivations for this design are discussed in terms of parameters that influence the VMI resolution and functionality. Particularly, this VMI has two tunable potentials used to adjust for optimal focus, yielding good VMI focus across a relatively large energy range. It also allows for larger interaction volumes without significant sacrifice to the resolution via a smaller electric gradient at the interaction region. All the electrodes in this VMI have the same dimensions for practicality and flexibility, allowing for relatively easy modifications to suit different experimental needs. We have coupled this VMI to a cryogenic ion trap mass spectrometer that has a flexible source design. The performance is demonstrated with the photoelectron spectra of S- and CS2 -. The latter has a long vibrational progression in the ground state, and the temperature dependence of the vibronic features is probed by changing the temperature of the ion trap.

  7. Changes in X-ray photoelectron spectra of yttria-tetragonal zirconia polycrystal by ion sputtering

    Energy Technology Data Exchange (ETDEWEB)

    Watanabe, Eiko; Yoshinari, Masao [Tokyo Dental College, Oral Health Science Center, Tokyo, Chiyoda-ku (Japan)

    2016-04-15

    This paper reports changes in X-ray photoelectron spectroscopy spectra of yttria-tetragonal zirconia polycrystal (Y-TZP) brought about by Ar ion sputtering. The changes in the core-level spectra of Y-TZP suggest that preferential sputtering of oxygen occurred. A new peak was observed near 0 eV binding energy accompanied with changes in the core-level spectra by the sputtering. After 18 h in a high vacuum following the sputtering, the spectra changed by the sputtering were returned to their original shapes. In contrast, the color of Y-TZP was changed from white to pale brown by X-ray irradiation and was changed from pale brown to dark gray by ion sputtering. However, when the new peak near 0 eV decreased after 18 h, no color change was observed. Therefore, it is thought that the new peak was mainly derived from electrons trapped in various kinds of oxygen vacancies created by the sputtering in other than color centers. (orig.)

  8. CHARACTERIZING SURFACE LAYERS IN NITINOL USING X-RAY PHOTOELECTRON SPECTROSCOPY

    Energy Technology Data Exchange (ETDEWEB)

    Christopfel, R.; Mehta, A.

    2008-01-01

    Nitinol is a shape memory alloy whose properties allow for large reversible deformations and a return to its original geometry. This nickel-titanium (NiTi) alloy has become a material used widely in the biomedical fi eld as a stent to open up collapsed arteries. Both ambient and biological conditions cause surface oxidation in these devices which in turn change its biocompatibility. The thickness of oxidized layers can cause fractures in the material if too large and can allow for penetration if too thin. Depending on the type and abundance of the chemical species on or near the surface, highly toxic metal ions can leak into the body causing cell damage or even cell death. Thus, biocompatibility of such devices is crucial. By using highly surface sensitive x-ray photoelectron spectroscopy to probe the surface of these structures, it is possible to decipher both layer composition and layer thickness. Two samples, both of which were mechanically polished, were investigated. Of the two samples, one was then exposed to a phosphate buffered saline (PBS) solution to mimic the chemical properties of blood, while the other remained unexposed. Although both samples were found to have oxide layers of appropriate thickness (on the order of a few nm), it was found that the sample exposed to the saline solution had a slightly thicker oxide layer and more signifi cantly, a phosphate layer very near the surface suggesting toxic metal components are well contained within the sample. These are considerable indications of a biocompatible device.

  9. Sliding mode control and observation

    CERN Document Server

    Shtessel, Yuri; Fridman, Leonid; Levant, Arie

    2014-01-01

    The sliding mode control methodology has proven effective in dealing with complex dynamical systems affected by disturbances, uncertainties and unmodeled dynamics. Robust control technology based on this methodology has been applied to many real-world problems, especially in the areas of aerospace control, electric power systems, electromechanical systems, and robotics. Sliding Mode Control and Observation represents the first textbook that starts with classical sliding mode control techniques and progresses toward newly developed higher-order sliding mode control and observation algorithms and their applications. The present volume addresses a range of sliding mode control issues, including: *Conventional sliding mode controller and observer design *Second-order sliding mode controllers and differentiators *Frequency domain analysis of conventional and second-order sliding mode controllers *Higher-order sliding mode controllers and differentiators *Higher-order sliding mode observers *Sliding mode disturbanc...

  10. Free boundary ballooning mode representation

    Science.gov (United States)

    Zheng, Linjin

    2012-03-01

    Considerable efforts have been made in this field to develop a free boundary ballooning mode representation, which can incorporate the peeling mode stability criterion. Those efforts have not succeeded, simply because the so-called ballooning mode invariance is broken toward plasma edge. This makes 1D description of high n modes at plasma edge become impossible, where n is toroidal mode number. Nevertheless, we prove that the existence of ``half" ballooning mode invariance toward plasma core enables an 1.δ-dimentional representation of the modes, where δ˜O(1/n). This considerably reduces the complicity in investigating high n modes at plasma edge and can be used to study peeling-ballooning modes. This technique can also be useful to extend the 1D calculation of fixed boundary ballooning modes for free boundary ballooning modes. Numerical example will also be presented together with the topological symmetry analysis.

  11. Modeli diskretne izbire

    Directory of Open Access Journals (Sweden)

    Boštjan Kerbler – Kefo

    2006-01-01

    Full Text Available V članku je sistematično predstavljena posebna oblika regresijskih metod – modelov diskretne izbire –, imenovanih tudi verjetnostni modeli. Poleg njihovega pomena so opisane še metodološke značilnosti pri njihovi izvedbi, natančneje pa so predstavljeni modeli binarne izbire in tisti z omejeno odvisno spremenljivko, logistični model ter modela probit in tobit kot izhodiščni metodološki pristopi k izvedbi modelov.

  12. Mode og mozzarella

    DEFF Research Database (Denmark)

    Nielsen, Jakob Isak

    2013-01-01

    Under en samtale i Paolo Sorrentinos La grande bellezza/da. Den store skønhed (2013) anføres det, at Italiens primære eksportvarer er mode og mozzarella. Selve filmen vidner om, at Italien har andet at byde på – heriblandt filmkunst og Roms righoldige kulturhistorie.......Under en samtale i Paolo Sorrentinos La grande bellezza/da. Den store skønhed (2013) anføres det, at Italiens primære eksportvarer er mode og mozzarella. Selve filmen vidner om, at Italien har andet at byde på – heriblandt filmkunst og Roms righoldige kulturhistorie....

  13. High-power, narrow-band, high-repetition-rate, 5.9 eV coherent light source using passive optical cavity for laser-based angle-resolved photoelectron spectroscopy.

    Science.gov (United States)

    Omachi, J; Yoshioka, K; Kuwata-Gonokami, M

    2012-10-08

    We demonstrate a scheme for efficient generation of a 5.9 eV coherent light source with an average power of 23 mW, 0.34 meV linewidth, and 73 MHz repetition rate from a Ti: sapphire picosecond mode-locked laser with an output power of 1 W. Second-harmonic light is generated in a passive optical cavity by a BiB(3)O(6) crystal with a conversion efficiency as high as 67%. By focusing the second-harmonic light transmitted from the cavity into a β-BaB(2)O(4) crystal, we obtain fourth-harmonic light at 5.9 eV. This light source offers stable operation for at least a week. We discuss the suitability of the laser light source for high-resolution angle-resolved photoelectron spectroscopy by comparing it with other sources (synchrotron radiation facilities and gas discharge lamp).

  14. Nonclassicality in two-mode BEC

    OpenAIRE

    Giri, Sandip Kumar; Sen, Biswajit; Ooi, C H Raymond; Pathak, Anirban

    2013-01-01

    The operator solution of a completely quantum mechanical Hamiltonian of the Raman processes is used here to investigate the possibility of obtaining intermodal entanglement between different modes involved in the Raman processes (e.g. pump mode, Stokes mode, vibration (phonon) mode and anti-Stokes mode). Intermodal entanglement is reported between a) pump mode and anti-Stokes mode, b) pump mode and vibration (phonon) mode c) Stokes mode and vibration phonon mode, d) Stokes mode and anti-stoke...

  15. The interfacial and surface properties of thin Fe and Gd films grown on W(110) as studied by scanning tunneling microscopy, site-resolved photoelectron diffraction, and spin polarized photoelectron diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Tober, Eric D. [Univ. of California, Davis, CA (United States)

    1997-06-01

    Combined scanning tunneling microscopy (STM) and low energy electron diffraction (LEED) measurements from Gd films grown on W(110) prepared with and without annealing have been used to provide a detailed picture of the growth of such films, permitting a quantitative structural explanation for previously-measured magnetic properties and the identification of a new two-dimensional structure for the first monolayer. The analysis of the film roughness of room-temperature-grown films as a function of coverage and lateral length scale reveals that the growing Gd surface follows scaling laws for a self-affine surface. Annealing these as-deposited films at elevated temperatures is found to drastically alter the morphology of the films, as seen by both STM and LEED. Nanometer-scale islands of relatively well-defined size and shape are observed under certain conditions. Finally, the first monolayer of Gd is observed to form a (7x14) superstructure with pseudo-(7x7) symmetry that is consistent with a minimally-distorted hexagonal two-dimensional Gd(0001) film. Furthermore, a new beamline and photoelectron spectrometer/diffractometer at the Advanced Light Source have been used to obtain full-solid-angle and site-specific photoelectron diffraction (PD) data from interface W atoms just beneath (1x1) Fe and (7x14) Gd monolayers on W(110) by utilizing the core level shift in the W 4f7/2 spectrum. A comparison of experiment with multiple scattering calculations permits determining the Fe adsorption site and the relative interlayer spacing to the first and second W layers. These Fe results are also compared to those from the very different Gd overlayer and from the clean W(110) surface. Such interface PD measurements show considerable promise for future studies. Finally, the rare-earth ferromagnetic system of Gd(0001) has been examined through the use of spin polarized photoelectron diffraction from the Gd 4s and 5s photoelectron multiplets.

  16. Vibrational modes of nanolines

    Science.gov (United States)

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

    2008-04-01

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

  17. Mode Gaussian beam tracing

    CERN Document Server

    Trofimov, M Yu; Kozitskiy, S B

    2015-01-01

    An adiabatic mode Helmholtz equation for 3D underwater sound propagation is developed. The Gaussian beam tracing in this case is constructed. The test calculations are carried out for the crosswedge benchmark and proved an excellent agreement with the source images method.

  18. New Modes of Citizenship

    DEFF Research Database (Denmark)

    Nickelsen, Niels Christian Mossfeldt

    2017-01-01

    in common that they involve important elements of autonomy and self-care and are part of an international movement toward empowering citizens and patients. This chapter discusses the relation between care innovation and new modes of citizenship in terms of the ‘active’ citizen. By way of an ethnographic...

  19. Thermodynamics of Radiation Modes

    Science.gov (United States)

    Pina, Eduardo; de la Selva, Sara Maria Teresa

    2010-01-01

    We study the equilibrium thermodynamics of the electromagnetic radiation in a cavity of a given volume and temperature. We found three levels of description, the thermodynamics of one mode, the thermodynamics of the distribution of frequencies in a band by summing over the frequencies in it and the global thermodynamics by summing over all the…

  20. Theories and Modes

    Science.gov (United States)

    Apsche, Jack A.

    2005-01-01

    In his work on the Theory of Modes, Beck (1996) suggested that there were flaws with his cognitive theory. He suggested that though there are shortcomings to his cognitive theory, there were not similar shortcomings to the practice of Cognitive Therapy. The author suggests that if there are shortcomings to cognitive theory the same shortcomings…

  1. Hard X-ray photoelectron spectroscopy of bulk and thin films of Heusler compounds

    Energy Technology Data Exchange (ETDEWEB)

    Kozina, Xeniya

    2012-03-26

    X-ray photoemission spectroscopy (XPS) is one of the most universal and powerful tools for investigation of chemical states and electronic structures of materials. The application of hard X-rays increases the inelastic mean free path of the emitted electrons within the solid and thus makes hard X-ray photoelectron spectroscopy (HAXPES) a bulk sensitive probe for solid state research and especially a very effective nondestructive technique to study buried layers. This thesis focuses on the investigation of multilayer structures, used in magnetic tunnel junctions (MTJs), by a number of techniques applying HAXPES. MTJs are the most important components of novel nanoscale devices employed in spintronics. The investigation and deep understanding of the mechanisms responsible for the high performance of such devices and properties of employed magnetic materials that are, in turn, defined by their electronic structure becomes feasible applying HAXPES. Thus the process of B diffusion in CoFeB-based MTJs was investigated with respect to the annealing temperature and its influence on the changes in the electronic structure of CoFeB electrodes that clarify the behaviour and huge TMR ratio values obtained in such devices. These results are presented in chapter 6. The results of investigation of the changes in the valence states of buried off-stoichiometric Co{sub 2}MnSi electrodes were investigated with respect to the Mn content {alpha} and its influence on the observed TMR ratio are described in chapter 7. Magnetoelectronic properties such as exchange splitting in ferromagnetic materials as well as the macroscopic magnetic ordering can be studied by magnetic circular dichroism in photoemission (MCDAD). It is characterized by the appearance of an asymmetry in the photoemission spectra taken either from the magnetized sample with the reversal of the photon helicity or by reversal of magnetization direction of the sample when the photon helicity direction is fixed. Though

  2. SLR2000: a microlaser-based single photoelectron satellite laser ranging system

    Science.gov (United States)

    Degnan, John J.; McGarry, Jan F.

    1998-01-01

    SLR2000 is an autonomous and eyesafe satellite laser ranging (SLR) station with an expected single shot range precision of about one centimeter and a normal point (time-averaged) precision better than 3 mm. The system wil provide continuous 24 hour tracking coverage for a constellation of over twenty artificial satellites. Replication costs are expected to be roughly an order of magnitude less than current operational systems, and the system will be about 75% less expensive to operate and maintain relative to manned systems. Computer simulations have predicted a daylight tracking capability to GPS and lower satellites with telescope apertures of 40 cm and have demonstrated the ability of our current autotracking algorithm to extract mean signal strengths below .001 photoelectrons per pulse from daytime background noise. The dominant cost driver in present SLR systems is the onsite and central infrastructure manpower required to operate the system, to service and maintain the complex subsystems, and to ensure that the transmitted laser beam is not a hazard to onsite personnel or to overflying aircraft. To keep development, fabrication, and maintenance costs at a minimum, we adopted the following design philosophies: (1) use off the shelf commercial components wherever possible; this allows rapid component replacement and "outsourcing" of engineering support; (2) use smaller telescopes (less than 50 cm) since this constrains the cost, size, and weight of the telescope and tracking mount; and (3) for low maintenance and failsafe reliability, choose simple versus complex technical approaches and, where possible, use passive techniques and components rather than active ones. Adherence to these philosophies has led to the SLR2000 design described here.

  3. From iron pentacarbonyl to the iron ion by imaging photoelectron photoion coincidence.

    Science.gov (United States)

    Russell, Eileen M; Cudjoe, Elvis; Mastromatteo, Michael E; Kercher, James P; Sztáray, Bálint; Bodi, Andras

    2013-06-06

    The dissociation dynamics of internal energy selected iron pentacarbonyl cations, Fe(CO)5(+), have been investigated using the imaging photoelectron photoion coincidence (iPEPICO) spectrometer at the Swiss Light Source. The molecular ion loses all five carbonyl ligands in sequential dissociations in the 8.5-20 eV photon energy range. The Fe(CO)5(+) parent ion is metastable at the onset of the first dissociation reaction on the time scale of the experiment. The slightly asymmetric and broad daughter ion time-of-flight distributions indicate parent ion lifetimes in the microsecond range, and are used to obtain an experimental dissociation rate curve. Further carbonyl losses were found to be fast at threshold. The fractional parent and daughter ion abundances as a function of the photon energy, that is, breakdown diagram, as well as the dissociation rates for the first CO loss were modeled using the statistical Rice-Ramsperger-Kassel-Marcus (RRKM) and statistical adiabatic channel model (SSACM) theories. The excess energy redistribution in the products was also taken into account in a statistical framework. The 0 K dissociative photoionization thresholds for the five carbonyl-loss channels were found to be 9.015 ± 0.024 eV, 10.199 ± 0.027 eV, 10.949 ± 0.033 eV, 12.282 ± 0.39 eV, and 13.821 ± 0.045 eV for the processes leading to Fe(CO)4(+), Fe(CO)3(+), Fe(CO)2(+), Fe(CO)(+), and Fe(+), respectively. The iron cation thermochemistry is well-known, and these onsets connect the bare metal ion to the other fragment ions as well as to the gas phase neutral Fe(CO)5.

  4. X-ray photoelectron spectra structure and chemical bonding in AmO2

    Directory of Open Access Journals (Sweden)

    Teterin Yury A.

    2015-01-01

    Full Text Available Quantitative analysis was done of the X-ray photoelectron spectra structure in the binding energy range of 0 eV to ~35 eV for americium dioxide (AmO2 valence electrons. The binding energies and structure of the core electronic shells (~35 eV-1250 eV, as well as the relativistic discrete variation calculation results for the Am63O216 and AmO8 (D4h cluster reflecting Am close environment in AmO2 were taken into account. The experimental data show that the many-body effects and the multiplet splitting contribute to the spectral structure much less than the effects of formation of the outer (0-~15 eV binding energy and the inner (~15 eV-~35 eV binding energy valence molecular orbitals. The filled Am 5f electronic states were shown to form in the AmO2 valence band. The Am 6p electrons participate in formation of both the inner and the outer valence molecular orbitals (bands. The filled Am 6p3/2 and the O 2s electronic shells were found to make the largest contributions to the formation of the inner valence molecular orbitals. Contributions of electrons from different molecular orbitals to the chemical bond in the AmO8 cluster were evaluated. Composition and sequence order of molecular orbitals in the binding energy range 0-~35 eV in AmO2 were established. The experimental and theoretical data allowed a quantitative scheme of molecular orbitals for AmO2, which is fundamental for both understanding the chemical bond nature in americium dioxide and the interpretation of other X-ray spectra of AmO2.

  5. Thermal desorption mass spectrometric and x-ray photoelectron studies of etched surfaces of polytetrafluoroethylene

    Science.gov (United States)

    Rye, R. R.; Kelber, J. A.

    1987-12-01

    The etching of polytetrafluoroethylene (PTFE) with Na solutions is known to lead to a loss of F, a loss which is correlated with enhanced adhesion. Subsequent heating partially restores surface F with a concurrent loss of adhesion strength. We have combined X-ray photoelectron spectroscopy (XPS) and gas phase mass spectroscopy for in situ measurements of the processes that occur as the fluorocarbon is heated. An array of volatile products, which vary with the specific treatment, desorb from etched PTFE. Among these are: N 2 and low molecular weight fluorocarbons, the amounts of which monotonically decrease with increasing exposure to the etching solution (and probably result from the bulk); species such as CO and CO 2, which in part result from surface impurities; and water and acetone which result from the rinse steps following the etching process. XPS measurements show that etching produces a major loss of surface F and a gain of surface O. The latter probably results from the subsequent rinse steps. Heating produces a substantial recovery in surface F with only a small decrease in the surface O, and the gain in surface F is shown to occur at a higher temperature than the desorption of any species from the surface. Thus, desorption of products from the surface is decoupled, in terms of both the distribution of products and their relative temperatures, from the surface changes as monitored by XPS. This decoupling suggests that the increase in surface F results from diffusion of low molecular weight fluorocarbons from the bulk or a transition region, or from a rearrangement of the sponge-like surface region produced in the etching process.

  6. Atomic contributions to the valence band photoelectron spectra of metal-free, iron and manganese phthalocyanines

    Energy Technology Data Exchange (ETDEWEB)

    Bidermane, I., E-mail: ieva.bidermane@physics.uu.se [Department of Physics and Astronomy, Uppsala University, Box-516, 75120 Uppsala (Sweden); Institut des Nanosciences de Paris, UPMC Univ. Paris 06, CNRS UMR 7588, F-75005 Paris (France); Brumboiu, I.E. [Department of Physics and Astronomy, Uppsala University, Box-516, 75120 Uppsala (Sweden); Totani, R. [Department of Physical and Chemical Sciences, University of L’Aquila, Via Vetoio, Coppito, I-67010 L’Aquila (Italy); Grazioli, C. [CNR-IOM, Laboratorio TASC, ss. 14 km. 163.5, Basovizza, 34149 Trieste (Italy); Departement of Chemical and Pharmaceutical Sciences, University of Trieste (Italy); Shariati-Nilsson, M.N.; Herper, H.C.; Eriksson, O.; Sanyal, B. [Department of Physics and Astronomy, Uppsala University, Box-516, 75120 Uppsala (Sweden); Ressel, B. [University of Nova Gorica, Vipavska Cesta 11c, 5270 Ajdovščina (Slovenia); Simone, M. de [CNR-IOM, Laboratorio TASC, ss. 14 km. 163.5, Basovizza, 34149 Trieste (Italy); Lozzi, L. [Department of Physical and Chemical Sciences, University of L’Aquila, Via Vetoio, Coppito, I-67010 L’Aquila (Italy); Brena, B.; Puglia, C. [Department of Physics and Astronomy, Uppsala University, Box-516, 75120 Uppsala (Sweden)

    2015-11-15

    Highlights: • In detail comparison between the valence band structure of H{sub 2}Pc, FePc and MnPc. • Comparison between the gas phase samples and thin evaporated films on Au (1 1 1). • Detailed analysis of the atomic orbital contributions to the valence band features. • DFT/HSE06 study of the valence band electronic structure of H{sub 2}Pc, FePc and MnPc. - Abstract: The present work reports a photoelectron spectroscopy study of the low-energy region of the valence band of metal-free phthalocyanine (H{sub 2}Pc) compared with those of iron phthalocyanine (FePc) and manganese phthalocyanine (MnPc). We have analysed in detail the atomic orbital composition of the valence band both experimentally, by making use of the variation in photoionization cross-sections with photon energy, and theoretically, by means of density functional theory. The atomic character of the Highest Occupied Molecular Orbital (HOMO), reflected on the outermost valence band binding energy region, is different for MnPc as compared to the other two molecules. The peaks related to the C 2p contributions, result in the HOMO for H{sub 2}Pc and FePc and in the HOMO-1 for MnPc as described by the theoretical predictions, in very good agreement with the experimental results. The DFT simulations, discerning the atomic contribution to the density of states, indicate how the central metal atom interacts with the C and N atoms of the molecule, giving rise to different partial and total density of states for these three Pc molecules.

  7. Fourier transform photoelectron diffraction and its application to molecular orbitals and surface structure

    Energy Technology Data Exchange (ETDEWEB)

    Zhou, Xin [Pennsylvania State Univ., University Park, PA (United States)

    1998-11-30

    Photoemission intensities from the molecular orbitals of c(2x2)CO/Pt(111) over a wide photon energy range were measured and analyzed by the same methods developed for structural studies using core levels. The 4{sigma} orbital center of gravity is found to be concentrated between the C and O atoms, while that of the 5{sigma} orbital lies between the C atom and the Pt surface. The C 1s photoelectron diffraction was used to determine the adsorption geometry. The earlier ambiguity that multiple scattering is needed to correctly model a {chi} curve while single scattering is sufficient for understanding major peaks in the ARPEFS-FTS is clarified by studying the clean Ni(111) surface. In the normal emission case, several different combinations of scattering events have similar path length differences (PLDs), and can either cancel each other or enhance the corresponding FT peak. In the off-normal case the degeneracy is greatly reduced due to the lower degree of symmetry. In normal emission AR PEFS, up to third order multiple scattering is needed to describe fully both the {chi} curve and its FT spectrum. To improve the spectral resolution in the ARPEFS-FT analysis, several new spectral analysis methods are introduced. With both autocorrelation autoregression (ACAR) and autocorrelation eigenvector (ACE), we can produce a reliable power spectrum by following the order-closing procedure. The best spectra are usually obtained when the autocorrelation sequence is computed with lags up to half the data range. A simple way of determining surface adsorption sites is proposed as follows: First use a single scattering cluster for possible adsorption sites to construct the geometrical PLDs from the strong backscattering events; then compare these PLDs with those obtained from the ARPEFS-FT analysis of the experimental data. After the preferred adsorption site is determined, fine tune the interlayer distances according to the positional R-factor.

  8. Inter-Diffusion of Copper and Hafnium as Studied by X-Ray Photoelectron Spectroscopy

    Science.gov (United States)

    Pearson, Justin Seth

    The purpose of this study is to investigate the interdiffusion of copper and hafnium. Thin films (thicknesses ranging from 100 nm to 150 nm) of hafnium were deposited on a silicon substrate. About 80 nm of copper was then deposited on such samples. High purity samples have been used in this investigation. The deposition of the elements was done by the e-beam technique. The interfaces thus formed were annealed for a fixed time (30 minutes) at temperatures of 100, 200, and 300°C. The samples were characterized in situ by the x-ray photoelectron spectroscopy technique. To carry out the depth profiling of these samples a controlled amount of the over layer was removed and the spectral data were acquired. The argon ion sputtering technique was used to sputter the layers away. Spectral data in the copper 2p and hafnium 4f regions were investigated. The atomic concentration of the constituents as a function of depth across the interface was determined by analyzing the areas under the curves. The depth profiling data thus obtained was analyzed by the Matano-Boltzmann's procedure. For this analysis the Matano plane was determined based on the criteria of equal area on each side of the interface. The Fick's Law second law was used to calculate the interdiffuison coefficient for each of these interfaces. The interdiffusion coefficient as a function of temperature was determined from these analyses. From these coefficients the activation energy and the pre-exponential factor was determined by using the Arrhenius plot. The activation energy was found to be 0.128 eV/atom and the pre-exponential factor was 3.33E-14 cm2/s. The results from this investigation will be useful in the application of Cu/Hf interface in design and fabrication of semiconductor devices.

  9. Ethanol Solvation in Water Studied on a Molecular Scale by Photoelectron Spectroscopy.

    Science.gov (United States)

    Marinho, Ricardo R T; Walz, Marie-Madeleine; Ekholm, Victor; Öhrwall, Gunnar; Björneholm, Olle; de Brito, Arnaldo Naves

    2017-08-24

    Because of the amphiphilic properties of alcohols, hydrophobic hydration is important in the alcohol-water system. In the present paper we employ X-ray photoelectron spectroscopy (XPS) to investigate the bulk and surface molecular structure of ethanol-water mixtures from 0.2 to 95 mol %. The observed XPS binding energy splitting between the methyl C 1s and hydroxymethyl C 1s groups (BES_[CH3-CH2OH]) as a function of the ethanol molar percentage can be divided into different regions: one below 35 mol % with higher values (about 1.53 eV) and one starting at 60 mol % up to 95 mol % with 1.49 eV as an average value. The chemical shifts agree with previous quantum mechanics/molecular mechanics (QM/MM) calculations [ Löytynoja , T. ; J. Phys. Chem. B 2014 , 118 , 13217 ]. According to these calculations, the BES_[CH3-CH2OH] is related to the number of hydrogen bonds between the ethanol and the surrounding molecules. As the ethanol concentration increases, the average number of hydrogen bonds decreases from 2.5 for water-rich mixtures to 2 for pure ethanol. We give an interpretation for this behavior based on how the hydrogen bonds are distributed according to the mixing ratio. Since our experimental data are surface sensitive, we propose that this effect may also be manifested at the interface. From the ratio between the XPS C 1s core lines intensities we infer that below 20 mol % the ethanol molecules have their hydroxyl groups more hydrated and possibly facing the solution's bulk. Between 0.1 and 14 mol %, we show the formation of an ethanol monolayer at approximately 2 mol %. Several parameters are derived for the surface region at monolayer coverage.

  10. X-Ray photoelectron study of actinide (Th, U, Pu, Am nitrates

    Directory of Open Access Journals (Sweden)

    Teterin Yury A.

    2003-01-01

    Full Text Available In this work an X-ray photoelectron spectroscopy study of nitrates Th(NO34.4H2O UO2(NO32-nH2O, Pu(NO34-nH2O, and Am(NO32.nH2O was done in the binding energy range from 0 to 1000 eV in order to draw a correlation of the fine spectral structure parameters with the actinide ions oxidation states close environment structure, and chemical bond nature. The linearity of the dependence of the An5fn line intensity on the number n5f of the An5f electrons was proven to remain up to the Am3+ ion with the electron configu5fra-tion{Rn 5f6. The spectral structure in the binding energy range from 0 to ~ 15 eV was associated with the formation of the outer valence molecular orbitals due to the interaction of the An6d-, 7s, 5f - O2p electrons, and the fine spectral structure in the binding energy range from ~ 15 to ~50 eV - with the formation of the inner valence molecular orbitals due to the interaction of the An6p - O2s electrons from the filled neighboring atomic orbitals of actinide and oxygen in the studied compounds. The fine structure of the core level electron spectra in the binding energy range from ~50 to 1000 eV was shown to correlate with the actinide ion oxidation state.

  11. Photoelectron spectroscopy of the parent anions of the nucleotides, adenosine-5'-monophosphate and 2'deoxyadenosine-5'-monophosphate

    Science.gov (United States)

    Stokes, Sarah T.; Grubisic, Andrej; Li, Xiang; Jae Ko, Yeon; Bowen, Kit H.

    2008-01-01

    The parent anions of the nucleotides, adenosine-5'-monophosphate (AMPH) and 2'deoxyadenosine-5'-monophosphate (dAMPH) were generated in a novel source and their photoelectron spectra recorded with 3.49eV photons. Vertical detachment energy (VDE) and the adiabatic electron affinity (EAa) values were extracted from each of the two spectra. Concurrently, Kobylecka et al. [J. Chem. Phys. 128, 044315 (2008)] conducted calculations which explored electron attachment to dAMPH. Based on the agreement between their calculated and our measured VDE and EAa values, we conclude that the dAMPH- anions studied in these experiments were formed by electron-induced, intramolecular, (barrier-free) proton-transfer as predicted by the calculations. Given the similarities between the photoelectron spectra of dAMPH- and AMPH-, it is likely that AMPH- can be described in the same manner.

  12. Relaxation Dynamics in Photoexcited Chiral Molecules Studied by Time-Resolved Photoelectron Circular Dichroism: Toward Chiral Femtochemistry

    CERN Document Server

    Comby, Antoine; Boggio-Pasqua, Martial; Descamps, Dominique; Légaré, Francois; Nahon, Laurent; Petit, Stéphane; Pons, Bernard; Fabre, Baptiste; Mairesse, Yann; Blanchet, Valérie

    2016-01-01

    Unravelling the main initial dynamics responsible for chiral recognition is a key stepin the understanding of many biological processes. However this challenging task requires a sensitive enantiospecic probe to investigate molecular dynamics on their natural femtosecond timescale. Here we show that, in the gas phase, the ultrafast relaxationdynamics of photoexcited chiral molecules can be tracked by recording Time-ResolvedPhotoElectron Circular Dichroism (TR-PECD) resulting from the photoionisation bya circularly polarized probe pulse. A large forward/backward asymmetry along theprobe propagation axis is observed in the photoelectron angular distribution. Its evolution with pump-probe delay reveals ultrafast dynamics that are inaccessible in theangle-integrated photoelectron spectrum nor via the usual electron emission anisotropyparameter ($\\beta$). PECD, which originates from the electron scattering in the chiral molecular potential, appears as a new sensitive observable for ultrafast molecular dynamicsin ch...

  13. Central role of electronic temperature for photoelectron charge and spin mobilities in p{sup +}-GaAs

    Energy Technology Data Exchange (ETDEWEB)

    Cadiz, F., E-mail: fabian.cadiz@polytechnique.edu; Paget, D.; Rowe, A. C. H. [Physique de la Matière Condensée, Ecole Polytechnique, CNRS, 91128 Palaiseau (France); Peytavit, E.; Arscott, S. [Institut d' Electronique, de Microélectronique et de Nanotechnologie (IEMN), University of Lille, CNRS, Avenue Poincaré, Cité Scientifique, 59652 Villeneuve d' Ascq (France)

    2015-03-02

    The charge and spin mobilities of minority photoelectrons in p{sup +}-GaAs are determined by monitoring the effect of an electric field on the spatial profiles of the luminescence and of its polarization. By using electric fields to increase the photoelectron temperature T{sub e} without significantly changing the hole or lattice temperatures, the charge and spin mobilities are shown to be principally dependent on T{sub e}. For T{sub e} > 70 K, both the charge and spin mobilities vary as T{sub e}{sup −1.3}, while at lower temperatures this changes to an even more rapid T{sub e}{sup −4.3} law. This finding suggests that current theoretical models based on degeneracy of majority carriers cannot fully explain the observed temperature dependence of minority carrier mobility.

  14. Synchrotron-based double imaging photoelectron/photoion coincidence spectroscopy of radicals produced in a flow tube: OH and OD

    Energy Technology Data Exchange (ETDEWEB)

    Garcia, Gustavo A.; Tang, Xiaofeng; Gil, Jean-François; Nahon, Laurent [Synchrotron SOLEIL, L’Orme des Merisiers, St. Aubin, BP 48, 91192 Gif sur Yvette (France); Ward, Michael; Batut, Sebastien; Fittschen, Christa [PC2A, Université de Lille 1, UMR CNRS-USTL 8522, Cité Scientifique Bât. C11, F-59655 Villeneuve d’Ascq (France); Taatjes, Craig A.; Osborn, David L. [Combustion Research Facility, Mail Stop 9055, Sandia National Laboratories, Livermore, California 94551-0969 (United States); Loison, Jean-Christophe [ISM, Université Bordeaux 1, CNRS, 351 cours de la Libération, 33405 Talence Cedex (France)

    2015-04-28

    We present a microwave discharge flow tube coupled with a double imaging electron/ion coincidence device and vacuum ultraviolet (VUV) synchrotron radiation. The system has been applied to the study of the photoelectron spectroscopy of the well-known radicals OH and OD. The coincidence imaging scheme provides a high selectivity and yields the spectra of the pure radicals, removing the ever-present contributions from excess reactants, background, or secondary products, and therefore obviating the need for a prior knowledge of all possible byproducts. The photoelectron spectra encompassing the X{sup 3}Σ{sup −} ground state of the OH{sup +} and OD{sup +} cations have been extracted and the vibrational constants compared satisfactorily to existing literature values. Future advantages of this approach include measurement of high resolution VUV spectroscopy of radicals, their absolute photoionization cross section, and species/isomer identification in chemical reactions as a function of time.

  15. Structure determination of a multilayer with an island-like overlayer using hard x-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Isomura, N., E-mail: isomura@mosk.tytlabs.co.jp; Kataoka, K.; Horibuchi, K.; Dohmae, K.; Kitazumi, K.; Takahashi, N.; Kimoto, Y. [Toyota Central R& D Laboratories, Inc., 41-1 Yokomichi, Nagakute, Aichi 480-1192 (Japan); Oji, H.; Cui, Y.-T.; Son, J.-Y. [Japan Synchrotron Radiation Research Institute (JASRI), 1-1-1 Kouto, Sayo, Hyogo 679-5198 (Japan)

    2016-07-27

    We use hard X-ray photoelectron spectroscopy (HAXPES) to obtain the surface structure of a multilayer Au/SiO{sub 2}/Si substrate sample with an island-like overlayer. Photoelectron intensities are measured as a function of incident photon energy (PE) and take-off angle (TOA, measured from the sample surface). The Au layer coverage and Au and SiO{sub 2} layer thicknesses are obtained by the PE dependence, and are used for the following TOA analysis. The Au island lateral width in the cross section is obtained by the TOA dependence, including information about surface roughness, in consideration of the island shadowing at small TOAs. In both cases, curve-fitting analysis is conducted. The surface structure, which consists of layer thicknesses, overlayer coverage and island width, is determined nondestructively by a combination of PE and TOA dependent HAXPES measurements.

  16. Internal energy dependence of the photodissociation dynamics of O3- using cryogenic photoelectron-photofragment coincidence spectroscopy

    Science.gov (United States)

    Shen, Ben B.; Benitez, Yanice; Lunny, Katharine G.; Continetti, Robert E.

    2017-09-01

    Photoelectron-photofragment coincidence (PPC) spectra of ozonide, O3-, were measured at 388 nm (Ehν = 3.20 eV) using a newly constructed cryogenic octopole accumulation trap coupled to a PPC spectrometer. The photoelectron spectra reveal three processes consisting of a stable photodetachment channel, and two distinct photodissociation pathways yielding (1) O2 + O- or (2) O + O2-. The first photodissociation pathway is observed in the PPC spectra by photodetachment of the O- product by a second photon, and produces electronically excited O2(1Δg). The O2- product of the second photodissociation pathway undergoes autodetachment for O2-(2Πg, v″ > 4), a process greatly enhanced by vibrational excitation of the precursor O3-. Cooling anions thermalized at 300 K to context of the low-lying excited states of O3-.

  17. Room temperature air oxidation of nanostructured Si thin films with varying porosities as studied by x-ray photoelectron spectroscopy

    Science.gov (United States)

    Yang, D.-Q.; Meunier, M.; Sacher, E.

    2006-04-01

    The room temperature air oxidation of nanostructured Si thin films, with varying porosities, has been followed by x-ray photoelectron spectroscopy (XPS), using films deposited by KrF excimer (248 nm) laser ablation in He gas ambients. The overall oxidation, determined from the Si2p XPS spectrum, was shown to be amenable to time-porosity superposition, with the extracted shift factors indicating that oxidation is controlled by the permeability of air in the pores. A model has been developed to describe the room temperature air oxidation process as a function of time and porosity, in accord with the experimental findings. Efforts to determine O:Si atomic ratios from O1s:Si2p spectral ratios have revealed the effect of porosity on both the photoelectron attenuation lengths and the size-dependent photoemission intensities of the nanoparticles that compose the samples.

  18. Electronic Properties of Si-Hx Vibrational Modes at Si Waveguide Interface.

    Science.gov (United States)

    Bashouti, Muhammad Y; Yousefi, Peyman; Ristein, Jürgen; Christiansen, Silke H

    2015-10-01

    Attenuated total reflectance (ATR) and X-ray photoelectron spectroscopy in suite with Kelvin probe were conjugated to explore the electronic properties of Si-Hx vibrational modes by developing Si waveguide with large dynamic detection range compared with conventional IR. The Si 2p emission and work-function related to the formation and elimination of Si-Hx bonds at Si surfaces are monitored based on the detection of vibrational mode frequencies. A transition between various Si-Hx bonds and thus related vibrational modes is monitored for which effective momentum transfer could be demonstrated. The combination of the aforementioned methods provides for results that permit a model for the kinetics of hydrogen termination of Si surfaces with time and advanced surface characterizing of hybrid-terminated semiconducting solids.

  19. Ambient pressure photoelectron spectroscopy: a new tool for surface science and nanotechnology

    Energy Technology Data Exchange (ETDEWEB)

    Salmeron, Miquel; Salmeron, Miquel; Schlogl, Robert

    2008-03-12

    Progress in science often follows or parallels the development of new techniques. The optical microscope helped convert medicine and biology from a speculative activity in old times to today's sophisticated scientific disciplines. The telescope changed the study and interpretation of heavens from mythology to science. X-ray diffraction enabled the flourishing of solid state physics and materials science. The technique object of this review, Ambient Pressure Photoelectron Spectroscopy or APPES for short, has also the potential of producing dramatic changes in the study of liquid and solid surfaces, particularly in areas such as atmospheric, environment and catalysis sciences. APPES adds an important missing element to the host of techniques that give fundamental information, i.e., spectroscopy and microscopy, about surfaces in the presence of gases and vapors, as encountered in industrial catalysis and atmospheric environments. APPES brings electron spectroscopy into the realm of techniques that can be used in practical environments. Decades of surface science in ultra high vacuum (UHV) has shown the power of electron spectroscopy in its various manifestations. Their unique property is the extremely short elastic mean free path of electrons as they travel through condensed matter, of the order of a few atomic distances in the energy range from a few eV to a few thousand eV. As a consequence of this the information obtained by analyzing electrons emitted or scattered from a surface refers to the top first few atomic layers, which is what surface science is all about. Low energy electron diffraction (LEED), Auger electron spectroscopy (AES), X-ray photoelectron spectroscopy (XPS), Ultraviolet photoelectron spectroscopy (UPS), and other such techniques have been used for decades and provided some of the most fundamental knowledge about surface crystallography, composition and electronic structure available today. Unfortunately the high interaction cross section of

  20. Modes of perceiving and imagining

    OpenAIRE

    Nudds, Matthew

    2000-01-01

    We enjoy modes of sensory imagining corresponding to our five modes of perception - seeing, touching, hearing, smelling and tasting. An account of what constitutes these different modes of perseption needs also to explain what constitutes the corresponding modes of sensory perception. In this paper I argue that we can explain what distinguishes the different modes of sensory imagination in terms of their characteristic experiences without supposing that we must distinguish the senses in terms...

  1. A combined photoelectron spectroscopy and relativistic ab initio studies of the electronic structures of UFO and UFO-

    Science.gov (United States)

    Roy, Soumendra K.; Jian, Tian; Lopez, Gary V.; Li, Wei-Li; Su, Jing; Bross, David H.; Peterson, Kirk A.; Wang, Lai-Sheng; Li, Jun

    2016-02-01

    The observation of the gaseous UFO- anion is reported, which is investigated using photoelectron spectroscopy and relativisitic ab initio calculations. Two strong photoelectron bands are observed at low binding energies due to electron detachment from the U-7sσ orbital. Numerous weak detachment bands are also observed due to the strongly correlated U-5f electrons. The electron affinity of UFO is measured to be 1.27(3) eV. High-level relativistic quantum chemical calculations have been carried out on the ground state and many low-lying excited states of UFO to help interpret the photoelectron spectra and understand the electronic structure of UFO. The ground state of UFO- is linear with an O-U-F structure and a 3H4 spectral term derived from a U 7sσ25fφ15fδ1 electron configuration, whereas the ground state of neutral UFO has a 4H7/2 spectral term with a U 7sσ15fφ15fδ1 electron configuration. Strong electron correlation effects are found in both the anionic and neutral electronic configurations. In the UFO neutral, a high density of electronic states with strong configuration mixing is observed in most of the scalar relativistic and spin-orbit coupled states. The strong electron correlation, state mixing, and spin-orbit coupling of the electronic states make the excited states of UFO very challenging for accurate quantum chemical calculations.

  2. Study on the ultrafast dynamics of o-xylene cation by combined fs-photoelectron imaging-photofragmentation spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Yuzhu, E-mail: yuzhu.liu@psi.ch; Radi, Peter; Gerber, Thomas; Knopp, Gregor, E-mail: gregor.knopp@psi.ch

    2014-10-17

    Highlights: • Photoelectron imaging and photofragment spectroscopy are combined. • Photoelectron imaging has been measured to characterize the prepared cation states. • Ultrafast signal decay with time constant of 734 (±61) fs has been observed. - Abstract: Ultrafast dynamics of o-xylene cation has been studied by time resolved fs-photofragmentation (PF) spectroscopy in combination with photoelectron imaging (PEI). In the experiment, multiphoton ionization is used to prepare the o-xylene cation characterized by PEI. The ultrafast dynamics of o-xylene ions are measured by monitoring the time dependent parent-ion depletion and the fragment-ion formation, simultaneously. An ultrafast relaxation time of the parent ion of 734 (±61) fs has been observed. The PEI-PF measurements support the interpretation of this relaxation channel to a combination of internal conversion between the two ionic states (D{sub 0} and D{sub 1}) and intramolecular vibrational-energy redistribution process within the D{sub 0} state.

  3. Size- and intensity-dependent photoelectron spectra from gas-phase gold nanoparticles irradiated by intense femtosecond laser pulses

    Science.gov (United States)

    Powell, J.; Robatjazi, S. J.; Makhija, V.; Vajdi, A.; Li, X.; Malakar, Y.; Pearson, W. L.; Rudenko, A.; Sorensen, C.; Stierle, J.; Kling, M. F.

    2016-05-01

    Nanoparticles bridge the gap between atomic/molecular and bulk matter offering unique opportunities to study light interactions with complex systems, in particular, near-field enhancements and excitation of plasmons. Here we report on a systematic study of photoelectron emission from isolated gold nanoparticles irradiated by 800 nm, 25 fs laser pulses at 10-50 TW/ cm2 peak intensities. A combination of an aerodynamic lens nanoparticle injector, high-energy velocity-map imaging spectrometer and a high-speed, single-shot camera is employed to record shot by shot photoelectron emission patterns from individual particles. By sorting the recorded images according to the number of emitted electrons, we select the events from the regions of particular laser intensities within the laser focus, thus, essentially avoiding focal volume averaging. Using this approach, we study the intensity- and size-dependence of photoelectron energy and angular distributions for particle sizes ranging from 5 nm to 400 nm. This work is supported by NSF Award No. IIA-143049. JRML operations and personal are supported by the Chemical Sciences, Geosciences, and Biosciences Division, Office of BES, Office of Science, U. S. DOE.

  4. Sensitivity of photoelectron diffraction to conformational changes of adsorbed molecules: Tetra-tert-butyl-azobenzene/Au(111).

    Science.gov (United States)

    Schuler, A; Greif, M; Seitsonen, A P; Mette, G; Castiglioni, L; Osterwalder, J; Hengsberger, M

    2017-01-01

    Electron diffraction is a standard tool to investigate the atomic structure of surfaces, interfaces, and adsorbate systems. In particular, photoelectron diffraction is a promising candidate for real-time studies of structural dynamics combining the ultimate time resolution of optical pulses and the high scattering cross-sections for electrons. In view of future time-resolved experiments from molecular layers, we studied the sensitivity of photoelectron diffraction to conformational changes of only a small fraction of molecules in a monolayer adsorbed on a metallic substrate. 3,3',5,5'-tetra-tert-butyl-azobenzene served as test case. This molecule can be switched between two isomers, trans and cis, by absorption of ultraviolet light. X-ray photoelectron diffraction patterns were recorded from tetra-tert-butyl-azobenzene/Au(111) in thermal equilibrium at room temperature and compared to patterns taken in the photostationary state obtained by exposing the surface to radiation from a high-intensity helium discharge lamp. Difference patterns were simulated by means of multiple-scattering calculations, which allowed us to determine the fraction of molecules that underwent isomerization.

  5. Photoelectron imaging spectroscopy of MoC{sup −} and NbN{sup −} diatomic anions: A comparative study

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Qing-Yu; Li, Zi-Yu; He, Sheng-Gui, E-mail: shengguihe@iccas.ac.cn, E-mail: chenh@iccas.ac.cn [Beijing National Laboratory for Molecular Sciences, State Key Laboratory for Structural Chemistry of Unstable and Stable Species, Institute of Chemistry, Chinese Academy of Sciences, Beijing 100190 (China); Hu, Lianrui; Chen, Hui, E-mail: shengguihe@iccas.ac.cn, E-mail: chenh@iccas.ac.cn [Beijing National Laboratory for Molecular Sciences, Key Laboratory of Photochemistry, Institute of Chemistry, Chinese Academy of Sciences, Beijing 100190 (China); Ning, Chuan-Gang [Department of Physics, State Key Laboratory of Low-Dimensional Quantum Physics, Tsinghua University, Beijing 100084 (China); Ma, Jia-Bi [Key Laboratory of Cluster Science, The Institute for Chemical Physics, School of Chemistry, Beijing Institute of Technology, Beijing 100081 (China)

    2015-04-28

    The isoeletronic diatomic MoC{sup −} and NbN{sup −} anions have been prepared by laser ablation and studied by photoelectron imaging spectroscopy combined with quantum chemistry calculations. The photoelectron spectra of NbN{sup −} can be very well assigned on the basis of literature reported optical spectroscopy of NbN. In contrast, the photoelectron spectra of MoC{sup −} are rather complex and the assignments suffered from the presence of many electronically hot bands and limited information from the reported optical spectroscopy of MoC. The electron affinities of NbN and MoC have been determined to be 1.450 ± 0.003 eV and 1.360  ±  0.003 eV, respectively. The good resolution of the imaging spectroscopy provided a chance to resolve the Ω splittings of the X{sup 3}Σ{sup −} (Ω = 0 and 1) state of MoC and the X{sup 4}Σ{sup −} (Ω = 1/2 and 3/2) state of MoC{sup −} for the first time. The spin-orbit splittings of the X{sup 2}Δ state of NbN{sup −} and the a{sup 2}Δ state of MoC{sup −} were also determined. The similarities and differences between the electronic structures of the NbN and MoC systems were discussed.

  6. Sensitivity of photoelectron diffraction to conformational changes of adsorbed molecules: Tetra-tert-butyl-azobenzene/Au(111

    Directory of Open Access Journals (Sweden)

    A. Schuler

    2017-01-01

    Full Text Available Electron diffraction is a standard tool to investigate the atomic structure of surfaces, interfaces, and adsorbate systems. In particular, photoelectron diffraction is a promising candidate for real-time studies of structural dynamics combining the ultimate time resolution of optical pulses and the high scattering cross-sections for electrons. In view of future time-resolved experiments from molecular layers, we studied the sensitivity of photoelectron diffraction to conformational changes of only a small fraction of molecules in a monolayer adsorbed on a metallic substrate. 3,3′,5,5′-tetra-tert-butyl-azobenzene served as test case. This molecule can be switched between two isomers, trans and cis, by absorption of ultraviolet light. X-ray photoelectron diffraction patterns were recorded from tetra-tert-butyl-azobenzene/Au(111 in thermal equilibrium at room temperature and compared to patterns taken in the photostationary state obtained by exposing the surface to radiation from a high-intensity helium discharge lamp. Difference patterns were simulated by means of multiple-scattering calculations, which allowed us to determine the fraction of molecules that underwent isomerization.

  7. Whispering Gallery Mode Thermometry.

    Science.gov (United States)

    Corbellini, Simone; Ramella, Chiara; Yu, Lili; Pirola, Marco; Fernicola, Vito

    2016-10-29

    This paper presents a state-of-the-art whispering gallery mode (WGM) thermometer system, which could replace platinum resistance thermometers currently used in many industrial applications, thus overcoming some of their well-known limitations and their potential for providing lower measurement uncertainty. The temperature-sensing element is a sapphire-crystal-based whispering gallery mode resonator with the main resonant modes between 10 GHz and 20 GHz. In particular, it was found that the WGM around 13.6 GHz maximizes measurement performance, affording sub-millikelvin resolution and temperature stability of better than 1 mK at 0 °C. The thermometer system was made portable and low-cost by developing an ad hoc interrogation system (hardware and software) able to achieve an accuracy in the order of a few parts in 10⁸ in the determination of resonance frequencies. Herein we report the experimental assessment of the measurement stability, repeatability and resolution, and the calibration of the thermometer in the temperature range from -74 °C to 85 °C. The combined standard uncertainty for a single temperature calibration point is found to be within 5 mK (i.e., comparable with state-of-the-art for industrial thermometry), and is mainly due to the employed calibration setup. The uncertainty contribution of the WGM thermometer alone is within a millikelvin.

  8. Whispering Gallery Mode Thermometry

    Directory of Open Access Journals (Sweden)

    Simone Corbellini

    2016-10-01

    Full Text Available This paper presents a state-of-the-art whispering gallery mode (WGM thermometer system, which could replace platinum resistance thermometers currently used in many industrial applications, thus overcoming some of their well-known limitations and their potential for providing lower measurement uncertainty. The temperature-sensing element is a sapphire-crystal-based whispering gallery mode resonator with the main resonant modes between 10 GHz and 20 GHz. In particular, it was found that the WGM around 13.6 GHz maximizes measurement performance, affording sub-millikelvin resolution and temperature stability of better than 1 mK at 0 °C. The thermometer system was made portable and low-cost by developing an ad hoc interrogation system (hardware and software able to achieve an accuracy in the order of a few parts in 109 in the determination of resonance frequencies. Herein we report the experimental assessment of the measurement stability, repeatability and resolution, and the calibration of the thermometer in the temperature range from −74 °C to 85 °C. The combined standard uncertainty for a single temperature calibration point is found to be within 5 mK (i.e., comparable with state-of-the-art for industrial thermometry, and is mainly due to the employed calibration setup. The uncertainty contribution of the WGM thermometer alone is within a millikelvin.

  9. Electron modes of plasma generated at tunnel ionization of atoms by a circularly polarized radiation

    Science.gov (United States)

    Vagin, K. Yu.; Uryupin, S. A.

    2017-10-01

    The collective modes of photoionized plasmas are studied using the model description of electron velocity distribution formed at tunnel ionization of atoms by circularly polarized radiation. The dispersion laws of transverse and approximately longitudinal high-frequency waves propagating at an arbitrary angle to the anisotropy axis of photoelectron distribution are obtained. The dispersion law of potential surface waves is derived. It is shown that the frequency of these waves may be greater than plasma frequency. The aperiodic instability of photoionized plasmas is described.

  10. Radiation effects and metalloproteins studied by x-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Wurzbach, J.A.

    1975-07-01

    X-ray photoelectron spectroscopy (XPS) is used to study the bonding structure at the iron site of cytochrome c and the bonding of rare earth ions to the phosphate oxygens of ATP. Radiation effects are studied on several amino acid and simple peptide model systems. The emission spectrum of the x-ray source is calculated from literature references. The distributions of photon energy as a function of photon frequency and as a function of take-off angle are obtained. From these distributions, the radiation dose absorbed by an organic sample is found to be 10/sup 6/ rads/sec. The C 1s and N 1s spectra of amino acids and peptides are studied to characterize an internal reference standard for protein XPS spectra. Samples of native cytochrome c prepared from solutions of pH 1.5, 3, 7, and 11 are studied. Control samples include porphyrin cytochrome c (PCC), the metal free analogue of the native protein, and microperoxidase (MP), a mixture of heme peptides derived from the peptic digestion of cytochrome c. These samples show two S 2p peaks. The first peak has a binding energy (BE) of 163 eV, which corresponds to the S containing amino acids; the second peak is shifted to 167 eV. This large shift may be the result of Fe-S binding, or oxidation, or both. Low spin ferricytochrome c and ferri-MP were found to have Fe 3p BE's that are unusually low (51 eV) compared to other ferric compounds (54 to 58 eV) and even Fe metal (53 eV). X-ray crystal structures of these compounds show that low spin heme Fe lies in the porphyrin plane; while, high spin heme Fe is displaced above the plane. The N 1s and P 2p spectra of ATP show no change except slight broadening when Nd/sup 3 +/ is substituted for Na/sup +/. Thus, there is no inconsistency with proposals that rare earth ions might be useful as substitutes for alkali metal ions and alkaline earth ions in proteins.

  11. Photoelectron Spectroscopy of Nitrogen Containing Molecules of Biological and Industrial Interest

    Science.gov (United States)

    Pinto, Rui Montenegro Val-do-Rio

    The work presented herein is based on the gas-phase spectroscopic characterization of several molecules of high nitrogen content which are relevant to organic synthesis, industry and fundamental research on molecular physics. It is mainly an experimental enterprise on selected organic azides and tetrazoles, with heavy support on theoretical results from readily available computational methods. Part of the work relies on the design and construction of scientific apparatus, which substantially improve the existing equipment and extend the limits of the experiment. The electronic structure and gas-phase thermal decomposition of methyl 2-azidopropionate (M2AP, N3CH3CHCO2CH 3), benzyl azide (BA, C6H5CH2N 3), 2-, 3- and 4- methyl benzyl azide (2-, 3- and 4-MBA, CH3C 6H4CH2N3), 5-aminotetrazole (5ATZ, NH2CN4H), and 5-methyltetrazole (5MTZ, CH3CN 4H) are investigated through photoelectron spectroscopy, using either He(I) (21.22 eV) or synchrotron radiation in the Xray range. Relevant information obtained from mass spectrometry and matrix-isolation infrared spectroscopy is used to complement characterization of the samples. Regarding each molecules' thermal decomposition, pathways are proposed which account for the observed end products. Conformational analysis is performed, and the special case of annular tautomerism is addressed in the tetrazole compounds. High-temperature pyrolysis work is performed in collaboration with the University of Southampton, and XPS analysis using synchrotron radiation is performed at Elettra, the multidisciplinary synchrotron light laboratory in Trieste, Italy. Experimental findings are rationalized using different computational methods, based on post-Hartree-Fock approaches: many-body perturbation theory (MPn), configuration interaction (CI) and Green's function methods (OVGF, P3), as well as density functional theory (DFT), are used extensively to obtain optimized molecular geometries, ionization energies, orbital contours, relative energies

  12. Mode-to-mode energy transfers in convective patterns

    Indian Academy of Sciences (India)

    Abstract. We investigate the energy transfer between various Fourier modes in a low- dimensional model for thermal convection. We have used the formalism of mode-to-mode energy transfer rate in our calculation. The evolution equations derived using this scheme is the same as those derived using the hydrodynamical ...

  13. Low kinetic energy photoelectron diffractions for C 1s and O 1s electrons of free CO molecules in the EXAFS region

    Energy Technology Data Exchange (ETDEWEB)

    Adachi, Jun-ichi; Yamazaki, Masakazu; Kimura, Yasuyuki; Yagishita, Akira [Photon Factory, IMSS, KEK, 1-1 Oho, Tsukuba 305-0801 (Japan); Kazama, Misato; Ohori, Yusuke; Fujikawa, Takashi [Graduate School of Advanced Integration Science, Chiba University, 1-33 Yayoi-cho, Inage 263-8522 (Japan); Teramoto, Takahiro, E-mail: jun-ichi.adachi@kek.j [Graduate School of Science, University of Tokyo, Bunkyo-ku, Tokyo, 113-0033 (Japan)

    2009-11-15

    We have measured molecular-frame photoelectron angular distributions from carbon 1s and oxygen 1s levels of CO molecules up to a photoelectron kinetic energy (KE) of {approx}150 eV. The backward-scattering intensities exhibited a strong modulation as a function of the kinetic energy of the photoelectrons, whereas the intensities for the forward-scattering gradually increased and then became nearly constant over KE {approx}100 eV. Multiple scattering calculations with a muffin-tin potential qualitatively reproduced the experimental results. The present results may be considered as the observation of low-energy photoelectron diffraction patterns for gaseous free CO molecules, which are involved in modulations in extended X-ray absorption fine structure (EXAFS) spectra.

  14. The electron spectro-microscopy beamline at National Synchrotron Light Source II: a wide photon energy range, micro-focusing beamline for photoelectron spectro-microscopies.

    Science.gov (United States)

    Reininger, R; Hulbert, S L; Johnson, P D; Sadowski, J T; Starr, D E; Chubar, O; Valla, T; Vescovo, E

    2012-02-01

    A comprehensive optical design for a high-resolution, high-flux, wide-energy range, micro-focused beamline working in the vacuum ultraviolet and soft x-ray photon energy range is proposed. The beamline is to provide monochromatic radiation to three photoelectron microscopes: a full-field x-ray photoelectron emission microscope and two scanning instruments, one dedicated to angle resolved photoemission spectroscopy (μ-ARPES) and one for ambient pressure x-ray photoelectron spectroscopy and scanning photoelectron microscopy (AP-XPS/SPEM). Microfocusing is achieved with state of the art elliptical cylinders, obtaining a spot size of 1 μm for ARPES and 0.5 μm for AP-XPS/SPEM. A detailed ray tracing analysis quantitatively evaluates the overall beamline performances.

  15. Azimuthal decomposition of optical modes

    CSIR Research Space (South Africa)

    Dudley, Angela L

    2012-07-01

    Full Text Available This presentation analyses the azimuthal decomposition of optical modes. Decomposition of azimuthal modes need two steps, namely generation and decomposition. An azimuthally-varying phase (bounded by a ring-slit) placed in the spatial frequency...

  16. Free boundary ballooning mode representation

    Science.gov (United States)

    Zheng, L. J.

    2012-10-01

    A new type of ballooning mode invariance is found in this paper. Application of this invariance is shown to be able to reduce the two-dimensional problem of free boundary high n modes, such as the peeling-ballooning modes, to a one-dimensional problem. Here, n is toroidal mode number. In contrast to the conventional ballooning representation, which requires the translational invariance of the Fourier components of the perturbations, the new invariance reflects that the independent solutions of the high n mode equations are translationally invariant from one radial interval surrounding a single singular surface to the other intervals. The conventional ballooning mode invariance breaks down at the vicinity of plasma edge, since the Fourier components with rational surfaces in vacuum region are completely different from those with rational surfaces in plasma region. But, the new type of invariance remains valid. This overcomes the limitation of the conventional ballooning mode representation for studying free boundary modes.

  17. Aristotelian Syllogistic, Subalternate Modes, Theophrastus’ Modes and the Fourth Figure

    OpenAIRE

    СЛИНИН Я.А.

    2015-01-01

    In his treatise «New Essays Concerning Human Understanding» Leibniz gives some evidence which suggests that he believed that each of the four figures of Aristotle’s categorical syllogism has 6 correct modes. It is known that Aristotle stated and proved correct syllogisms modes in the three figures, with the fi rst of them having a number of the indirect modes. Why Aristotle did not explicitly introduced into his syllogistic subalternative modes and modes with conversed conclusion? In the pape...

  18. Damage mechanics - failure modes

    Energy Technology Data Exchange (ETDEWEB)

    Krajcinovic, D.; Vujosevic, M. [Arizona State Univ., Tempe, AZ (United States)

    1996-12-31

    The present study summarizes the results of the DOE sponsored research program focused on the brittle failure of solids with disordered microstructure. The failure is related to the stochastic processes on the microstructural scale; namely, the nucleation and growth of microcracks. The intrinsic failure modes, such as the percolation, localization and creep rupture, are studied by emphasizing the effect of the micro-structural disorder. A rich spectrum of physical phenomena and new concepts that emerges from this research demonstrates the reasons behind the limitations of traditional, deterministic, and local continuum models.

  19. Localized Acoustic Surface Modes

    KAUST Repository

    Farhat, Mohamed

    2015-08-04

    We introduce the concept of localized acoustic surface modes (ASMs). We demonstrate that they are induced on a two-dimensional cylindrical rigid surface with subwavelength corrugations under excitation by an incident acoustic plane wave. Our results show that the corrugated rigid surface is acoustically equivalent to a cylindrical scatterer with uniform mass density that can be represented using a Drude-like model. This, indeed, suggests that plasmonic-like acoustic materials can be engineered with potential applications in various areas including sensing, imaging, and cloaking.

  20. Standardization of Keyword Search Mode

    Science.gov (United States)

    Su, Di

    2010-01-01

    In spite of its popularity, keyword search mode has not been standardized. Though information professionals are quick to adapt to various presentations of keyword search mode, novice end-users may find keyword search confusing. This article compares keyword search mode in some major reference databases and calls for standardization. (Contains 3…

  1. Raman amplification of OAM modes

    DEFF Research Database (Denmark)

    Ingerslev, Kasper; Gregg, Patrick; Galili, Michael

    2017-01-01

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

  2. Fluxon modes in superconducting multilayers

    DEFF Research Database (Denmark)

    Pedersen, Niels Falsig; Madsen, Søren Peder

    2004-01-01

    We show how to construct fluxon modes from plasma modes in the inductively coupled stacked Josephson junctions, and consider some special cases of these fluxon modes analytically. In some cases we can find exact analytical solutions when we choose the bias current in a special way. We also consid...

  3. Design of large mode area, mode selection fiber

    Science.gov (United States)

    Jin, Liang; Xu, Li; Zhang, He; Zou, Yonggang; Ding, Ye; Ma, Xiaohui

    2014-12-01

    The paper study on the effect of index distribution on the mode field and calculated the mode distribution in various index profiles. A single mode gaussian hybrid multicore fiber with 19 hexagonally arranged high index quartz rods is designed and investigated. Theoretical and simulative results are presented and compared to the conventional large mode area double clad fiber, the fundamental mode (FM) area can be reached 694.28 μm2, the confinement loss of FM and high order modes (HOMs) are 0.186 dB/m and 1.48 dB/m respectively with the bending radius of 20 cm at 1.064 μm wavelength, moreover, the index distribution can resistant the mode field distortion, which caused by fiber bending. So the FM delivery can be formed and the beam quality can be improved.

  4. Photodissociation of Small Molecules and Photoionization of Free Radicals Using the VUV Velocity-Map Imaging Photoion and Photoelectron Method

    Science.gov (United States)

    Gao, Hong

    The tunable vacuum ultraviolet (VUV) laser generated through the two-photon resonance-enhanced four-wave mixing scheme is combined with the newly developed time-slice velocity map imaging photoion method to study the photodissociation of small molecules in the VUV region, and with the velocity map imaging photoelectron method to study the photoionization of free radicals. The photodissociation dynamics of NO in the energy region around 13.5 eV has been investigated. Branching ratios of the three lowest dissociation channels of 12C 16O that produce C(3P) + O(3P), C( 1D) + O(3P) and C(3P) + O(1D) are measured for the first time in the VUV region from 102,500 cm-1 to 110,500 cm-1, valuable information of the dissociation dynamics for this prototype system has been deduced. We demonstrated an experiment that has two independently tunable VUV lasers and a time-slice velocity map imaging setup, this provides us a global way to perform systematic state-selected photodissociation of small molecules via state-selected detection of the atomic products in the VUV region. The velocity map imaging photoelectron method was successfully used to obtain the photoelectron spectrum of the propargyl radical (C3H3) via a single VUV photoionization process. The propargyl radical is generated by the 193 nm laser photodissociation of the precursor C3H3Cl. This is the first time that the velocity map imaging photoelectron method is used to get the photoelectron spectra of free radicals, indicating that it is a powerful technique for studying the photoionization of free radicals which are always hard to be produced with high enough number densities for spectroscopic studies. This dissertation is mainly based on the following peer-reviewed journal articles: 1. Hong Gao, Yang Pan, Lei Yang, Jingang Zhou, C. Y. Ng and William M. Jackson. "Time-slice velocity-map ion imaging studies of the Photodissociation of NO in the vacuum ultraviolet region", the Journal of Chemical Physics, 136, 134302

  5. Electronic states and growth modes of Zn atoms deposited on Cu(111) studied by XPS, UPS and DFT

    Science.gov (United States)

    Koitaya, Takanori; Shiozawa, Yuichiro; Yoshikura, Yuki; Mukai, Kozo; Yoshimoto, Shinya; Torii, Siro; Muttaqien, Fahdzi; Hamamoto, Yuji; Inagaki, Kouji; Morikawa, Yoshitada; Yoshinobu, Jun

    2017-09-01

    Electronic states and growth modes of the Zn-deposited Cu(111) surface at 300 K were quantitatively studied using core-level and valence photoelectron spectroscopies. Both Cu 2p and Zn 2p core-levels shifted to higher binding energy with increasing the amount of deposited Zn up to multilayer. The origin of the core-level shift of Cu 2p was further investigated by density functional theory calculations; the shift of the Cu 2p peak results from the change in the effective electrostatic potential (initial state effect) caused by the formation of Zn-Cu surface alloy, and the increase of coordination numbers of surface Cu atoms by Zn overlayer. The observed valence photoelectron spectra show the formation of the two atomic-layer Zn-Cu alloy up to the Zn coverage of 1 ML, followed by the formation of three-dimensional Zn islands on the alloyed surface at 300 K.

  6. Viscoelastic pulsational mode

    Science.gov (United States)

    Dutta, Pranamika; Karmakar, Pralay Kumar

    2017-08-01

    We present a theoretical model analysis to study the linear pulsational mode dynamics in viscoelastic complex self-gravitating infinitely extended clouds in the presence of active frictional coupling and dust-charge fluctuations. The complex cloud consists of uniformly distributed lighter hot mutually thermalized electrons and ions, and heavier cold dust grains amid partial ionization in a homogeneous, quasi-neutral, hydrostatic equilibrium configuration. A normal mode analysis over the closed set of slightly perturbed cloud governing equations is employed to obtain a generalized dispersion relation (septic) of unique analytic construct on the plasma parameters. Two extreme cases of physical interest depending on the perturbation scaling, hydrodynamic limits and kinetic limits are considered. It is shown that the grain mass and viscoelastic relaxation time associated with the charged dust fluid play stabilizing roles to the fluctuations in the hydrodynamic regime. In contrast, however in the kinetic regime, the stabilizing effects are introduced by the dust mass, dust equilibrium density and equilibrium ionic population distribution. Besides, the oscillatory and propagatory features are illustrated numerically and interpreted in detail. The results are in good agreement with the previously reported findings as special corollaries in like situations. Finally, a focalized indication to new implications and applications of the outcomes in the astronomical context is foregrounded.

  7. Metal-polymer interfaces studied with adsorption microcalorimetry and photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Bebensee, Fabian

    2010-06-21

    The interface formation between calcium and two different semiconducting, ?-conjugated polymers, namely poly(3-hexylthiophene) (P3HT) and poly[2-methoxy-5-(2-ethylhexyloxy)-1,4-(1-cyanovilylene)phenylene] (CN-MEH-PPV), was investigated using adsorption microcalorimetry, low energy ion scattering spectroscopy (LEIS), atomic beam scattering and X-ray photoelectron spectroscopy. In addition to the interface formation on pristine, i.e., untreated polymer surfaces, the influence of electron irradiation prior to calcium deposition and the effect of dosing calcium at a low substrate temperature was studied. The reactive site for the interaction of calcium atoms impinging on a pristine P3HT surface appears to be the sulfur in the thiophene ring, as is concluded from a combination of XPS, adsorption calorimetry and theory results. The interaction, in fact, is strong enough that the sulfur atoms abstracted from the thiophene ring under formation of calcium sulfide with an overall reaction energy of this process of 405 kJ per mol. Quantitative evaluation of XPS data reveal that the depth up to which Ca atoms react with sulfur in the polymer is 3 nm, irrespective of increasing the amount of Ca dosed onto the substrate. A closed layer of Ca is only formed at a Ca coverage exceeding 11 ML, as suggested by LEIS. Irradiation of P3HT with electrons with a kinetic energy of 100 eV results in dehydrogenation of the hexyl side chains and formation of new C=C double bonds. This in turn results in a higher initial sticking probability of 0.63 for Ca, while no other significant changes could be observed: XPS indicates that the thiophene rings remain intact and the measured heat of adsorption is the same as observed for the deposition of Ca on pristine P3HT. Dosing Ca onto P3HT held at low temperature (130 K) is found to result in a very low saturation thickness of the reacted layer of approximately 0.3 nm. Upon warming the sample up to room temperature, the thickness of the reacted layer

  8. Surface study of stainless steel electrode deposition from soil electrokinetic (EK) treatment using X-ray photoelectron spectroscopy (XPS)

    Energy Technology Data Exchange (ETDEWEB)

    Embong, Zaidi, E-mail: zaidi@uthm.edu.my [Faculty of Science, Technology and Human Development, Universiti Tun Hussien Onn Malaysia (UTHM) 86400, Parit Raja, Batu, Johor (Malaysia); Research Centre for Soft Soils (RECESS), Office for Research, Innovation, Commercialization and Consultancy Management (ORICC), Universiti Tun Hussien Onn Malaysia UTHM 86400, Parit Raja, Batu, Johor (Malaysia); Johar, Saffuwan [Faculty of Science, Technology and Human Development, Universiti Tun Hussien Onn Malaysia (UTHM) 86400, Parit Raja, Batu, Johor (Malaysia); Tajudin, Saiful Azhar Ahmad [Research Centre for Soft Soils (RECESS), Office for Research, Innovation, Commercialization and Consultancy Management (ORICC), Universiti Tun Hussien Onn Malaysia UTHM 86400, Parit Raja, Batu, Johor (Malaysia); Sahdan, Mohd Zainizan [Microelectronics and Nanotechnology Centre (MiNT-SRC), Office for Research, Innovation, Commercialization and Consultancy Management (ORICC), Universiti Tun Hussien Onn Malaysia UTHM 86400, Parit Raja, Batu, Johor (Malaysia)

    2015-04-29

    Electrokinetic (EK) remediation relies upon application of a low-intensity direct current through the soil between stainless steel electrodes that are divided into a cathode array and an anode array. This mobilizes charged species, causing ions and water to move toward the electrodes. Metal ions and positively charged organic compounds move toward the cathode. Anions such as chloride, fluoride, nitrate, and negatively charged organic compounds move toward the anode. Here, this remediation techniques lead to a formation of a deposition at the both cathode and anode surface that mainly contributed byanion and cation from the remediated soil. In this research, Renggam-Jerangau soil species (HaplicAcrisol + RhodicFerralsol) with a surveymeter reading of 38.0 ± 3.9 μR/hr has been investigation in order to study the mobility of the anion and cation under the influence electric field. Prior to the EK treatment, the elemental composition of the soil and the stainless steel electrode are measured using XRF analyses. Next, the soil sample is remediated at a constant electric potential of 30 V within an hour of treatment period. A surface study for the deposition layer of the cathode and anode using X-ray Photoelectron spectroscopy (XPS) revealed that a narrow photoelectron signal from oxygen O 1s, carbon, C 1s silica, Si 2p, aluminium, Al 2p and chromium, Cr 2p exhibited on the electrode surface and indicate that a different in photoelectron intensity for each element on both electrode surface. In this paper, the mechanism of Si{sup 2+} and Al{sup 2+} cation mobility under the influence of voltage potential between the cathode and anode will be discussed in detail.

  9. A combined photoelectron spectroscopy and relativistic ab initio studies of the electronic structures of UFO and UFO(-).

    Science.gov (United States)

    Roy, Soumendra K; Jian, Tian; Lopez, Gary V; Li, Wei-Li; Su, Jing; Bross, David H; Peterson, Kirk A; Wang, Lai-Sheng; Li, Jun

    2016-02-28

    The observation of the gaseous UFO(-) anion is reported, which is investigated using photoelectron spectroscopy and relativisitic ab initio calculations. Two strong photoelectron bands are observed at low binding energies due to electron detachment from the U-7sσ orbital. Numerous weak detachment bands are also observed due to the strongly correlated U-5f electrons. The electron affinity of UFO is measured to be 1.27(3) eV. High-level relativistic quantum chemical calculations have been carried out on the ground state and many low-lying excited states of UFO to help interpret the photoelectron spectra and understand the electronic structure of UFO. The ground state of UFO(-) is linear with an O-U-F structure and a (3)H4 spectral term derived from a U 7sσ(2)5fφ(1)5fδ(1) electron configuration, whereas the ground state of neutral UFO has a (4)H(7/2) spectral term with a U 7sσ(1)5fφ(1)5fδ(1) electron configuration. Strong electron correlation effects are found in both the anionic and neutral electronic configurations. In the UFO neutral, a high density of electronic states with strong configuration mixing is observed in most of the scalar relativistic and spin-orbit coupled states. The strong electron correlation, state mixing, and spin-orbit coupling of the electronic states make the excited states of UFO very challenging for accurate quantum chemical calculations.

  10. Epitaxial grapheme on SiC(0001) and SiC(000-1): a photoelectron diffraction (XPD) study

    Energy Technology Data Exchange (ETDEWEB)

    Lima, L.H.; Siervo, A.; Landers, R. [Universidade Estadual de Campinas (IFGW/UNICAMP), SP (Brazil). Inst. de Fisica Gleb Wataghin; Goncalves, A.B.; Lacerda, R.G. [Universidade Federal de Minas Gerais (UFMG), Belo Horizonte, MG (Brazil). Dept. de Fisica; Tapia, P.H. [Universidad Tecnica Federico Santa Maria, Valparaiso (Chile)

    2011-07-01

    Full text. A flat, single layer of graphite known as grapheme has become the focus of studies due to its exceptional properties and fascinating applications. Large scale grapheme layers for a possible application can be grown epitaxially on SiC by Si sublimation. Even before the interest in grapheme, the surface of SiC was already extensively studied. It exhibits a large variety of surface reconstructions and these reconstructions are very dependent of sample preparation and orientation (0001) or (000-1). In this study, we show a preliminary investigation of the structural properties of grapheme layers on SiC (0001) e SiC (000-1) by photoelectron diffraction (XPD). The surfaces were prepared by heating the 1x1 surface to temperatures of about 1150 deg C in high ultra vacuum and the various reconstructions were monitored by Low Energy Electron Diffraction (LEED) and X-Ray Photoelectron Spectroscopy (XPS). In particular for the Si-terminated surface, that is SiC(0001), the interface between grapheme and SiC is characterized by the so-called (6{radical}3 x 6{radical}3) R30 deg reconstruction (buffer layer). The interpretation of this reconstruction, which is the initial stage of graphitization, has lead to controversy in the literature. We will further discuss the buffer layer structure in terms of the XPD results. The XPD experiments were performed at SGM beam line at LNLS using photons with 400/450 eV probing the Si2p and C1s core level. The C1s signal was separate in to contributions from volume and surface and compares the experimental results with photoelectron multiple scattering calculations performed with the MSCD package

  11. Time-resolved photoelectron spectroscopy of polyatomic molecules using 42-nm vacuum ultraviolet laser based on high harmonics generation

    Science.gov (United States)

    Nishitani, Junichi; West, Christopher W.; Higashimura, Chika; Suzuki, Toshinori

    2017-09-01

    Time-resolved photoelectron spectroscopy (TRPES) of gaseous polyatomic molecules using 266-nm (4.7 eV) pump and 42-nm (29.5 eV) probe pulses is presented. A 1-kHz Ti:sapphire laser with a 35 fs pulse duration is employed to generate high harmonics in Kr gas, and the 19th harmonic (42-nm) was selected using two SiC/Mg mirrors. Clear observation of the ultrafast electronic dephasing in pyrazine and photoisomerization of 1,3-cyclohexadiene demonstrates the feasibility of TRPES with the UV pump and VUV probe pulses under weak excitation conditions in the perturbation regime.

  12. Depth-resolved soft x-ray photoelectron emission microscopy in nanostructures via standing-wave excited photoemission

    Energy Technology Data Exchange (ETDEWEB)

    Kronast, F.; Ovsyannikov, R.; Kaiser, A.; Wiemann, C.; Yang, S.-H.; Locatelli, A.; Burgler, D.E.; Schreiber, R.; Salmassi, F.; Fischer, P.; Durr, H.A.; Schneider, C.M.; Eberhardt, W.; Fadley, C.S.

    2008-11-24

    We present an extension of conventional laterally resolved soft x-ray photoelectron emission microscopy. A depth resolution along the surface normal down to a few {angstrom} can be achieved by setting up standing x-ray wave fields in a multilayer substrate. The sample is an Ag/Co/Au trilayer, whose first layer has a wedge profile, grown on a Si/MoSi2 multilayer mirror. Tuning the incident x-ray to the mirror Bragg angle we set up standing x-ray wave fields. We demonstrate the resulting depth resolution by imaging the standing wave fields as they move through the trilayer wedge structure.

  13. Photoelectron yield spectroscopy and inverse photoemission spectroscopy evaluations of p-type amorphous silicon carbide films prepared using liquid materials

    Energy Technology Data Exchange (ETDEWEB)

    Murakami, Tatsuya, E-mail: mtatsuya@jaist.ac.jp, E-mail: mtakashi@jaist.ac.jp [Center for Nano Materials and Technology, Japan Advanced Institute of Science and Technology (JAIST), 1-1 Asahidai, Nomi, Ishikawa 923-1292 (Japan); Masuda, Takashi, E-mail: mtatsuya@jaist.ac.jp, E-mail: mtakashi@jaist.ac.jp; Inoue, Satoshi; Shimoda, Tatsuya [Green Device Research Center, Japan Advanced Institute of Science and Technology, Nomi, Ishikawa 923-1211 (Japan); Yano, Hiroshi; Iwamuro, Noriyuki [Graduate School of Pure and Applied Sciences, University of Tsukuba, Tennoudai, Tsukuba, Ibaraki 305-8573 (Japan)

    2016-05-15

    Phosphorus-doped amorphous silicon carbide films were prepared using a polymeric precursor solution. Unlike conventional polymeric precursors, this polymer requires neither catalysts nor oxidation for its synthesis and cross-linkage, providing semiconducting properties in the films. The valence and conduction states of resultant films were determined directly through the combination of inverse photoemission spectroscopy and photoelectron yield spectroscopy. The incorporated carbon widened energy gap and optical gap comparably in the films with lower carbon concentrations. In contrast, a large deviation between the energy gap and the optical gap was observed at higher carbon contents because of exponential widening of the band tail.

  14. Counterintuitive angular shifts in the photoelectron momentum distribution for atoms in strong few-cycle circularly polarized laser pulses

    DEFF Research Database (Denmark)

    Martiny, Christian; Abu-Samha, Mahmoud; Madsen, Lars Bojer

    2009-01-01

    We solve the three-dimensional time-dependent Schrödinger equation for a three-cycle circularly polarized laser pulse interacting with an atom. The photoelectron momentum distributions show counterintuitive shifts, similar to those observed in a recent experiment (Eckle et al 2008 Science 322 1525......). The physical origin of the shifts is examined by a detailed investigation of the wave packet after the pulse. We show that the shifts arise as a consequence of an intimate interplay between the external field and the binding potential, and that the shifts occur also at lower intensities than used...

  15. Monolithic mode-selective few-mode multicore fiber multiplexers.

    Science.gov (United States)

    Riesen, Nicolas; Gross, Simon; Love, John D; Sasaki, Yusuke; Withford, Michael J

    2017-08-01

    With the capacity limits of standard single-mode optical fiber fast approaching, new technologies such as space-division multiplexing are required to avoid an Internet capacity crunch. Few-mode multicore fiber (FM-MCF) could allow for a two orders of magnitude increase in capacity by using the individual spatial modes in the different cores as unique data channels. We report the realization of a monolithic mode-selective few-mode multicore fiber multiplexer capable of addressing the individual modes of such a fiber. These compact multiplexers operate across the S + C + L telecommunications bands and were inscribed into a photonic chip using ultrafast laser inscription. They allow for the simultaneous multiplexing of the LP 01 , LP 11a and LP 11b modes of all cores in a 3-mode, 4-core fiber with excellent mode extinction ratios and low insertion losses. The devices are scalable to more modes and cores and therefore could represent an enabling technology for practical ultra-high capacity dense space-division multiplexing.

  16. Polarization Mode Dispersion

    CERN Document Server

    Galtarossa, Andrea

    2005-01-01

    This book contains a series of tutorial essays on polarization mode dispersion (PMD) by the leading experts in the field. It starts with an introductory review of the basic concepts and continues with more advanced topics, including a thorough review of PMD mitigation techniques. Topics covered include mathematical representation of PMD, how to properly model PMD in numerical simulations, how to accurately measure PMD and other related polarization effects, and how to infer fiber properties from polarization measurements. It includes discussions of other polarization effects such as polarization-dependent loss and the interaction of PMD with fiber nonlinearity. It additionally covers systems issues like the impact of PMD on wavelength division multiplexed systems. This book is intended for research scientists or engineers who wish to become familiar with PMD and its system impacts.

  17. The Integrated Mode Management Interface

    Science.gov (United States)

    Hutchins, Edwin

    1996-01-01

    Mode management is the processes of understanding the character and consequences of autoflight modes, planning and selecting the engagement, disengagement and transitions between modes, and anticipating automatic mode transitions made by the autoflight system itself. The state of the art is represented by the latest designs produced by each of the major airframe manufacturers, the Boeing 747-400, the Boeing 777, the McDonnell Douglas MD-11, and the Airbus A320/A340 family of airplanes. In these airplanes autoflight modes are selected by manipulating switches on the control panel. The state of the autoflight system is displayed on the flight mode annunciators. The integrated mode management interface (IMMI) is a graphical interface to autoflight mode management systems for aircraft equipped with flight management computer systems (FMCS). The interface consists of a vertical mode manager and a lateral mode manager. Autoflight modes are depicted by icons on a graphical display. Mode selection is accomplished by touching (or mousing) the appropriate icon. The IMMI provides flight crews with an integrated interface to autoflight systems for aircraft equipped with flight management computer systems (FMCS). The current version is modeled on the Boeing glass-cockpit airplanes (747-400, 757/767). It runs on the SGI Indigo workstation. A working prototype of this graphics-based crew interface to the autoflight mode management tasks of glass cockpit airplanes has been installed in the Advanced Concepts Flight Simulator of the CSSRF of NASA Ames Research Center. This IMMI replaces the devices in FMCS equipped airplanes currently known as mode control panel (Boeing), flight guidance control panel (McDonnell Douglas), and flight control unit (Airbus). It also augments the functions of the flight mode annunciators. All glass cockpit airplanes are sufficiently similar that the IMMI could be tailored to the mode management system of any modern cockpit. The IMMI does not replace the

  18. Real-time observation of multi-mode vibronic coherence in pentafluoropyridine

    Science.gov (United States)

    Kus, J. A.; Hüter, O.; Temps, F.

    2017-07-01

    The ultrafast dynamics of pentafluoropyridine in the 1 1B2 (ππ*) electronic state excited at λpump = 255 nm is investigated by femtosecond time-resolved time-of-flight mass spectrometry and photoelectron imaging spectroscopy. A pronounced, long-lived, and complex periodic modulation of the transient ion yield signal with contributions by four distinct frequency components, 72 cm-1, 144 cm-1, 251 cm-1, and 281 cm-1, is observed for up to 9 ps. The recorded photoelectron images display a spectral band from the excited 1 1B2 (ππ*) state only in the oscillation maxima; the signal is strongly reduced in the oscillation minima. Supported by electronic structure calculations at the RI-SCS-CC2 and XMCQDPT2 levels of theory, the oscillating components of the signal are identified as frequencies of b1 symmetry coupling modes in a vibronic coherence of the 1 1B2 (ππ*) and 1 1A2 (πσ*) electronic states. The optical excitation initiates regular and periodic wavepacket motion along those out-of-plane modes. In the distorted molecular structure, the initially excited state acquires substantial πσ* character that modulates the transition dipole moment for ionization and results in the observed oscillations.

  19. X-ray photoelectron spectroscopic studies of the oxidation of aluminium by liquid water monitored in an anaerobic cell.

    Science.gov (United States)

    Rotole, J A; Sherwood, P M

    2001-02-01

    The oxidation of clean polycrystalline aluminium foil was performed in a previously described anaerobic cell and studied by core level and valence band X-ray photoelectron spectroscopy. Oxide free sample surfaces were exposed under inert atmosphere at room temperature to increasingly oxidative environments of water vapor and liquid water beginning with an oxide free metal foil each time. Minor oxidative environments were found to produce a film of boehmite with a thinner outer film of gibbsite. Harsher oxidation in liquid water resulted in an oxide film much thicker than that found on the as received sample which contained an inner composition of gamma alumina with an outer film of gibbsite. As expected, the oxide film observed for ultra high purity polycrystalline aluminiurm foil in the as received state was gibbsite. The valence band of the cleaned metal is discussed in terms of residual surface species. The evaluation and determination of these residual surface species is evaluated following an analysis of two different band structure calculations which use different d orbital exponents. It is found that while the density of states is almost unaltered by changes in the d exponent, the predicted spectrum is substantially changed. The work makes extensive use of valence band X-ray photoelectron spectroscopy.

  20. Photoelectron spectra and structure of the Mn{sub n}{sup −} anions (n = 2–16)

    Energy Technology Data Exchange (ETDEWEB)

    Gutsev, G. L., E-mail: gennady.gutsev@famu.edu; Weatherford, C. A. [Department of Physics, Florida A& M University, Tallahassee, Florida 32307 (United States); Ramachandran, B. R. [College of Engineering and Science, Louisiana Tech University, Ruston, Louisiana 71272 (United States); Gutsev, L. G. [Department of Chemistry and Biochemistry, Florida State University, Tallahassee, Florida 32306 (United States); Zheng, W.-J.; Thomas, O. C.; Bowen, Kit H., E-mail: kbowen@jhu.edu [Departments of Chemistry and Materials Science, Johns Hopkins University, Baltimore, Maryland 21218 (United States)

    2015-07-28

    Photoelectron spectra of the Mn{sub n}{sup −} anion clusters (n = 2–16) are obtained by anion photoelectron spectroscopy. The electronic and geometrical structures of the anions are computed using density functional theory with generalized gradient approximation and a basis set of triple-ζ quality. The electronic and geometrical structures of the neutral Mn{sub n} clusters have also been computed to estimate the adiabatic electron affinities. The average absolute difference between the computed and experimental vertical detachment energies of an extra electron is about 0.2 eV. Beginning with n = 6, all lowest total energy states of the Mn{sub n}{sup −} anions are ferrimagnetic with the spin multiplicities which do not exceed 8. The computed ionization energies of the neutral Mn{sub n} clusters are in good agreement with previously obtained experimental data. According to the results of our computations, the binding energies of Mn atoms are nearly independent on the cluster charge for n > 6 and possess prominent peaks at Mn{sub 13} and Mn{sub 13}{sup −} in the neutral and anionic series, respectively. The density of states obtained from the results of our computations for the Mn{sub n}{sup −} anion clusters show the metallic character of the anion electronic structures.

  1. X-ray photoelectron spectroscopy study of the functionalization of carbon metal-containing nanotubes with phosphorus atoms

    Energy Technology Data Exchange (ETDEWEB)

    Shabanova, I.N., E-mail: xps@fti.udm.ru; Terebova, N.S.

    2013-08-15

    Highlights: •Carbon metal-containing nanotubes (Me–Cu, Ni, Fe) were functionalized with chemical groups containing different concentrations of phosphorous. •The C1s and Me3s spectra were measured by the X-ray photoelectron spectroscopy method. •The values of the atomic magnetic moment of the carbon metal-containing nanotubes were determined. -- Abstract: In the present paper, carbon metal-containing (Me: Cu, Ni, Fe) nanotubes functionalized with phosphorus atoms (ammonium polyphosphate) were studied by X-ray photoelectron spectroscopy (XPS) on an X-ray electron magnetic spectrometer. It is found that the functionalization leads to the change of the metal atomic magnetic moment, i.e. the value of the atomic magnetic moment in the functionalized carbon metal-containing (Cu, Ni, Fe) nanotubes increases and is higher than that in pristine nanotubes. It is shown that the covalent bond of Me and P atoms is formed. This leads to an increase in the activity of the nanostructure surface which is necessary for the modification of materials.

  2. Structure of the c(2x2) Mn/Ni(001) surface alloy by quantitative photoelectron diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Banerjee, S.; Denlinger, J.; Chen, X. [Univ. of Wisconsin, Milwaukee, WI (United States)] [and others

    1997-04-01

    Surface alloys are two-dimensional metallic systems that can have structures that are unique to the surface, and have no counterpart in the bulk binary phase diagram. A very unusual structure was reported for the Mn-Ni system, based on a quantitative LEED structure determination, which showed that the Mn atoms were displaced out of the surface by a substantial amount. This displacement was attributed to a large magnetic moment on the Mn atoms. The structure of the Mn-Ni surface alloy was proposed to be based on a bulk termination model. Magnetic measurements on the Mn-Ni surface alloys, however, showed conclusively that the magnetic structure of these surface alloys is completely different from the bulk alloy analogs. For example, bulk MnNi is an antiferromagnet, whereas the surface alloy is ferromagnetic. This suggests that the proposed structure based on bulk termination, may not be correct. X-ray Photoelectron Diffraction (XPD) techniques were used to investigate this structure, using both a comparison to multiple scattering calculations and photoelectron holography. In this article the authors present some of the results from the quantitative analysis of individual diffraction patterns by comparison to theory.

  3. Evaluation of band offset at amorphous-Si/BaSi{sub 2} interfaces by hard x-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Takabe, Ryota; Takeuchi, Hiroki; Du, Weijie; Toko, Kaoru; Suemasu, Takashi [Institute of Applied Physics, University of Tsukuba, Tsukuba, Ibaraki 305-8573 (Japan); Ito, Keita [Institute of Applied Physics, University of Tsukuba, Tsukuba, Ibaraki 305-8573 (Japan); Japan Society for the Promotion of Science (JSPS), Chiyoda, Tokyo 102-0083 (Japan); Department of Electronic Engineering, Graduate School of Engineering, Tohoku University, Sendai 980-8579 (Japan); Ueda, Shigenori [Synchrotron X-Ray Station at SPring-8, National Institute for Materials Science (NIMS), Sayo, Hyogo 679-5148 (Japan); Quantum Beam Unit, NIMS, Tsukuba, Ibaraki 305-0047 (Japan); Kimura, Akio [Graduate School of Science, Hiroshima University, Higashi-Hiroshima 739-8526 (Japan)

    2016-04-28

    The 730 nm-thick undoped BaSi{sub 2} films capped with 5 nm-thick amorphous Si (a-Si) intended for solar cell applications were grown on Si(111) by molecular beam epitaxy. The valence band (VB) offset at the interface between the BaSi{sub 2} and the a-Si was measured by hard x-ray photoelectron spectroscopy to understand the carrier transport properties by the determination of the band offset at this heterointerface. We performed the depth-analysis by varying the take-off angle of photoelectrons as 15°, 30°, and 90° with respect to the sample surface to obtain the VB spectra of the BaSi{sub 2} and the a-Si separately. It was found that the barrier height of the a-Si for holes in the BaSi{sub 2} is approximately −0.2 eV, whereas the barrier height for electrons is approximately 0.6 eV. This result means that the holes generated in the BaSi{sub 2} layer under solar radiation could be selectively extracted through the a-Si/BaSi{sub 2} interface, promoting the carrier separation in the BaSi{sub 2} layer. We therefore conclude that the a-Si/BaSi{sub 2} interface is beneficial for BaSi{sub 2} solar cells.

  4. Features of atomic images reconstructed from photoelectron, Auger electron, and internal detector electron holography using SPEA-MEM

    Energy Technology Data Exchange (ETDEWEB)

    Matsushita, Tomohiro, E-mail: matusita@spring8.or.jp [Japan Synchrotron Radiation Research Institute, SPring-8, Sayo, Hyogo 679-5198 (Japan); Matsui, Fumihiko [Graduate School of Materials Science, Nara Institute of Science and Technology, Ikoma, Nara 630-0192 (Japan)

    2014-08-15

    Highlights: • We develop a 3D atomic image reconstruction algorithm for photoelectron, Auger electron, and internal detector holography. • We examine the shapes of the atomic images reconstructed by using a developed kernel function. • We examine refraction effect at surface, limitation effect of the hologram data, energy resolution effect, and angular resolution effect. • These discussions indicate the experimental requirements to obtain the clear 3D atomic image. - Abstract: Three-dimensional atomic images can be reconstructed from photoelectron, Auger electron, and internal detector electron holograms using a scattering pattern extraction algorithm using the maximum entropy method (SPEA-MEM) that utilizes an integral transform. An integral kernel function for the integral transform is the key to clear atomic image reconstruction. We composed the kernel function using a scattering pattern function and estimated its ability. Image distortion caused by multiple scattering was also evaluated. Four types of Auger electron wave functions were investigated, and the effect of these wave function types was estimated. In addition, we addressed refraction at the surface, the effects of data limitation, and energy and angular resolutions.

  5. Ionization potential and electron attenuation length of titanium dioxide deposited by atomic layer deposition determined by photoelectron spectroscopy in air

    Science.gov (United States)

    Marques, Francisco C.; Jasieniak, Jacek J.

    2017-11-01

    Photoelectron emission spectroscopy in air (PESA) has been used to investigate titanium dioxide (TiO2) deposited by atomic layer deposition (ALD). A procedure has been developed to unambiguously determine the photoemission threshold energy (also referred to as the ;ionization potential;) of TiO2 thin films, avoiding inherent artifacts due to photoelectron emission from the substrate, which supplies misleading results. This has been achieved using PESA measurements performed as a function of TiO2 film thickness on two substrates with different work functions. We find that proper measurements of the photoemission threshold energy (including work function and ionization potential) of thin films by PESA require the use of films much thicker than their electron attenuation length (EAL). A photoemission threshold energy of 5.0 ± 0.2 eV is obtained for TiO2 and has been attributed to a trap level due to oxygen vacancies, which lie within the band gap of the TiO2. The analysis of the photoemission decay with film thickness also provides a method for determining a ;practical; (or effective) EAL at excitation energy slightly above the photoemission threshold energy of the material. We extract an EAL for the deposited TiO2 of 0.65 ± 0.02 nm (at 0.5 eV). The procedure can also be adopted for determining the thickness of extremely thin films, provided their thickness is smaller than their EAL.

  6. In-situ observation of oxidation of Ti(0001) surface by real-time photoelectron spectroscopy using synchrotron radiation

    CERN Document Server

    Takakuwa, Y; Yoshigoe, A; Teraoka, Y; Mizuno, Y; Tonda, H; Homma, T

    2003-01-01

    Temperature dependence of the initial oxidation kinetics of Ti(0001) surface was investigated by low energy electron diffraction (LEED) and real-time photoelectron spectroscopy using synchrotron radiation of surface- and bulk-sensitive photon energies. LEED observation revealed that oxide layers grow epitaxially with different surface structures depending on temperature: 1x1 at 200degC and sq root 3 x sq root 3 at 400degC. From the oxygen uptake curve measured by O 1s photo-electron intensity, it was clarified that oxygen diffusion through the epitaxially grown oxide layer is significantly enhanced with raising temperature, making the oxide layer thicker than 70A at 400degC. The chemical shift components observed for Ti 2p showed that TiO sub 2 becomes predominant at the subsurface with O sub 2 dose, while the stoichiometry of oxide near the interface is maintained as TiO and Ti sub 2 O sub 3 , for both cases at 200degC and 400degC. Thus it is concluded that the epitaxial growth of a very thin oxide on the Ti...

  7. Prominent conjugate processes in the PCI recapture of photoelectrons revealed by high resolution Auger electron measurements of Xe

    Science.gov (United States)

    Azuma, Yoshiro; Kosugi, Satoshi; Suzuki, Norihiro; Shigemasa, Eiji; Iwayama, Hiroshi; Koike, Fumihiro

    2016-05-01

    The Xe (N5O2 , 3O2 , 3) Auger electron spectrum originating from 4d5/ 2 - 1 photoionization was measured with the photon energy tuned very close above the ionization threshold. As the photon energy approached the 4d5/ 2 - 1 photoionization threshold, Rydberg series structures including several angular momentum components were formed within the Auger profile by the recapture of the photoelectrons into high-lying final ion orbitals. Our spectrum with resolution much narrower than the lifetime width of the corresponding core excited state allowed us to resolve detailed structures due to the orbital angular momenta very clearly. Unexpectedly, conjugate peaks originating from the exchange of angular momentum between the photoelectron and the Auger electron through Post-Collision-Interaction were found to dominate the spectrum. The new assignments were in accord with the quantum defect values obtained for the high Rydberg series for singly charged ionic Xe + 5 p(1S0) ml. This work was supported by Japan Society for the Promotion of Science through Grants-in-Aid for Scientific Research No. 23600009.

  8. 50 years anniversary of the discovery of the core level chemical shifts. The early years of photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Mårtensson, Nils [Department of Physics and Astronomy, Uppsala University, Box 516, 751 20 Uppsala (Sweden); Sokolowski, Evelyn [Tvär-Ramsdal 1, 611 99 Tystberga (Sweden); Svensson, Svante, E-mail: Svante.Svensson@fysik.uu.se [Department of Physics and Astronomy, Uppsala University, Box 516, 751 20 Uppsala (Sweden)

    2014-03-01

    Highlights: • 50 years since the discovery of t the core level chemical shift. • The pioneering years of ESCA. • A critical review of the first core electron chemical shift results. - Abstract: The pioneering years of photoelectron spectroscopy in Uppsala are discussed, especially the work leading to the discovery of the core level chemical shifts. At a very early stage of the project, the pioneering group observed what they described as evidence for chemical shifts in the core level binding energies. However, it can now be seen that the initial observations to a large extent was due to charging of the samples. It is interesting to note that the decisive experiment was realized, not as a result of a systematic study, but was obtained with a large element of serendipity. Only when a chemical binding energy shift was observed between two S2p electron lines in the same molecule, the results were accepted internationally, and the fascinating expansion of modern core level photoelectron spectroscopy could start.

  9. Waveguides having patterned, flattened modes

    Energy Technology Data Exchange (ETDEWEB)

    Messerly, Michael J.; Pax, Paul H.; Dawson, Jay W.

    2015-10-27

    Field-flattening strands may be added to and arbitrarily positioned within a field-flattening shell to create a waveguide that supports a patterned, flattened mode. Patterning does not alter the effective index or flattened nature of the mode, but does alter the characteristics of other modes. Compared to a telecom fiber, a hexagonal pattern of strands allows for a three-fold increase in the flattened mode's area without reducing the separation between its effective index and that of its bend-coupled mode. Hexagonal strand and shell elements prove to be a reasonable approximation, and, thus, to be of practical benefit vis-a-vis fabrication, to those of circular cross section. Patterned flattened modes offer a new and valuable path to power scaling.

  10. Multiple-scattering calculations for 1s photoelectron angular distributions from single oriented molecules in the energy region above 50 eV

    Energy Technology Data Exchange (ETDEWEB)

    Kazama, Misato, E-mail: misato-k@graduate.chiba-u.jp [Graduate School of Advanced Integration Science, Chiba University, 1-33 Yayoi-cho, Inage, Chiba 263-8522 (Japan); Shinotsuka, Hiroshi; Fujikawa, Takashi [Graduate School of Advanced Integration Science, Chiba University, 1-33 Yayoi-cho, Inage, Chiba 263-8522 (Japan); Stener, Mauro; Decleva, Piero [Dipartimento di Scienze Chimiche, Universita di Trieste, Via L. Giorgieri 1, I-34127 Trieste (Italy); Adachi, Jun-ichi; Mizuno, Tomoya; Yagishita, Akira [Photon Factory, Institute of Materials Structure Science, KEK, 1-1 Oho, Tsukuba, Ibaraki 305-0801 (Japan)

    2012-11-15

    Highlights: Black-Right-Pointing-Pointer We calculate X-ray photoelectron angular distributions for oriented molecules. Black-Right-Pointing-Pointer We compare these results with DFT theory and experimental data. Black-Right-Pointing-Pointer The multiple-scattering theory well reproduces experimental angular distributions. Black-Right-Pointing-Pointer Our theory is powerful to describe photoelectron angular distributions above 50 eV. -- Abstract: 1s photoelectron angular distributions from fixed-in-space CO{sub 2}, NO{sub 2}, BF{sub 3} and CH{sub 3}F molecules have been calculated by X-ray photoelectron diffraction (XPD) theory with muffin-tin-type molecular potential. For all the molecules, the calculated results show good agreements with those by density functional theory in the energy region Greater-Than-Or-Equivalent-To 100 eV. Furthermore, for all the molecules experimental data on the angular distributions in such energy region are well reproduced by the XPD theory. These intensive studies lead to a rather general rule that the XPD theory is an adequate tool to describe high-energy photoelectron angular distributions for any single oriented molecules.

  11. Whispering gallery mode sensors.

    Science.gov (United States)

    Foreman, Matthew R; Swaim, Jon D; Vollmer, Frank

    2015-06-30

    We present a comprehensive overview of sensor technology exploiting optical whispering gallery mode (WGM) resonances. After a short introduction we begin by detailing the fundamental principles and theory of WGMs in optical microcavities and the transduction mechanisms frequently employed for sensing purposes. Key recent theoretical contributions to the modeling and analysis of WGM systems are highlighted. Subsequently we review the state of the art of WGM sensors by outlining efforts made to date to improve current detection limits. Proposals in this vein are numerous and range, for example, from plasmonic enhancements and active cavities to hybrid optomechanical sensors, which are already working in the shot noise limited regime. In parallel to furthering WGM sensitivity, efforts to improve the time resolution are beginning to emerge. We therefore summarize the techniques being pursued in this vein. Ultimately WGM sensors aim for real-world applications, such as measurements of force and temperature, or alternatively gas and biosensing. Each such application is thus reviewed in turn, and important achievements are discussed. Finally, we adopt a more forward-looking perspective and discuss the outlook of WGM sensors within both a physical and biological context and consider how they may yet push the detection envelope further.

  12. Intrinsic localized modes and nonlinear impurity modes in curved ...

    Indian Academy of Sciences (India)

    We explore the nature of intrinsic localized modes (ILMs) in a curved Fermi–. Pasta–Ulam (FPU) chain ... We further demonstrate that a nonlinear impurity mode may be treated as a bound state of an ILM with the impurity .... length [14] and see that the particular choice of the chain geometry ensures the DB propagation with ...

  13. Mode Launcher Design for the Multi-moded DLDS

    CERN Document Server

    Li, Z

    2003-01-01

    The DLDS (Delay Line Distribution System) power delivery system proposed by KEK combines several klystrons to obtain the high peak power required to drive a TeV scale linear collider. In this system the combined klystron output is subdivided into shorter pulses by proper phasing of the sources, and each subpulse is delivered to various accelerator sections via separate waveguides. A cost-saving improvement suggested by SLAC is to use a single multimoded waveguide to deliver the power of all the subpulses. This scheme requires a mode launcher that can deliver each subpulse by way of a different waveguide mode through selective phasing of the sources when combining their power. We present a compact design for such a mode launcher that converts the power from four rectangular waveguide feeds to separate modes in a multi-moded circular guide through coupling slots. Such a design has been simulated and found to satisfy the requirements for high efficiency and low surface fields.

  14. An experimental and theoretical study of the valence shell photoelectron spectra of 2-chloropyridine and 3-chloropyridine

    Science.gov (United States)

    Holland, D. M. P.; Powis, I.; Trofimov, A. B.; Menzies, R. C.; Potts, A. W.; Karlsson, L.; Badsyuk, I. L.; Moskovskaya, T. E.; Gromov, E. V.; Schirmer, J.

    2017-10-01

    The valence shell photoelectron spectra of 2-chloropyridine and 3-chloropyridine have been studied both experimentally and theoretically. Synchrotron radiation has been employed to record angle resolved photoelectron spectra in the photon energy range 20-100 eV, and these have enabled anisotropy parameters and branching ratios to be derived. The experimental results have been compared with theoretical predictions obtained using the continuum multiple scattering Xα approach. This comparison shows that the anisotropy parameter associated with the nominally chlorine lone-pair orbital lying in the molecular plane is strongly affected by the atomic Cooper minimum. In contrast, the photoionization dynamics of the second lone-pair orbital, orientated perpendicular to the molecular plane, seem relatively unaffected by this atomic phenomenon. The outer valence ionization has been studied theoretically using the third-order algebraic-diagrammatic construction (ADC(3)) approximation scheme for the one-particle Green's function, the outer valence Green's function method, and the equation-of-motion (EOM) coupled cluster (CC) theory at the level of the EOM-IP-CCSD and EOM-EE-CC3 models. The convergence of the results to the complete basis set limit has been investigated. The ADC(3) method has been employed to compute the complete valence shell ionization spectra of 2-chloropyridine and 3-chloropyridine. The relaxation mechanism for ionization of the nitrogen σ-type lone-pair orbital (σN LP) has been found to be different to that for the corresponding chlorine lone-pair (σCl LP). For the σN LP orbital, π-π* excitations play the main role in the screening of the lone-pair hole. In contrast, excitations localized at the chlorine site involving the chlorine πCl LP lone-pair and the Cl 4p Rydberg orbital are the most important for the σCl LP orbital. The calculated photoelectron spectra have allowed assignments to be proposed for most of the structure observed in the

  15. Theory of psychological adaptive modes.

    Science.gov (United States)

    Lehti, Juha

    2016-05-01

    When an individual is facing a stressor and normal stress-response mechanism cannot guarantee sufficient adaptation, special emotional states, adaptive modes, are activated (for example a depressive reaction). Adaptive modes are involuntary states of mind, they are of comprehensive nature, they interfere with normal functioning, and they cannot be repressed or controlled the same way as many emotions. Their transformational nature differentiates them from other emotional states. The object of the adaptive mode is to optimize the problem-solving abilities according to the situation that has provoked the mode. Cognitions and emotions during the adaptive mode are different than in a normal mental state. These altered cognitions and emotional reactions guide the individual to use the correct coping skills in order to deal with the stressor. Successful adaptation will cause the adaptive mode to fade off since the adaptive mode is no longer necessary, and the process as a whole will lead to raised well-being. However, if the adaptation process is inadequate, then the transformation period is prolonged, and the adaptive mode will turn into a dysfunctional state. Many psychiatric disorders are such maladaptive processes. The maladaptive processes can be turned into functional ones by using adaptive skills that are used in functional adaptive processes. Copyright © 2016 Elsevier Ltd. All rights reserved.

  16. Transformation and Modes of Production

    DEFF Research Database (Denmark)

    Høst, Jeppe Engset

    2015-01-01

    modes of production and examine the ways of life that are enabled by the two modes of production. The central questions are around how market-based fisheries management transforms the principal preconditions for the self-employed fishers; and, in turn, why capitalist organized large-scale fisheries...

  17. Pump-probe experiments at the TEMPO beamline using the low-α operation mode of Synchrotron SOLEIL.

    Science.gov (United States)

    Silly, Mathieu G; Ferté, Tom; Tordeux, Marie Agnes; Pierucci, Debora; Beaulieu, Nathan; Chauvet, Christian; Pressacco, Federico; Sirotti, Fausto; Popescu, Horia; Lopez-Flores, Victor; Tortarolo, Marina; Sacchi, Maurizio; Jaouen, Nicolas; Hollander, Philippe; Ricaud, Jean Paul; Bergeard, Nicolas; Boeglin, Christine; Tudu, Bharati; Delaunay, Renaud; Luning, Jan; Malinowski, Gregory; Hehn, Michel; Baumier, Cédric; Fortuna, Franck; Krizmancic, Damjan; Stebel, Luigi; Sergo, Rudi; Cautero, Giuseppe

    2017-07-01

    The SOLEIL synchrotron radiation source is regularly operated in special filling modes dedicated to pump-probe experiments. Among others, the low-α mode operation is characterized by shorter pulse duration and represents the natural bridge between 50 ps synchrotron pulses and femtosecond experiments. Here, the capabilities in low-α mode of the experimental set-ups developed at the TEMPO beamline to perform pump-probe experiments with soft X-rays based on photoelectron or photon detection are presented. A 282 kHz repetition-rate femtosecond laser is synchronized with the synchrotron radiation time structure to induce fast electronic and/or magnetic excitations. Detection is performed using a two-dimensional space resolution plus time resolution detector based on microchannel plates equipped with a delay line. Results of time-resolved photoelectron spectroscopy, circular dichroism and magnetic scattering experiments are reported, and their respective advantages and limitations in the framework of high-time-resolution pump-probe experiments compared and discussed.

  18. Mode Combinations and International Operations

    DEFF Research Database (Denmark)

    Benito, Gabriel R. G.; Petersen, Bent; Welch, Lawrence S.

    2011-01-01

    An enduring characteristic of extant literature on foreign operation modes is its discrete choice approach, where companies are assumed to choose one among a small number of distinctive alternatives. In this paper we use detailed information about the operations of six Norwegian companies in three...... key markets (China, UK and USA) as the basis for an exploration of the extent to which, and how and why, companies combine clearly different foreign operation modes. We examine their use of foreign operation mode combinations within given value activities as well as within given countries. The study...... reveals that companies tend to combine modes of operation; thereby producing unique foreign operation mode “packages” for given activities and/or countries, and that the packages are liable to be modified over time – providing a potentially important optional path for international expansion. Our data...

  19. Mode Combinations and International Operations

    DEFF Research Database (Denmark)

    Benito, Gabriel R. G.; Petersen, Bent; Welch, Lawrence S.

    2011-01-01

    An enduring characteristic of extant literature on foreign operation modes is its discrete choice approach, where companies are assumed to choose one among a small number of distinctive alternatives. In this paper, detailed information about the operations of six Norwegian companies in three key...... markets (China, UK and USA) is used as the basis for an exploration of the extent to which, and how and why, companies combine clearly different foreign operation modes. We examine their use of foreign operation mode combinations within given value activities as well as within given countries. The study...... reveals that companies tend to combine modes of operation; thereby producing unique foreign operation mode “packages” for given activities and/or countries, and that the packages are liable to be modified over time—providing a potentially important optional path for international expansion. The data show...

  20. Photoelectron spectroscopy study of interaction of oxygen with the (111) surface of a Cu-Zn alloy

    Science.gov (United States)

    Ozawa, Kenichi; Mimori, Yuhei; Kato, Hiroo; Imanishi, Saori; Edamoto, Kazuyuki; Mase, Kazuhiko

    2014-05-01

    Interaction of O atoms with the (111) surface of a Cu-Zn alloy with a face-centered cubic structure (α-brass) is investigated by photoelectron spectroscopy utilizing synchrotron radiation. The O adatoms interact mainly with the Zn atoms to form the ZnO islands, whereas the Cusbnd O bond formation is negligible in the initial oxidation stages at room temperature. O adsorption induces a binding-energy shift of the Shockley-type surface states towards the Fermi level. Also induced is a lowering of the work function of the α-brass(111) surface. These O-induced changes resemble those on the alkali-metal-covered Cu (111) surface. Similarity between Zn on the brass surface and alkali metals adsorbed on Cu (111) in initial oxidation is discussed.

  1. On the intrinsic photophysics of indigo: a time-resolved photoelectron spectroscopy study of the indigo carmine dianion.

    Science.gov (United States)

    Chatterley, Adam S; Horke, Daniel A; Verlet, Jan R R

    2012-12-14

    The intrinsic photophysics of indigo has been studied using gas-phase time-resolved photoelectron imaging of the indigo carmine dianion (InC(2-)). The action spectrum reveals that the gas-phase absorption spectrum arising from the S(1) indigo. Femtosecond spectroscopy shows that the S(1) state decays on a 1.4 ps timescale. Through isotopic substitution, the primary mechanism on the S(1) excited state can be assigned to an intra-molecular proton transfer, which is the same as that which has been observed in solution. However, the excited state lifetime is significantly shorter in vacuum. These similarities and differences are discussed in terms of recent theoretical investigations of the S(1) excited state of indigo.

  2. Modeling the Photoelectron Spectra of MoNbO2(-) Accounting for Spin Contamination in Density Functional Theory.

    Science.gov (United States)

    Thompson, Lee M; Hratchian, Hrant P

    2015-08-13

    Spin contamination in density functional studies has been identified as a cause of discrepancies between theoretical and experimental spectra of metal oxide clusters such as MoNbO2. We perform calculations to simulate the photoelectron spectra of the MoNbO2 anion using broken-symmetry density functional theory incorporating recently developed approximate projection methods. These calculations are able to account for the presence of contaminating spin states at single-reference computational cost. Results using these new tools demonstrate the significant effect of spin-contamination on geometries and force constants and show that the related errors in simulated spectra may be largely overcome by using an approximate projection model.

  3. CO adsorption on Pd(100) studied by multimodal ambient pressure X-ray photoelectron and infrared reflection absorption spectroscopies

    Science.gov (United States)

    Head, Ashley R.; Karslıoǧlu, Osman; Gerber, Timm; Yu, Yi; Trotochaud, Lena; Raso, Joseph; Kerger, Philipp; Bluhm, Hendrik

    2017-11-01

    The adsorption of CO on Pd(100) was investigated using simultaneous ambient pressure X-ray photoelectron spectroscopy (APXPS) and infrared reflection absorption infrared spectroscopy (IRRAS). The measurements were performed as a function of CO partial pressures from ultra-high vacuum to 0.5 Torr. Total CO coverages estimated from the complementary APXPS and IRRAS measurements are in good agreement. A signal for atop CO, which is uncommon for Pd(100), was observed in the IRRAS data and was used to identify the C 1 s binding energy of this species. Discerning this binding configuration of CO on the Pd(100) surface at elevated pressures has significance for catalytic reactions involving CO, where bridging CO is often the only configuration considered. We also detail the combined APXPS/IRRAS instrumentation and discuss ways to improve these multimodal measurements, which should have wide applicability across many areas of surface and interface science.

  4. Associative Electron Attachment to 2-Aminopyridine-(CO{sub 2}){sub 1} Complex: Photoelectron Spectroscopic and Theoretical Approach

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Namdoo [Seoul National Univ., Seoul (Korea, Republic of)

    2013-08-15

    We investigated the associative electron attachment to the [2AP-(CO{sub 2}){sub 1}] van der Waal complex using anion photoelectron spectroscopy and theoretical calculations. We found a covalent bond formation between 2AP and CO{sub 2} opposite to that seen in [Pd-(CO{sub 2}){sub 2}]{sup -} which could not form an additional covalent bond due to the steric hindrance. Excess negative charge is totally delocalized to the entire complex to give extended π-conjugation. Carbon dioxide is a very inert molecule whose reactivity is low at room temperature. It does not make a stable anion in the gas phase since it has a negative adiabatic electron affinity (AEA). Instead, it becomes a metastable anion with quite a long lifetime (< 100 μs) when it adopts a bent geometry which differs greatly from the geometry of the neutral species.

  5. Momentum-resolved photoelectron absorption in surface barrier scattering on Ir(111) and graphene/Ir(111)

    Science.gov (United States)

    Zaporozhchenko-Zymaková, A.; Kutnyakhov, D.; Medjanik, K.; Tusche, C.; Fedchenko, O.; Chernov, S.; Ellguth, M.; Nepijko, S. A.; Elmers, H. J.; Schönhense, G.

    2017-10-01

    Time-of-flight momentum microscopy reveals sixfold symmetric sharp features of decreased intensity (dark lines) in constant-energy maps for clean Ir(111) and graphene/Ir(111). The dark lines have been observed for p - and s -polarized light in the photon-energy range of 20-27 eV and result from scattering of photoelectrons at the surface potential barrier. The phenomenon is strongly related to threshold effects in low-energy electron diffraction. A quantitative analysis of the dark lines' positions shows that the relevant reciprocal-lattice vector corresponds to the lattice of the topmost layer (in our case graphene and Ir, respectively). The dark lines appear in the momentum patterns only in a certain photon-energy range satisfying the additional condition that the electron wavelength matches the lattice periodicity.

  6. Induced-field enhancement of band-structure effects in photoelectron spectra from Al surfaces by ultrashort laser pulses

    Science.gov (United States)

    Ríos Rubiano, C. A.; Della Picca, R.; Mitnik, D. M.; Silkin, V. M.; Gravielle, M. S.

    2017-03-01

    The electron emission produced by the grazing incidence of ultrashort laser pulses on two faces of aluminum, Al(100) and Al(111), is investigated using the band-structure-based-Volkov (BSB-V) approximation. The present version of the BSB-V approach includes not only a realistic description of the surface interaction, accounting for band-structure effects, but also effects due to the induced potential that originates from the collective response of valence electrons to the external electromagnetic field. For both crystallographic orientations we found that the induced potential contributes to the emergence of band-structure signatures in the near-threshold region of photoelectron spectra. This result opens a window to scrutinize band-structure effects in metal surfaces via ultrashort-laser interactions.

  7. Optical and x-ray photoelectron spectroscopy studies of α-Al{sub 2}O{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Prakash, Ram, E-mail: rpgiuc@gmail.com, E-mail: ramprakash@smvdu.ac.in; Kumar, Sandeep; Kumar, Vinay [School of Physics, Shri Mata Vaishno Devi University, Katra 182320 J& K (India); Choudhary, R. J.; Phase, D. M. [UGC DAE Consortium for Scientific Research, Indore-452001 (India)

    2016-05-23

    α-Al{sub 2}O{sub 3} powder sample was synthesized at 550 °C via solution combustion synthesis (SCS) method using urea as an organic fuel. The sample was characterized by X-ray diffraction (XRD), Optical spectroscopy and X-ray photoelectron spectroscopy (XPS) without any further thermal treatment. XRD study reveals that the powder crystallized directly in the hexagons α-Al{sub 2}O{sub 3} phase. A band gap of 5.7 eV was estimated using diffuse reflectance spectra. For surface investigation X-ray photo electron spectroscopy (XPS) was carried out. The XPS survey scan study of α-Al{sub 2}O{sub 3} powder reveals that the sample is free from impurity. The core levels of Al-2s and O-1s are also reported.

  8. Structures and magnetic properties of CrSin- (n = 3-12) clusters: Photoelectron spectroscopy and density functional calculations

    Science.gov (United States)

    Kong, Xiangyu; Xu, Hong-Guang; Zheng, Weijun

    2012-08-01

    Chromium-doped silicon clusters, CrSin-(n = 3-12), were investigated with anion photoelectron spectroscopy and density functional theory calculations. The combination of experimental measurement and theoretical calculations reveals that the onset of endohedral structure in CrSin- clusters occurs at n = 10 and the magnetic properties of the CrSin- clusters are correlated to their geometric structures. The most stable isomers of CrSin- from n = 3 to 9 have exohedral structures with magnetic moments of 3-5μB while those of CrSi10-, CrSi11-, and CrSi12- have endohedral structures and magnetic moments of 1μB.

  9. Water adsorption on SrTiO3(001) studied by x-ray standing wave excited photoelectron spectroscopy

    Science.gov (United States)

    Zegenhagen, Jorg; Solokha, Vladyslav; Wilson, Axel; Duncan, David; Garai, Debi; Hingerl, Kurt

    We investigated the nature of water adsorption and in particular the H2O and/or OH- bonding sites on different SrTiO3(001) surfaces using the powerful technique of standing wave excited photoelectron spectroscopy. This allowed us determining whether the H2O adsorption is associative or dissociative and additionally localizing the exact bonding site of the different oxygen species (water oxygen and OH- oxygen species). We deposited water in ultra high vacuum on several differently structured or reconstruction SrTiO3(001) surfaces in the range from 100K to room temperature. Our results provide valuable insight into water adsorption on STO(001) surfaces and its specific catalytic activity in view of water splitting applications. They also help clarify previous conflicting previous results.

  10. X-ray photoelectron spectroscopy of trihalide ionic liquids: Comparison to halide-based analogues, anion basicity and beam damage

    Science.gov (United States)

    Men, Shuang; Lovelock, Kevin R. J.; Licence, Peter

    2017-07-01

    X-ray photoelectron spectroscopy is used to investigate two 1-octyl-3-methylimidazolium trihalide ionic liquids, with anions including triiodide and iododibromide. The electronic environment of each element present in ionic liquids studied herein is analysed and compared to their halide-based analogous. The anion basicity is compared based upon the measured N 1s binding energy. The iododibromide ionic liquid is studied as a representative sample to illustrate the beam damage effect. Due to the beam damage, there is a new formed bromine component observed. This effect is calculated and demonstrated for all elements present within the ionic liquid. It suggests that the beam induced decomposition caused a stoichiometric loss of bromine atom and iodine atom.

  11. Combined use of atomic force microscopy, X-ray photoelectron spectroscopy, and secondary ion mass spectrometry for cell surface analysis.

    Science.gov (United States)

    Dague, Etienne; Delcorte, Arnaud; Latgé, Jean-Paul; Dufrêne, Yves F

    2008-04-01

    Understanding the surface properties of microbial cells is a major challenge of current microbiological research and a key to efficiently exploit them in biotechnology. Here, we used three advanced surface analysis techniques with different sensitivity, probing depth, and lateral resolution, that is, in situ atomic force microscopy, X-ray photoelectron spectroscopy, and secondary ion mass spectrometry, to gain insight into the surface properties of the conidia of the human fungal pathogen Aspergillus fumigatus. We show that the native ultrastructure, surface protein and polysaccharide concentrations, and amino acid composition of three mutants affected in hydrophobin production are markedly different from those of the wild-type, thereby providing novel insight into the cell wall architecture of A. fumigatus. The results demonstrate the power of using multiple complementary techniques for probing microbial cell surfaces.

  12. Ionic dissociation dynamics and energetics of hexamethyldigermanium, (CH3)6Ge2, by threshold photoelectron-photoion coincidence spectroscopy

    Science.gov (United States)

    Dávalos, Juan Z.; Baer, Tomas; Blancas, Carlos

    2017-09-01

    Threshold Photoelectron-Photoion Coincidence Spectroscopy (TPEPICO) has been used to study the ionic dissociation dynamics and energetics of Me6Ge2 (Me = CH3). Ions are energy-selected and the 0 K dissociation onsets for methyl and Me3Ge loss are obtained from the breakdown diagram and mass spectra distributions, both of them analyzed and modeled with statistical SSACM theory and quantum chemical (DFT, MP2) calculations. An updated value for the enthalpy of formation, ΔfHm0 (g) of Me6Ge2, is used to derive Δf Hm0 (Me3Ge,g) = 70.8 ± 8.9 kJ·mol-1. The bond dissociation enthalpies, BDE (Gesbnd X), of Me3Gesbnd X (X = Me, GeMe3, Cl and Br) were also derived in this study.

  13. Operando x-ray photoelectron emission microscopy for studying forward and reverse biased silicon p-n junctions

    Energy Technology Data Exchange (ETDEWEB)

    Barrett, N., E-mail: nick.barrett@cea.fr; Gottlob, D. M.; Mathieu, C.; Lubin, C. [SPEC, CEA, CNRS, Université Paris-Saclay, CEA Saclay, 91191 Gif-sur-Yvette Cedex (France); Passicousset, J. [SPEC, CEA, CNRS, Université Paris-Saclay, CEA Saclay, 91191 Gif-sur-Yvette Cedex (France); IFP Energies nouvelles, Rond-point de l’échangeur de Solaize, BP 3, 69360 Solaize (France); Renault, O.; Martinez, E. [University Grenoble-Alpes, 38000 Grenoble, France and CEA, LETI, MINATEC Campus, 38054 Grenoble (France)

    2016-05-15

    Significant progress in the understanding of surfaces and interfaces of materials for new technologies requires operando studies, i.e., measurement of chemical, electronic, and magnetic properties under external stimulus (such as mechanical strain, optical illumination, or electric fields) applied in situ in order to approach real operating conditions. Electron microscopy attracts much interest, thanks to its ability to determine semiconductor doping at various scales in devices. Spectroscopic photoelectron emission microscopy (PEEM) is particularly powerful since it combines high spatial and energy resolution, allowing a comprehensive analysis of local work function, chemistry, and electronic structure using secondary, core level, and valence band electrons, respectively. Here we present the first operando spectroscopic PEEM study of a planar Si p-n junction under forward and reverse bias. The method can be used to characterize a vast range of materials at near device scales such as resistive oxides, conducting bridge memories and domain wall arrays in ferroelectrics photovoltaic devices.

  14. Measurement of the time-resolved spectrum of photoelectrons from ZnS:Mn, Cu luminescent material

    CERN Document Server

    Dong Guo Yi; Wei Zh; Yang Shao Peng; Fu Guang Sheng

    2003-01-01

    The process of decay of photoelectrons in the conduction band of ZnS:Mn, Cu luminescent materials after excitation with a short-pulse laser has been investigated in this paper by means of measurements made using the microwave absorption dielectric spectrum detection technique. Exponential decay processes were observed for the electrons in the conduction band and the shallow-trapped electrons; the lifetimes of the electrons were found to be 1177 and 1703 ns, respectively. The processes of decay of the luminescence from ZnS:Mn, Cu were investigated and exponential decay processes were found for blue Cu sup + , green Cu sup + and Mn sup 2 sup + luminescent centres with lifetimes of the excited state of 139, 140 and 680 mu s, respectively.

  15. Structural and X-Ray Photoelectron Spectroscopy Study of Al-Doped Zinc-Oxide Thin Films

    Directory of Open Access Journals (Sweden)

    Bong Ju Lee

    2015-01-01

    Full Text Available Al-doped zinc-oxide (AZO thin films were prepared by RF magnetron sputtering at different oxygen partial pressures and substrate temperatures. The charge-carrier concentrations in the films decreased from 1.69 × 1021 to 6.16 × 1017 cm−3 with increased gas flow rate from 7 to 21 sccm. The X-ray diffraction (XRD patterns show that the (002/(103 peak-intensity ratio decreased as the gas flow rate increased, which was related to the increase of AZO thin film disorder. X-ray photoelectron spectra (XPS of the O1s were decomposed into metal oxide component (peak A and the adsorbed molecular oxygen on thin films (peak B. The area ratio of XPS peaks (A/B was clearly related to the stoichiometry of AZO films; that is, the higher value of A/B showed the higher stoichiometric properties.

  16. X-ray photoelectron spectroscopy study of the chemical structure of thermally nitrided SiO2

    Science.gov (United States)

    Vasquez, R. P.; Hecht, M. H.; Grunthaner, F. J.; Naiman, M. L.

    1984-01-01

    X-ray photoelectron spectroscopy has been used to study the composition of 100-A thermally grown SiO2 films that have been thermally nitrided in ammonia. The SiO(x)N(y)/Si interface was studied both by chemical depth profiling of the oxynitride and by removal of the Si substrate with XeF2. It is found that N is distributed throughout the film, but with the concentration higher at the surface and in a region centered 25 A from the film/substrate interface. The interface region itself is found to be oxygen-rich relative to the rest of the film. Possible models which can explain these results are discussed.

  17. XPS studies of structure-induced radiation effects at the Si/SiO2 interface. [X ray Photoelectron Spectroscopy

    Science.gov (United States)

    Grunthaner, F. J.; Lewis, B. F.; Zamini, N.; Maserjian, J.; Madhukar, A.

    1980-01-01

    The interfacial structures of radiation hard and soft oxides grown by dry and wet processes on silicon substrates have been examined by high-resolution X-ray photoelectron spectroscopy. It is found that the primary difference in the local atomic structure at the Si/SiO2 interface is the significantly higher concentration of strained 120 deg SiO2 bonds and SiO interfacial species in soft samples. Results of in situ radiation damage experiments using low energy electrons (0-20 eV) are reported which correlate with the presence of a strained layer of SiO2 (20 A) at the interface. The results are interpreted in terms of a structural model for hole and electron trap generation by ionizing radiation.

  18. Probing the electron beam induced reduction of graphite oxide by in situ X-ray photoelectron spectroscopy/mass spectrometer

    Science.gov (United States)

    Zhu, Chunhua; Hao, Xiaofei; Liu, Yu; Wu, Yeping; Wang, Jianhua

    2018-01-01

    The graphite oxide (GO) was reduced successfully by electron-beam irradiation without solution chemistry and high temperature, where the chemical structural changes and gaseous species released during the exposure was monitored directly by X-ray photoelectron spectroscopy/mass spectrometer. The degree of reduction of GO can be tuned effectively by way of electron beam intensity and irradiation time, resulting a high C/O ratio of 5.27. The evolution of C 1s spectra with irradiation time was also investigated. The CO, CO2, H2 molecules and several organic species were detected during the irradiation, confirmed that the electron beam induced the photoreduction of GO. The combined chemical structure evolution and gas species analysis make the XPS-MS highly desirable as a powerful in situ analytical instrument for tracking the reaction process. The electron-beam-induced reduction described in detail here provides potential way to fabricate graphene device from GO in one step.

  19. The offset droplet: a new methodology for studying the solid/water interface using x-ray photoelectron spectroscopy

    Science.gov (United States)

    Booth, S. G.; Tripathi, A. M.; Strashnov, I.; Dryfe, R. A. W.; Walton, A. S.

    2017-11-01

    The routine study of the solid-water interface by XPS is potentially revolutionary as this development opens up whole new areas of study for photoelectron spectroscopy. To date this has been realised by only a few groups worldwide and current techniques have significant restrictions on the type of samples which can be studied. Here we present a novel and uniquely flexible approach to the problem. By introducing a thin capillary into the NAP-XPS, a small droplet can be injected onto the sample surface, offset from the analysis area by several mm. By careful control of the droplet size a water layer of controllable thickness can be established in the analysis area—continuous with the bulk droplet. We present results from the solid-water interface on a vacuum prepared TiO2(110) single crystal and demonstrate that the solid/liquid interface is addressable.

  20. A facility for the analysis of the electronic structures of solids and their surfaces by synchrotron radiation photoelectron spectroscopy

    Science.gov (United States)

    Hoesch, M.; Kim, T. K.; Dudin, P.; Wang, H.; Scott, S.; Harris, P.; Patel, S.; Matthews, M.; Hawkins, D.; Alcock, S. G.; Richter, T.; Mudd, J. J.; Basham, M.; Pratt, L.; Leicester, P.; Longhi, E. C.; Tamai, A.; Baumberger, F.

    2017-01-01

    A synchrotron radiation beamline in the photon energy range of 18-240 eV and an electron spectroscopy end station have been constructed at the 3 GeV Diamond Light Source storage ring. The instrument features a variable polarisation undulator, a high resolution monochromator, a re-focussing system to form a beam spot of 50 × 50 μm2, and an end station for angle-resolved photoelectron spectroscopy (ARPES) including a 6-degrees-of-freedom cryogenic sample manipulator. The beamline design and its performance allow for a highly productive and precise use of the ARPES technique at an energy resolution of 10-15 meV for fast k-space mapping studies with a photon flux up to 2 ṡ 1013 ph/s and well below 3 meV for high resolution spectra.

  1. A facility for the analysis of the electronic structures of solids and their surfaces by synchrotron radiation photoelectron spectroscopy.

    Science.gov (United States)

    Hoesch, M; Kim, T K; Dudin, P; Wang, H; Scott, S; Harris, P; Patel, S; Matthews, M; Hawkins, D; Alcock, S G; Richter, T; Mudd, J J; Basham, M; Pratt, L; Leicester, P; Longhi, E C; Tamai, A; Baumberger, F

    2017-01-01

    A synchrotron radiation beamline in the photon energy range of 18-240 eV and an electron spectroscopy end station have been constructed at the 3 GeV Diamond Light Source storage ring. The instrument features a variable polarisation undulator, a high resolution monochromator, a re-focussing system to form a beam spot of 50 × 50 μm 2 , and an end station for angle-resolved photoelectron spectroscopy (ARPES) including a 6-degrees-of-freedom cryogenic sample manipulator. The beamline design and its performance allow for a highly productive and precise use of the ARPES technique at an energy resolution of 10-15 meV for fast k-space mapping studies with a photon flux up to 2 ⋅ 10 13 ph/s and well below 3 meV for high resolution spectra.

  2. Native target chemistry during reactive dc magnetron sputtering studied by ex-situ x-ray photoelectron spectroscopy

    Science.gov (United States)

    Greczynski, G.; Mráz, S.; Schneider, J. M.; Hultman, L.

    2017-07-01

    We report x-ray photoelectron spectroscopy (XPS) analysis of native Ti target surface chemistry during magnetron sputtering in an Ar/N2 atmosphere. To avoid air exposure, the target is capped immediately after sputtering with a few-nm-thick Al overlayers; hence, information about the chemical state of target elements as a function of N2 partial pressure pN2 is preserved. Contrary to previous reports, which assume stoichiometric TiN formation, we present direct evidence, based on core-level XPS spectra and TRIDYN simulations, that the target surface is covered by TiNx with x varying in a wide range, from 0.27 to 1.18, depending on pN2. This has far-reaching consequences both for modelling of the reactive sputtering process and for everyday thin film growth where detailed knowledge of the target state is crucial.

  3. Anion Binding of One-, Two-, and Three-Armed Thiourea Receptors Examined via Photoelectron Spectroscopy and Quantum Computations.

    Science.gov (United States)

    Beletskiy, Evgeny V; Wang, Xue-Bin; Kass, Steven Robert

    2016-10-05

    A benzene ring substituted with 1-3 thiourea containing arms (1-3) were examined by photoelectron spectroscopy and density functional theory computations. Their conjugate bases and chloride, acetate and dihydrogen phosphate anion clusters are reported. The resulting vertical and adiabatic detachment energies span from 3.93 - 5.82 eV (VDE) and 3.65 - 5.10 (ADE) for the deprotonated species and 4.88 - 5.97 eV (VDE) and 4.45 - 5.60 eV (ADE) for the anion complexes. These results reveal the stabilizing effects of multiple hydrogen bonds and anionic host-guest interactions in the gas phase. Previously measured equilibrium binding constants in aqueous dimethyl sulfoxide for all three thioureas are compared to the present results and cooperative binding is uniformly observed in the gas phase but only for one case (i.e., 3 • H2PO4-) in solution.

  4. Assessment of the Quality of Newly Formed Bone around Titanium Alloy Implants by Using X-Ray Photoelectron Spectroscopy

    Directory of Open Access Journals (Sweden)

    Hiroshi Nakada

    2012-01-01

    Full Text Available The aim of this study was to evaluate differences in bones quality between newly formed bone and cortical bone formed around titanium alloy implants by using X-ray photoelectron spectroscopy. As a result of narrow scan measurement at 4 weeks, the newly formed bone of C1s, P2p, O1s, and Ca2p were observed at a different peak range and strength compared with a cortical bone. At 8 weeks, the peak range and strength of newly formed bone were similar to those of cortical bone at C1s, P2p, and Ca2p, but not O1s. The results from this analysis indicate that the peaks and quantities of each element of newly formed bone were similar to those of cortical bone at 8 weeks, suggestive of a strong physicochemical resemblance.

  5. Probing the electronic environment of binary and ternary ionic liquid mixtures by X-ray photoelectron spectroscopy

    Science.gov (United States)

    Men, Shuang; Licence, Peter

    2017-10-01

    X-ray photoelectron spectroscopy is used to probe the electronic environment of cations and anions for three binary and one ternary chlorostannate ionic liquid mixtures. The impact of the weighting of Cl- on the electronic environment of the cation-based nitrogen atom is revealed in detail. With the increasing of the concentration of Cl-, the N 1s binding energy is decreased. The electronic environment of the anion-based component is also compared based upon Sn 3d5/2 and Cl 2p3/2 binding energies. It is found that with the increasing of the weighting of Cl-, binding energies of Sn 3d5/2 and Cl 2p3/2 both decrease.

  6. Excited state non-adiabatic dynamics of pyrrole: A time-resolved photoelectron spectroscopy and quantum dynamics study

    Energy Technology Data Exchange (ETDEWEB)

    Wu, Guorong [National Research Council of Canada, 100 Sussex Drive, Ottawa, Ontario K1A 0R6 (Canada); State Key Laboratory of Molecular Reaction Dynamics, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian, Liaoning 116023 (China); Synergetic Innovation Center of Quantum Information and Quantum Physics, University of Science and Technology of China, Hefei, Anhui 230026 (China); Neville, Simon P.; Worth, Graham A., E-mail: g.a.worth@bham.ac.uk [School of Chemistry, University of Birmingham, Edgbaston, Birmingham B15 2TT (United Kingdom); Schalk, Oliver [National Research Council of Canada, 100 Sussex Drive, Ottawa, Ontario K1A 0R6 (Canada); Department of Physics, AlbaNova University Center, Stockholm University, Roslagstullsbacken 21, 109 61 Stockholm (Sweden); Sekikawa, Taro [National Research Council of Canada, 100 Sussex Drive, Ottawa, Ontario K1A 0R6 (Canada); Department of Applied Physics, Hokkaido University, Kita-13 Nishi-8, Kita-ku, Sapporo 060-8628 (Japan); Ashfold, Michael N. R. [School of Chemistry, University of Bristol, Bristol BS8 1TS (United Kingdom); Stolow, Albert, E-mail: astolow@uottawa.ca [National Research Council of Canada, 100 Sussex Drive, Ottawa, Ontario K1A 0R6 (Canada); Departments of Chemistry and Physics, University of Ottawa, 10 Marie Curie, Ottawa, Ontario K1N 6N5 (Canada)

    2015-02-21

    The dynamics of pyrrole excited at wavelengths in the range 242-217 nm are studied using a combination of time-resolved photoelectron spectroscopy and wavepacket propagations performed using the multi-configurational time-dependent Hartree method. Excitation close to the origin of pyrrole’s electronic spectrum, at 242 and 236 nm, is found to result in an ultrafast decay of the system from the ionization window on a single timescale of less than 20 fs. This behaviour is explained fully by assuming the system to be excited to the A{sub 2}(πσ{sup ∗}) state, in accord with previous experimental and theoretical studies. Excitation at shorter wavelengths has previously been assumed to result predominantly in population of the bright A{sub 1}(ππ{sup ∗}) and B{sub 2}(ππ{sup ∗}) states. We here present time-resolved photoelectron spectra at a pump wavelength of 217 nm alongside detailed quantum dynamics calculations that, together with a recent reinterpretation of pyrrole’s electronic spectrum [S. P. Neville and G. A. Worth, J. Chem. Phys. 140, 034317 (2014)], suggest that population of the B{sub 1}(πσ{sup ∗}) state (hitherto assumed to be optically dark) may occur directly when pyrrole is excited at energies in the near UV part of its electronic spectrum. The B{sub 1}(πσ{sup ∗}) state is found to decay on a timescale of less than 20 fs by both N-H dissociation and internal conversion to the A{sub 2}(πσ{sup ∗}) state.

  7. Crystal chemistry, surface morphology and X-ray photoelectron spectroscopy of Fe-rich osumilite from Mt. Arci, Sardinia (Italy)

    Science.gov (United States)

    Elmi, Chiara; Brigatti, Maria Franca; Pasquali, Luca; Montecchi, Monica; Laurora, Angela; Malferrari, Daniele; Nannarone, Stefano

    2010-09-01

    Microprobe analysis, single crystal X-ray diffraction, X-ray photoelectron spectroscopy, atomic force microscopy, and X-ray absorption spectroscopy were applied on Fe-rich osumilite from the volcanic massif of Mt. Arci, Sardinia, Italy. Osumilite belongs to the space group P6/ mcc with unit cell parameters a = 10.1550(6), c = 14.306(1) Å and chemical formula (K0.729)C (Na0.029)B (Si10.498 Al1.502)T1 (Al2.706 Fe{0.294/2+})T2 (Mg0.735 Mn0.091 Fe{1.184/2+})AO30. Structure refinement converged at R = 0.0201. Unit cell parameter a is related to octahedral edge length as well as to Fe2+ content, unlike the c parameter which does not seem to be affected by chemical composition. The determination of the amount of each element on the mineral surface, obtained through X-ray photoelectron spectroscopy high-resolution spectra in the region of the Si2p, Al2p, Mg1s and Fe2p core levels, suggests that Fe presents Fe2+ oxidation state and octahedral coordination. Two peaks at 103.1 and 100.6 eV can be related to Si4+ and Si1+ components, respectively, both in tetrahedral coordination. The binding energy of Al2p, at 74.5 eV, indicates that Al is mostly present in the distorted T2 site, whereas the Mg peak at 1,305.2 eV suggests that this cation is located at the octahedral site. X-ray absorption at the Fe L2,3-edges confirms that iron is present in the mineral structure, prevalently in the divalent state and at the A octahedral site.

  8. Valence shell threshold photoelectron spectroscopy of the CHxCN (x = 0-2) and CNC radicals

    Science.gov (United States)

    Garcia, Gustavo A.; Krüger, Julia; Gans, Bérenger; Falvo, Cyril; Coudert, Laurent H.; Loison, Jean-Christophe

    2017-07-01

    We present the photoelectron spectroscopy of four radical species, CHxCN (x = 0-2) and CNC, formed in a microwave discharge flow-tube reactor by consecutive H abstractions from CH3CN (CHxCN + F → CHx-1CN + HF (x = 1-3)). The spectra were obtained combining tunable vacuum ultraviolet synchrotron radiation with double imaging electron/ion coincidence techniques, which yielded mass-selected threshold photoelectron spectra. The results obtained for H2CCN complement existing ones while for the other radicals the data represent the first observation of their (single-photon) ionizing transitions. In the case of H2CCN, Franck-Condon calculations have been performed in order to assign the vibrational structure of the X+1A1←X 2B1 ionizing transition. A similar treatment for the HCCN, CCN, and CNC radicals appeared to be more complicated mainly because a Renner-Teller effect strongly affects the vibrational levels of the ground electronic state of the HCCN+, CCN, and CNC species. Nevertheless, the first adiabatic ionization energies of these radicals are reported and compared to our ab initio calculated values, leading to new values for enthalpies of formation (ΔfH2980(HCCN+(X2A')) =1517 ± 12 kJmol-1,ΔfH2980(CCN(X2Π ) ) =682 ± 13 kJmol-1 , and ΔfH2980(CNC(X2Π g) ) =676 ± 12 kJmol-1) , which are of fundamental importance for astrochemistry.

  9. Valence shell threshold photoelectron spectroscopy of the CHxCN (x = 0-2) and CNC radicals.

    Science.gov (United States)

    Garcia, Gustavo A; Krüger, Julia; Gans, Bérenger; Falvo, Cyril; Coudert, Laurent H; Loison, Jean-Christophe

    2017-07-07

    We present the photoelectron spectroscopy of four radical species, CHxCN (x = 0-2) and CNC, formed in a microwave discharge flow-tube reactor by consecutive H abstractions from CH3CN (CHxCN + F → CHx-1CN + HF (x = 1-3)). The spectra were obtained combining tunable vacuum ultraviolet synchrotron radiation with double imaging electron/ion coincidence techniques, which yielded mass-selected threshold photoelectron spectra. The results obtained for H2CCN complement existing ones while for the other radicals the data represent the first observation of their (single-photon) ionizing transitions. In the case of H2CCN, Franck-Condon calculations have been performed in order to assign the vibrational structure of the X(+ 1)A1←X (2)B1 ionizing transition. A similar treatment for the HCCN, CCN, and CNC radicals appeared to be more complicated mainly because a Renner-Teller effect strongly affects the vibrational levels of the ground electronic state of the HCCN(+), CCN, and CNC species. Nevertheless, the first adiabatic ionization energies of these radicals are reported and compared to our ab initio calculated values, leading to new values for enthalpies of formation (ΔfH298(0)(HCCN(+)(X(2)A(')))=1517±12kJmol(-1),ΔfH298(0)(CCN(X(2)Π))=682±13kJmol(-1), and ΔfH298(0)(CNC(X(2)Πg))=676±12kJmol(-1)), which are of fundamental importance for astrochemistry.

  10. Mode coupling trigger of neoclassical magnetohydrodynamic tearing modes in tokamaks

    Energy Technology Data Exchange (ETDEWEB)

    Gianakon, T.A.; Hegna, C.C.; Callen, J.D.

    1997-05-01

    Numerical studies of the nonlinear evolution of coupled magnetohydrodynamic - type tearing modes in three-dimensional toroidal geometry with neoclassical effects are presented. The inclusion of neoclassical physics introduces an additional free-energy source for the nonlinear formation of magnetic islands through the effects of a bootstrap current in Ohm`s law. The neoclassical tearing mode is demonstrated to be destabilized in plasmas which are otherwise {Delta}{prime} stable, albeit once a threshold island width is exceeded. A possible mechanism for exceeding or eliminating this threshold condition is demonstrated based on mode coupling due to toroidicity with a pre-existing instability at the q = 1 surface.

  11. Mode-by-mode hydrodynamics: Ideas and concepts

    Energy Technology Data Exchange (ETDEWEB)

    Floerchinger, Stefan

    2014-06-15

    The main ideas, technical concepts and perspectives for a mode resolved description of the hydrodynamical regime of relativistic heavy ion collisions are discussed. A background-fluctuation splitting and a Bessel–Fourier expansion for the fluctuating part of the hydrodynamical fields allows for a complete characterization of initial conditions, the fluid dynamical propagation of single modes, the study of interaction effects between modes, the determination of the associated particle spectra and the generalization of the whole program to event-by-event correlations and probability distributions.

  12. Espectroscopia de fotoelétrons de limiares de átomos e moléculas Atomic and molecular threshold photoelectron spectroscopy

    Directory of Open Access Journals (Sweden)

    Maria Cristina Andreolli Lopes

    2006-02-01

    Full Text Available A threshold photoelectron spectrometer applied to the study of atomic and molecular threshold photoionization processes is described. The spectrometer has been used in conjunction with a toroidal grating monochromator at the National Synchrotron Radiation Laboratory (LNLS, Brazil. It can be tuned to accept threshold electrons (< 20 meV and work with a power resolution of 716 (~18 meV at 12 eV with a high signal/noise ratio. The performance of this apparatus and some characteristics of the TGM (Toroidal Grating Monochromator beam line of LNLS are described and discussed by means of argon, O2 and N2 threshold photoelectron spectra.

  13. Retrieval of parameters of few-cycle laser pulses from high-energy photoelectron spectra of atoms by a genetic algorithm

    Science.gov (United States)

    Zhou, Zhaoyan; Wang, Xu; Chen, Zhangjin; Lin, C. D.

    2017-06-01

    According to the quantitative rescattering theory, the laser features are imbedded in the returning electron wave packets. By analyzing high-energy photoelectron wave packets on the two sides of the linearly polarization axis we can retrieve the experimental laser pulse irrespective of the atomic targets. Laser parameters including its carrier-envelope phase, pulse duration, and peak intensity can be retrieved within a small range simultaneously from the output of the genetic algorithm. This is a simple direct retrieval method for characterizing a phase-stabilized few-cycle laser pulse based only on one set of photoelectron spectra.

  14. Exotic decay: Transition from cluster mode to fission mode

    Indian Academy of Sciences (India)

    ' reaction were studied taking interacting barrier consisting of Coulomb and proximity potential. Calculated half-life time shows that some modes of decay are well within the present upper limit for measurements (1/2 < 1030 s). Cluster ...

  15. Mode control and mode conversion in nonlinear aluminum nitride waveguides.

    Science.gov (United States)

    Stegmaier, Matthias; Pernice, Wolfram H P

    2013-11-04

    While single-mode waveguides are commonly used in integrated photonic circuits, emerging applications in nonlinear and quantum optics rely fundamentally on interactions between modes of different order. Here we propose several methods to evaluate the modal composition of both externally and device-internally excited guided waves and discuss a technique for efficient excitation of arbitrary modes. The applicability of these methods is verified in photonic circuits based on aluminum nitride. We control modal excitation through suitably engineered grating couplers and are able to perform a detailed study of waveguide-internal second harmonic generation. Efficient and broadband power conversion between orthogonal polarizations is realized within an asymmetric directional coupler to demonstrate selective excitation of arbitrary higher-order modes. Our approach holds promise for applications in nonlinear optics and frequency up/down-mixing in a chipscale framework.

  16. Principal Metabolic Flux Mode Analysis.

    Science.gov (United States)

    Bhadra, Sahely; Blomberg, Peter; Castillo, Sandra; Rousu, Juho; Wren, Jonathan

    2018-02-06

    In the analysis of metabolism, two distinct and complementary approaches are frequently used: Principal component analysis (PCA) and stoichiometric flux analysis. PCA is able to capture the main modes of variability in a set of experiments and does not make many prior assumptions about the data, but does not inherently take into account the flux mode structure of metabolism. Stoichiometric flux analysis methods, such as Flux Balance Analysis (FBA) and Elementary Mode Analysis, on the other hand, are able to capture the metabolic flux modes, however, they are primarily designed for the analysis of single samples at a time, and not best suited for exploratory analysis on a large sets of samples. We propose a new methodology for the analysis of metabolism, called Principal Metabolic Flux Mode Analysis (PMFA), which marries the PCA and stoichiometric flux analysis approaches in an elegant regularized optimization framework. In short, the method incorporates a variance maximization objective form PCA coupled with a stoichiometric regularizer, which penalizes projections that are far from any flux modes of the network. For interpretability, we also introduce a sparse variant of PMFA that favours flux modes that contain a small number of reactions. Our experiments demonstrate the versatility and capabilities of our methodology. The proposed method can be applied to genome-scale metabolic network in efficient way as PMFA does not enumerate elementary modes. In addition, the method is more robust on out-of-steady steady-state experimental data than competing flux mode analysis approaches. Matlab software for PMFA and SPMFA and data set used for experiments are available in https://github.com/aalto-ics-kepaco/PMFA. sahely@iitpkd.ac.in, juho.rousu@aalto.fi, Peter.Blomberg@vtt.fi, Sandra.Castillo@vtt.fi. Detailed results are in Supplementary files. Supplementary data are available at https://github.com/aalto-ics-kepaco/PMFA/blob/master/Results.zip.

  17. Mode synthesizing atomic force microscopy and mode-synthesizing sensing

    Science.gov (United States)

    Passian, Ali; Thundat, Thomas George; Tetard, Laurene

    2013-05-17

    A method of analyzing a sample that includes applying a first set of energies at a first set of frequencies to a sample and applying, simultaneously with the applying the first set of energies, a second set of energies at a second set of frequencies, wherein the first set of energies and the second set of energies form a multi-mode coupling. The method further includes detecting an effect of the multi-mode coupling.

  18. Distributed Mode Filtering Rod Fiber Amplifier With Improved Mode Stability

    DEFF Research Database (Denmark)

    Laurila, Marko; Alkeskjold, Thomas Tanggaard; Broeng, Jes

    2012-01-01

    We report 216W of average output power from a photonic crystal rod fiber amplifier. We demonstrate 44% power improvement before onset of the mode instability by operating the rod fiber in a leaky guiding regime.......We report 216W of average output power from a photonic crystal rod fiber amplifier. We demonstrate 44% power improvement before onset of the mode instability by operating the rod fiber in a leaky guiding regime....

  19. Intelligence and musical mode preference

    DEFF Research Database (Denmark)

    Bonetti, Leonardo; Costa, Marco

    2016-01-01

    The relationship between fluid intelligence and preference for major–minor musical mode was investigated in a sample of 80 university students. Intelligence was assessed by the Raven’s Advanced Progressive Matrices. Musical mode preference was assessed by presenting 14 pairs of musical stimuli...... that varied only in mode. Mood and personality were assessed, respectively, by the Brief Mood Introspection Scale and the Big Five Questionnaire. Preference for minor stimuli was related positively and significantly to fluid intelligence and openness to experience. The results add evidence of individual...

  20. Few-mode fiber technology for mode division multiplexing

    Science.gov (United States)

    Mori, Takayoshi; Sakamoto, Taiji; Wada, Masaki; Yamamoto, Takashi; Nakajima, Kazuhide

    2017-02-01

    We review recent progress on few-mode fiber (FMF) technologies for mode-division multiplexing (MDM) transmission. First, we introduce fibers for use without and with multiple-input multiple-output (MIMO) digital signal processing (DSP) to compensate for modal crosstalk, and briefly report recent work on FMF for use without/with a MIMO DSP system. We next discuss in detail a fiber for MIMO transmission systems, and show numerically that a graded-index core can flexibly tune the differential mode group delay (DMD) and a cladding trench can flexibly control the guiding mode number. We optimized the spacing of the core and trench. Accordingly, we can achieve a 6 LP (10 spatial) mode operation and a low DMD while preventing the high index difference that leads to manufacturing difficulties and any loss increase. We finally describe our experimental results for a 6 LP (10 spatial) mode transmission line for use in a C + L band wavelength-division multiplexing (WDM) MDM transmission with MIMO DSP.

  1. Fiber cavities with integrated mode matching optics.

    Science.gov (United States)

    Gulati, Gurpreet Kaur; Takahashi, Hiroki; Podoliak, Nina; Horak, Peter; Keller, Matthias

    2017-07-17

    In fiber based Fabry-Pérot Cavities (FFPCs), limited spatial mode matching between the cavity mode and input/output modes has been the main hindrance for many applications. We have demonstrated a versatile mode matching method for FFPCs. Our novel design employs an assembly of a graded-index and large core multimode fiber directly spliced to a single mode fiber. This all-fiber assembly transforms the propagating mode of the single mode fiber to match with the mode of a FFPC. As a result, we have measured a mode matching of 90% for a cavity length of ~400 μm. This is a significant improvement compared to conventional FFPCs coupled with just a single mode fiber, especially at long cavity lengths. Adjusting the parameters of the assembly, the fundamental cavity mode can be matched with the mode of almost any single mode fiber, making this approach highly versatile and integrable.

  2. Adaptive Structural Mode Control Project

    Data.gov (United States)

    National Aeronautics and Space Administration — M4 Engineering proposes the development of an adaptive structural mode control system. The adaptive control system will begin from a "baseline" dynamic model of the...

  3. Rotational Modes in Phononic Crystals

    Science.gov (United States)

    Wu, Ying; Peng, Pai; Mei, Jun

    2014-03-01

    We propose a lumped model for the rotational modes in two-dimensional phononic crystals comprised of square arrays of solid cylindrical scatterers in solid hosts. The model not only can reproduce the dispersion relations in a certain range with one fitted parameter, but also gives simple analytical expressions for the frequencies of the eigenmodes at the high symmetry points in the Brillouin zone. These expressions provide physical understandings of the rotational modes as well as certain translational and hybrid mode, and predict the presence of accidental degeneracy of the rotational and dipolar modes, which leads to a Dirac-like cone in the Brillouin zone center. Supported by KAUST Baseline Research Fund, National Natural Science Foundation of China (Grants No. 10804086 and No. 11274120), and the Fundamental Research Funds for the Central Universities (Grant No. 2012ZZ0077).

  4. Amplitude damping of vortex modes

    CSIR Research Space (South Africa)

    Dudley, Angela L

    2010-09-01

    Full Text Available An interferometer, mimicking an amplitude damping channel for vortex modes, is presented. Experimentally the action of the channel is in good agreement with that predicted theoretically. Since we can characterize the action of the channel on orbital...

  5. Novel Modes Workshop Summary Report

    Science.gov (United States)

    2015-12-01

    On December 2-3, 2014, the Federal Highway Administration's (FHWA's) Exploratory Advanced Research Program, with support from the John A. Volpe National Transportation Systems Center, convened the 2-day workshop "Novel Modes." It was held concurrentl...

  6. The Kuhnian mode of HPS

    DEFF Research Database (Denmark)

    Schindler, Samuel

    2013-01-01

    In this article I argue that a methodological challenge to an integrated history and philosophy of science approach put forth by Ronald Giere almost forty years ago can be met by what I call the Kuhnian mode of History and Philosophy of Science (HPS). Although in the Kuhnian mode of HPS norms about...... science are motivated by historical facts about scientific practice, the justifiers of the constructed norms are not historical facts. The Kuhnian mode of HPS therefore evades the naturalistic fallacy which Giere’s challenge is a version of. Against the backdrop of a discussion of Laudan’s normative...... naturalism I argue that the Kuhnian mode of HPS is a superior form of naturalism: it establishes contact to the practice of science without making itself dependent on its contingencies....

  7. Examination of the 'web mode effect'

    DEFF Research Database (Denmark)

    Clement, Sanne Lund; Shamshiri-Petersen, Ditte

    for different modes, and mode differences then are influenced by stratification differences. In both cases the real mode differences are nearly impossible to determine and remains rather speculative. The purpose of this contribution is to examine potential “web mode effects” in mixed-mode surveys. Compared...

  8. The Fifth Mode of Representation

    DEFF Research Database (Denmark)

    Hansen, Per Krogh; Behrendt, Poul Olaf

    2011-01-01

    “The fifth mode of representation: Ambiguous voices in unreliable third person narration”. Sammen med Poul Behrendt. In Per Krogh Hansen, Stefan Iversen, Henrik Skov Nielsen og Rolf Reitan (red.): Strange Voices. Walter de Gruyter, Berlin & New York......“The fifth mode of representation: Ambiguous voices in unreliable third person narration”. Sammen med Poul Behrendt. In Per Krogh Hansen, Stefan Iversen, Henrik Skov Nielsen og Rolf Reitan (red.): Strange Voices. Walter de Gruyter, Berlin & New York...

  9. An interdecadal American rainfall mode

    Science.gov (United States)

    Jury, Mark R.

    2009-04-01

    Low-frequency climate variability across the American continents and surrounding oceans is analyzed by application of singular value decomposition (SVD) to gauge-based rainfall and environmental anomaly fields in the period 1901-2002. A 5-year filter is used to maintain a focus on interdecadal cycles. The rainfall regime of particular interest (mode 1) is when West Africa and the Caribbean share positive loading and North and South America share negative loading. Wavelet cospectral energy is found at ˜8, 24, and 50 years for Caribbean/West African zones and 16 and 32 years for North/South America. West Africa and South America exhibit antiphase multidecadal variability, while North America and the Caribbean rainfall exhibit quasi-decadal cycles. The rainfall associations are nonstationary. In the early 1900s, Caribbean and South American rainfall were antiphase. Since 1930 low-frequency oscillations of North American (West African) rainfall have been positively (negatively) associated with South America. Low-frequency oscillations of North American rainfall have been consistently antiphase with respect to Caribbean rainfall; however, West Africa rainfall fluctuations have been in phase with the Caribbean more in the period 1920-1950 than at other times. Hemispheric-scale environmental SVD patterns and scores were compared with the leading rainfall modes. The north-south gradient modes in temperature are influential in respect of mode 1 rainfall, while east-west gradients relate to mode 2 (northern Brazil) rainfall. The ability of the GFDL2.1 coupled (ocean-atmosphere) general circulation model to represent interdecadal rainfall modes in the 20th century was evaluated. While mode 2 is reproduced, mode 1 remains elusive.

  10. The electronic states of 1,2,3-triazole studied by vacuum ultraviolet photoabsorption and ultraviolet photoelectron spectroscopy, and a comparison with ab initio configuration interaction methods

    DEFF Research Database (Denmark)

    Palmer, Michael H.; Hoffmann, Søren Vrønning; Jones, Nykola C.

    2011-01-01

    The Rydberg states in the vacuum ultraviolet photoabsorption spectrum of 1,2,3-triazole have been measured and analyzed with the aid of comparison to the UV valence photoelectron ionizations and the results of ab initio configuration interaction (CI) calculations. Calculated electronic ionization...

  11. Normal modes and mode transformation of pure electron vortex beams.

    Science.gov (United States)

    Thirunavukkarasu, G; Mousley, M; Babiker, M; Yuan, J

    2017-02-28

    Electron vortex beams constitute the first class of matter vortex beams which are currently routinely produced in the laboratory. Here, we briefly review the progress of this nascent field and put forward a natural quantum basis set which we show is suitable for the description of electron vortex beams. The normal modes are truncated Bessel beams (TBBs) defined in the aperture plane or the Fourier transform of the transverse structure of the TBBs (FT-TBBs) in the focal plane of a lens with the said aperture. As these modes are eigenfunctions of the axial orbital angular momentum operator, they can provide a complete description of the two-dimensional transverse distribution of the wave function of any electron vortex beam in such a system, in analogy with the prominent role Laguerre-Gaussian (LG) beams played in the description of optical vortex beams. The characteristics of the normal modes of TBBs and FT-TBBs are described, including the quantized orbital angular momentum (in terms of the winding number l) and the radial index p>0. We present the experimental realization of such beams using computer-generated holograms. The mode analysis can be carried out using astigmatic transformation optics, demonstrating close analogy with the astigmatic mode transformation between LG and Hermite-Gaussian beams.This article is part of the themed issue 'Optical orbital angular momentum'. © 2017 The Author(s).

  12. Investigating the Mode Structure of the Weakly Coherent Mode

    Science.gov (United States)

    Golfinopoulos, T.; Labombard, B.; Hubbard, A.; Hughes, J. W.; Whyte, D.; Granetz, R.; Davis, E. M.; Edlund, E.; Ennever, P.; Greenwald, M.; Marmar, E.; Porkolab, M.; Wolfe, S. M.; Wukitch, S. J.; Alcator C-Mod Team

    2017-10-01

    The Weakly Coherent Mode (WCM, 200-500 kHz, k⊥ρs < 0.1) is an edge phenomenon associated with I-mode, a steady state, ELM-free confinement regime that has been observed on the Alcator C-Mod, ASDEX-Upgrade, and DIII-D tokamaks. I-mode is characterized by high particle flux, creating a separation of transport channels that leads to the development of a temperature pedestal, but not a density pedestal. The WCM is thought to contribute to this increased particle flux, though its precise role in regulating edge transport is not well-understood. Here, we investigate the structure of the WCM, particularly regarding poloidal asymmetry, using data from poloidally- and toroidally-arrayed Mirnov coils, as well as phase contrast imaging, with radial profiles of Te, ne, and Φ in the scrape-off layer provided by the Mirror Langmuir Probe. The WCM phenomenology is then compared to that of the Quasi-Coherent Mode, the edge fluctuation responsible for exhausting impurities in the Enhanced Dα H-mode. This work is supported by USDoE award DE-FC02-99ER54512.

  13. Microsolvation of LiI and CsI in water: anion photoelectron spectroscopy and ab initio calculations.

    Science.gov (United States)

    Li, Ren-Zhong; Liu, Cheng-Wen; Gao, Yi Qin; Jiang, Hong; Xu, Hong-Guang; Zheng, Wei-Jun

    2013-04-03

    In order to understand the microsolvation of LiI and CsI in water and provide information about the dependence of solvation processes on different ions, we investigated the LiI(H2O)n(-) and CsI(H2O)n(-) (n = 0-6) clusters using photoelectron spectroscopy. The structures of these clusters and their corresponding neutrals were investigated with ab initio calculations and confirmed by comparing with the photoelectron spectroscopy experiments. Our studies show that the structural evolutions of LiI(H2O)n and CsI(H2O)n clusters are very different. The Li-I distance in LiI(H2O)n(-) increases abruptly at n = 3, whereas the abrupt elongation of the Li-I distance in neutral LiI(H2O)n occurs at n = 5. In contrast to the LiI(H2O)n(-) clusters, the Cs-I distance in CsI(H2O)n(-) increases significantly at n = 3, reaches a maximum at n = 4, and decreases again as n increases further. There is no abrupt change of the Cs-I distance in neutral CsI(H2O)n as n increases from 0 to 6. Water molecules interact strongly with the Li ion; consequently, water molecule(s) can insert within the Li(+)-I(-) ion pair. In contrast, five or six water molecules are not enough to induce obvious separation of the Cs(+)-I(-) ion pair since the Cs-water interaction is relatively weak compared to the Li-water interaction. Our work has shown that the structural variation and microsolvation in MI(H2O)n clusters are determined by the delicate balance between ion-ion, ion-water, and water-water interactions, which may have significant implications for the general understanding of salt effects in water solution.

  14. Electron Anisotropy as a Signature of Mode Specific Isomerization in Vinylidene

    Science.gov (United States)

    Gibson, Stephen T.; Laws, Benjamin A.; Mabbs, Richard; Neumark, Daniel; Lineberger, Carl; Field, Robert W.

    2016-06-01

    he nature of the isomerization process that turns vinylidene into acetylene has been awaiting advances in experimental methods, to better define fractionation widths beyond those available in the seminal 1989 photoelectron spectrum measurement. This has proven a challenge. The technique of velocity-map imaging (VMI) is one avenue of approach. Images of electrons photodetached from vinylidene negative-ions, at various wavelengths, 1064 nm shown, provide more detail, including unassigned structure, but only an incremental improvement in the instrument line width. Intriguingly, the VMIs demonstrate a mode dependent variation in the electron anisotropy. Most notable in the figure, the inner-ring transition clusters are discontinuously, more isotropic. Electron anisotropy may provide an alternative key to examine the character of vinylidene transitions, mediating the necessity for an extreme resolution measurement. Vibrational dependent anisotropy has previously been observed in diatomic photoelectron spectra, associated with the coupling of electronic and nuclear motions. Research supported by the Australian Research Council Discovery Project Grant DP160102585. K. M. Ervin, J. Ho, and W. C. Lineberger, J. Chem. Phys. 91, 5974 (1989). doi:10.1063/1.457415 M. van Duzor et al. J. Chem. Phys. 133, 174311 (2010). doi:10.1063/1.3493349

  15. A Current Mode Detector Array for Gamma-Ray Asymmetry Measurements

    CERN Document Server

    Gericke, M T; Bowman, J D; Gillis, R C; Hartfield, J; Ino, T; Leuschner, M; Masuda, Y; Mitchell, G S; Muto, S; Nann, H; Page, S A; Penttil"a, S I; Ramsay, W D; Seo, P N; Snow, W M; Tasson, J; Wilburn, W S

    2004-01-01

    We have built a CsI(Tl) gamma-ray detector array for the NPDGamma experiment to search for a small parity-violating directional asymmetry in the angular distribution of 2.2 MeV gamma-rays from the capture of polarized cold neutrons by protons with a sensitivity of several ppb. The weak pion-nucleon coupling constant can be determined from this asymmetry. The small size of the asymmetry requires a high cold neutron flux, control of systematic errors at the ppb level, and the use of current mode gamma-ray detection with vacuum photo diodes and low-noise solid-state preamplifiers. The average detector photoelectron yield was determined to be 1300 photoelectrons per MeV. The RMS width seen in the measurement is therefore dominated by the fluctuations in the number of gamma rays absorbed in the detector (counting statistics) rather than the intrinsic detector noise. The detectors were tested for noise performance, sensitivity to magnetic fields, pedestal stability and cosmic background. False asymmetries due to ga...

  16. Optically Mediated Hybridization Between Two Mechanical Modes

    CERN Document Server

    Shkarin, A B; Hoch, S W; Deutsch, C; Reichel, J; Harris, J G E

    2013-01-01

    In this paper we study a system consisting of two nearly degenerate mechanical modes that couple to a single mode of an optical cavity. We show that this coupling leads to nearly complete (99.5%) hybridization of the two mechanical modes into a bright mode that experiences strong optomechanical interactions and a dark mode that experiences almost no optomechanical interactions. We use this hybridization to transfer energy between the mechanical modes with 40% efficiency.

  17. Challenges in higher order mode Raman amplifiers

    DEFF Research Database (Denmark)

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

    2015-01-01

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

  18. UV-Raman spectroscopy, X-ray photoelectron spectroscopy, and temperature programmed desorption studies of model and bulk heterogeneous catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Tewell, Craig Richmond [Univ. of California, Berkeley, CA (United States)

    2002-01-01

    X-ray photoelectron spectroscopy (XPS) and Temperature Programmed Desorption (TPD) have been used to investigate the surface structure of model heterogeneous catalysts in ultra-high vacuum (UHV). UV-Raman spectroscopy has been used to probe the structure of bulk model catalysts in ambient and reaction conditions. The structural information obtained through UV-Raman spectroscopy has been correlated with both the UHV surface analysis and reaction results. The present day propylene and ethylene polymerization catalysts (Ziegler-Natta catalysts) are prepared by deposition of TiCl4 and a Al(Et)3 co-catalyst on a microporous Mg-ethoxide support that is prepared from MgCl2 and ethanol. A model thin film catalyst is prepared by depositing metallic Mg on a Au foil in a UHV chamber in a background of TiCl4 in the gas phase. XPS results indicate that the Mg is completely oxidized to MgCl2 by TiCl4 resulting in a thin film of MgCl2/TiClx, where x = 2, 3, and 4. To prepare an active catalyst, the thin film of MgCl2/TiClx on Au foil is enclosed in a high pressure cell contained within the UHV chamber and exposed to ~1 Torr of Al(Et)3.

  19. Excited state non-adiabatic dynamics of N-methylpyrrole: A time-resolved photoelectron spectroscopy and quantum dynamics study

    Energy Technology Data Exchange (ETDEWEB)

    Wu, Guorong [National Research Council Canada, 100 Sussex Drive, Ottawa, Ontario K1A 0R6 (Canada); State Key Laboratory of Molecular Reaction Dynamics, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian, Liaoning 116023 (China); Synergetic Innovation Center of Quantum Information & Quantum Physics, University of Science and Technology of China, Hefei, Anhui 230026 (China); Neville, Simon P. [Department of Chemistry, University of Ottawa, 10 Marie Curie, Ottawa, Ontario K1N 6N5 (Canada); Schalk, Oliver [National Research Council Canada, 100 Sussex Drive, Ottawa, Ontario K1A 0R6 (Canada); Department of Physics, AlbaNova University Center, Stockholm University, Roslagstullsbacken 21, 106 91 Stockholm (Sweden); Sekikawa, Taro [Department of Applied Physics, Hokkaido University, Kita-13 Nishi-8, Kita-ku, Sapporo 060-8628 (Japan); Ashfold, Michael N. R. [School of Chemistry, University of Bristol, Bristol BS8 1TS (United Kingdom); Worth, Graham A. [School of Chemistry, University of Birmingham, Edgbaston, Birmingham B15 2TT (United Kingdom); Stolow, Albert, E-mail: astolow@uottawa.ca [National Research Council Canada, 100 Sussex Drive, Ottawa, Ontario K1A 0R6 (Canada); Department of Chemistry, University of Ottawa, 10 Marie Curie, Ottawa, Ontario K1N 6N5 (Canada); Department of Physics, University of Ottawa, 150 Louis Pasteur, Ottawa, Ontario K1N 6N5 (Canada)

    2016-01-07

    The dynamics of N-methylpyrrole following excitation at wavelengths in the range 241.5-217.0 nm were studied using a combination of time-resolved photoelectron spectroscopy (TRPES), ab initio quantum dynamics calculations using the multi-layer multi-configurational time-dependent Hartree method, as well as high-level photoionization cross section calculations. Excitation at 241.5 and 236.2 nm results in population of the A{sub 2}(πσ{sup ∗}) state, in agreement with previous studies. Excitation at 217.0 nm prepares the previously neglected B{sub 1}(π3p{sub y}) Rydberg state, followed by prompt internal conversion to the A{sub 2}(πσ{sup ∗}) state. In contrast with the photoinduced dynamics of pyrrole, the lifetime of the wavepacket in the A{sub 2}(πσ{sup ∗}) state was found to vary with excitation wavelength, decreasing by one order of magnitude upon tuning from 241.5 nm to 236.2 nm and by more than three orders of magnitude when excited at 217.0 nm. The order of magnitude difference in lifetimes measured at the longer excitation wavelengths is attributed to vibrational excitation in the A{sub 2}(πσ{sup ∗}) state, facilitating wavepacket motion around the potential barrier in the N–CH{sub 3} dissociation coordinate.

  20. Electrochemical impedance spectroscopy and X-ray photoelectron spectroscopy study of the corrosion behaviour of galvanized steel and electroplating steel

    Energy Technology Data Exchange (ETDEWEB)

    Lebrini, M., E-mail: mlebrini@yahoo.fr [Laboratoire des Procedes d' Elaboration des Revetements Fonctionnels, PERF-LSPES UMR CNRS 8008, ENSCL, BP 90108, F-59652 Villeneuve d' Ascq Cedex (France); Traisnel, M. [Laboratoire des Procedes d' Elaboration des Revetements Fonctionnels, PERF-LSPES UMR CNRS 8008, ENSCL, BP 90108, F-59652 Villeneuve d' Ascq Cedex (France); Gengembre, L. [Unite de Catalyse et Chimie du solide UMR 8181 Bat C3, USTL, F-59655, Villeneuve d' Ascq Cedex (France); Fontaine, G. [Laboratoire des Procedes d' Elaboration des Revetements Fonctionnels, PERF-LSPES UMR CNRS 8008, ENSCL, BP 90108, F-59652 Villeneuve d' Ascq Cedex (France); Lerasle, O.; Genet, N. [TOTAL France, Centre de Recherche de Solaize, Chemin du canal, BP 22, F-69360 Solaize (France)

    2011-02-01

    The efficiency of a formula containing 2-{l_brace}(2-hydroxyethyl)[(4-methyl-1H-1,2,3-benzotriazol-1-yl)methyl] amino{r_brace}ethanol (tolyltriazole) and decanoic acid as corrosion inhibitor for galvanized steel and electroplating steel in aqueous solution have been determined by electrochemical impedance spectroscopy (EIS) techniques. The experimental data obtained from this method show a frequency distribution and therefore a modelling element with frequency dispersion behaviour, a constant phase element (CPE) has been used. The corrosion behaviour in the presence of different concentration of decanoic acid (DA) in the formula was also investigated by EIS. Results obtained reveal that, the formula is a good inhibitor for galvanized steel and electroplating steel in aqueous solution, the better performance was obtained in the case of galvanized steel. The ability of the inhibitor to be adsorbed on the surface was dependent on the nature of metal. X-ray photoelectron spectroscopy surface analysis with inhibitor shows that it's chemisorbed at the galvanized and electroplating steel/aqueous solution interface.

  1. Probing microhydration effect on the electronic structure of the GFP chromophore anion: Photoelectron spectroscopy and theoretical investigations

    Energy Technology Data Exchange (ETDEWEB)

    Bhaskaran-Nair, Kiran; Shelton, William A. [Cain Department of Chemical Engineering, Louisiana State University, Baton Rouge, Louisiana 70803 (United States); Center for Computation and Technology, Louisiana State University, Baton Rouge, Louisiana 70803 (United States); Valiev, Marat; Kowalski, Karol, E-mail: karol.kowalski@pnnl.gov [William R. Wiley Environmental Molecular Sciences Laboratory, Pacific Northwest National Laboratory, K8-91, P.O. Box 999, Richland, Washington 99352 (United States); Deng, S. H. M.; Wang, Xue-Bin, E-mail: xuebin.wang@pnnl.gov [Physical Sciences Division, Pacific Northwest National Laboratory, K8-88, P.O. Box 999, Richland, Washington 99352 (United States)

    2015-12-14

    The photophysics of the Green Fluorescent Protein (GFP) chromophore is critically dependent on its local structure and on its environment. Despite extensive experimental and computational studies, there remain many open questions regarding the key fundamental variables that govern this process. One outstanding problem is the role of autoionization as a possible relaxation pathway of the excited state under different environmental conditions. This issue is considered in our work through combined experimental and theoretical studies of microsolvated clusters of the deprotonated p-hydroxybenzylidene-2,3-dimethylimidazolinone anion (HBDI{sup −}), an analog of the GFP chromophore. Through selective generation of microsolvated structures of predetermined size and subsequent analysis of experimental photoelectron spectra by high level ab initio methods, we are able to precisely identify the structure of the system, establish the accuracy of theoretical data, and provide reliable description of auto-ionization process as a function of hydrogen-bonding environment. Our study clearly illustrates the first few water molecules progressively stabilize the excited state of the chromophore anion against the autodetached neutral state, which should be an important trait for crystallographic water molecules in GFPs that has not been fully explored to date.

  2. Probing microhydration effect on the electronic structure of the GFP chromophore anion. Photoelectron spectroscopy and theoretical investigations

    Energy Technology Data Exchange (ETDEWEB)

    Bhaskaran-Nair, Kiran; Valiev, Marat; Deng, Shihu; Shelton, William A.; Kowalski, Karol; Wang, Xue B.

    2015-12-14

    The photophysics of Green Fluorescent Protein (GFP) chromophore is critically dependent on its local structure and on its environment. Despite extensive experimental and computational studies, there remain many open questions regarding the key fundamental variables that govern this process. One outstanding problem is the role of autoionization as a possible relaxation pathway of the excited state under different environmental conditions. This issue is considered in our work through combined experimental and theoretical studies of microsolvated clusters of the deprotonated p-hydroxybenzylidene-2,3-dimethylimidazolinone anion (HBDI⁻), an analog of GFP chromophore. Through selective generation of microsolvated structures of predetermined size and subsequent analysis of experimental photoelectron spectra by high level ab-initio methods we are able to precisely identify the structure of the system, establish the accuracy of theoretical data, and provide reliable description of auto-ionization process as a function of hydrogen-bonding environment. Our study clearly illustrates the first few water molecules progressively stabilize the excited state of the chromophore anion against the autodetached neutral state, which should be an important trait for crystallographic water molecules in GFPs that has not been fully explored to date.

  3. Probing microhydration effect on the electronic structure of the GFP chromophore anion: Photoelectron spectroscopy and theoretical investigations

    Science.gov (United States)

    Bhaskaran-Nair, Kiran; Valiev, Marat; Deng, S. H. M.; Shelton, William A.; Kowalski, Karol; Wang, Xue-Bin

    2015-12-01

    The photophysics of the Green Fluorescent Protein (GFP) chromophore is critically dependent on its local structure and on its environment. Despite extensive experimental and computational studies, there remain many open questions regarding the key fundamental variables that govern this process. One outstanding problem is the role of autoionization as a possible relaxation pathway of the excited state under different environmental conditions. This issue is considered in our work through combined experimental and theoretical studies of microsolvated clusters of the deprotonated p-hydroxybenzylidene-2,3-dimethylimidazolinone anion (HBDI-), an analog of the GFP chromophore. Through selective generation of microsolvated structures of predetermined size and subsequent analysis of experimental photoelectron spectra by high level ab initio methods, we are able to precisely identify the structure of the system, establish the accuracy of theoretical data, and provide reliable description of auto-ionization process as a function of hydrogen-bonding environment. Our study clearly illustrates the first few water molecules progressively stabilize the excited state of the chromophore anion against the autodetached neutral state, which should be an important trait for crystallographic water molecules in GFPs that has not been fully explored to date.

  4. Electronic Structure of the d Bent-metallocene Cp(2)VCl(2): A Photoelectron and Density Functional Study.

    Science.gov (United States)

    Cranswick, Matthew A; Gruhn, Nadine E; Enemark, John H; Lichtenberger, Dennis L

    2008-04-15

    The Cp(2)VCl(2) molecule is a prototype for bent metallocene complexes with a single electron in the metal d shell, but experimental measure of the binding energy of the d electron by photoelectron spectroscopy eluded early attempts due to apparent decomposition in the spectrometer to Cp(2)VCl. With improved instrumentation, the amount of decomposition is reduced and subtraction of ionization intensity due to Cp(2)VCl from the Cp(2)VCl(2)/Cp(2)VCl mixed spectrum yields the Cp(2)VCl(2) spectrum exclusively. The measured ionization energies provide well-defined benchmarks for electronic structure calculations. Density functional calculations support the spectral interpretations and agree well with the ionization energy of the d(1) electron and the energies of the higher positive ion states of Cp(2)VCl(2). The calculations also account well for the trends to the other Group V bent metallocene dichlorides Cp(2)NbCl(2) and Cp(2)TaCl(2). The first ionization energy of Cp(2)VCl(2) is considerably greater than the first ionization energies of the second- and third-row transition metal analogues.

  5. Anion Binding of One-, Two-, and Three-Armed Thiourea Receptors Examined via Photoelectron Spectroscopy and Quantum Computations

    Energy Technology Data Exchange (ETDEWEB)

    Beletskiy, Evgeny V.; Wang, Xue-Bin; Kass, Steven R.

    2016-10-27

    A benzene ring substituted with 1–3 thiourea containing arms (1–3) were examined by photoelectron spectroscopy and density functional theory computations. Their conjugate bases and chloride, acetate and dihydrogen phosphate anion clusters are reported. The resulting vertical and adiabatic detachment energies span from 3.93 – 5.82 eV (VDE) and 3.65 – 5.10 (ADE) for the deprotonated species and 4.88 – 5.97 eV (VDE) and 4.45 – 5.60 eV (ADE) for the anion complexes. These results reveal the stabilizing effects of multiple hydrogen bonds and anionic host-guest interactions in the gas phase. Previously measured equilibrium binding constants in aqueous dimethyl sulfoxide for all three thioureas (Org. Biolmol. Chem. 2015, 13, 2170-2176) are compared to the present results and cooperative binding is uniformly observed in the gas phase but only for one case (i.e., 3 • H2PO4–) in solution.

  6. Excitation of plasma waves by unstable photoelectron and thermal electron populations on closed magnetic field lines in the Martian ionosphere

    Directory of Open Access Journals (Sweden)

    N. Borisov

    2005-06-01

    Full Text Available It is argued that anisotropic electron pitch angle distributions in the closed magnetic field regions of the Martian ionosphere gives rise to excitation of plasma instabilities. We discuss two types of instabilities that are excited by two different populations of electrons. First, the generation of Langmuir waves by photoelectrons with energies of the order of 10eV is investigated. It is predicted that the measured anisotropy of their pitch angle distribution at the heights z≈400km causes excitation of waves with frequencies f~30kHz and wavelengths λ~30m. Near the terminators the instability of the electrostatic waves with frequencies of the order of or less than the electron gyrofrequency exited by thermal electrons is predicted. The typical frequencies of these waves depend on the local magnitude of the magnetic field and can achieve values f~3-5kHz above strong crustal magnetic fields.

  7. Probing The Electronic Properties of Dichromium Oxide Clusters Cr2On-(n=1-7) Using Photoelectron Spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Zhai, Hua-jin; Wang, Lai S.

    2006-10-28

    In an effort to elucidate the variation of the electronic structure as a function of oxidation and composition, we investigated an extensive series of dichromium oxide clusters, Cr2On- (n = 1-7) using photoelectron spectroscopy (PES). Well-resolved PES spectra were obtained at several photon energies. While low photon energy spectra yielded much better spectral resolution, high photon energy data allowed both Cr 3d- and O 2p-dreived detachment features to be observed. The overall spectral evolution of Cr2On– exhibits a behavior of sequential oxidation with increasing oxygen content, where low binding energy Cr 3d-based spectral features diminish in numbers and the spectra shift towards higher binding energies as a result of charge transfer from Cr to O. Evidence was obtained for the population of low-lying isomers for Cr2O2-, Cr2O3-, and Cr2O6-. The current data are compared with previous studies and with related studies on W2On- and Mo2On-.

  8. Time-of-flight secondary ion mass spectrometry and X-ray photoelectron spectroscopy analyses of Bixa orellana seeds.

    Science.gov (United States)

    Felicissimo, Marcella P; Bittencourt, Carla; Houssiau, Laurent; Pireaux, Jean-Jacques

    2004-04-07

    Three different experiments were performed in order to obtain the major carotenoid composition of the natural colorant annatto (E160b) through ToF-SIMS (time-of-flight secondary ion mass spectrometry) and XPS (X-ray photoelectron spectroscopy) analyses. In the first experiment, Bixa orellana seeds aril as well as its interior part were analyzed. The analysis of the seeds aril by ToF-SIMS gives the colorant fingerprint without any sample treatment, showing the presence of bixin and its characteristic fragments. The analysis performed in the interior part of the seeds indicates the presence of Fe. The second set of measurements was conducted on the seeds organic extract right after extraction revealing the same components observed by in situ measurement. A third set of measurements was performed aiming to determine the reason for the organic extract color shift observed after 3 months of exposure to ambient light at room temperature. In this case, it was possible to evidence the degradation of bixin by the loss of xylene molecules through ToF-SIMS and the probable carotenoid oxidation based on the C1s XPS spectrum of the degraded extract.

  9. Photon counting imaging with an electron-bombarded CCD: Towards a parallel-processing photoelectronic time-to-amplitude converter

    Energy Technology Data Exchange (ETDEWEB)

    Hirvonen, Liisa M.; Jiggins, Stephen; Sergent, Nicolas; Zanda, Gianmarco; Suhling, Klaus, E-mail: klaus.suhling@kcl.ac.uk [Department of Physics, King' s College London, Strand, London WC2R 2LS (United Kingdom)

    2014-12-15

    We have used an electron-bombarded CCD for optical photon counting imaging. The photon event pulse height distribution was found to be linearly dependent on the gain voltage. We propose on this basis that a gain voltage sweep during exposure in an electron-bombarded sensor would allow photon arrival time determination with sub-frame exposure time resolution. This effectively uses an electron-bombarded sensor as a parallel-processing photoelectronic time-to-amplitude converter, or a two-dimensional photon counting streak camera. Several applications that require timing of photon arrival, including Fluorescence Lifetime Imaging Microscopy, may benefit from such an approach. A simulation of a voltage sweep performed with experimental data collected with different acceleration voltages validates the principle of this approach. Moreover, photon event centroiding was performed and a hybrid 50% Gaussian/Centre of Gravity + 50% Hyperbolic cosine centroiding algorithm was found to yield the lowest fixed pattern noise. Finally, the camera was mounted on a fluorescence microscope to image F-actin filaments stained with the fluorescent dye Alexa 488 in fixed cells.

  10. X-ray photoelectron spectra and electronic structure of quasi-one-dimensional SbSeI crystals

    Directory of Open Access Journals (Sweden)

    J.Grigas

    2007-01-01

    Full Text Available The paper presents the X-ray photoelectron spectra (XPS of the valence band (VB and of the principal core levels from the (110 and (001 crystal surfaces for the quasi-one-dimensional high permittivity SbSeI single crystal isostructural to ferroelectric SbSI. The XPS were measured with monochromatized Al Ka radiation in the energy range of 0-1400 eV at room temperature. The VB is located from 1.6 to 20 eV below the Fermi level. Experimental energies of the VB and core levels are compared with the results of theoretical ab initio calculations of the molecular model of the SbSeI crystal. The electronic structure of the VB is revealed. Shifts in the core-level binding energies of surface atoms relative to bulk ones, which show a dependency on surface crystallography, have been observed. The chemical shifts of the core levels (CL in the SbSeI crystal for the Sb, I and Se states are obtained.

  11. Evaluating the Internal Structure of Core-Shell Nanoparticles Using X-ray Photoelectron Intensities and Simulated Spectra.

    Science.gov (United States)

    Chudzicki, M; Werner, W S M; Shard, A G; Wang, Y-C; Castner, D G; Powell, C J

    2015-08-06

    The functionality of a new version of the National Institute of Standards and Technology database Simulation of Electron Spectra for Surface Analysis (SESSA) has been extended by implementing a new geometry engine. The engine enables users to simulate Auger-electron spectra and X-ray photoelectron spectra for different predefined morphologies (planar, islands, spheres, multi-layer core-shell particles). We compared shell thicknesses of core-shell nanoparticles derived from core-shell XPS peak intensities using Shard's method, which allows one to estimate shell thicknesses of core-shell nanoparticles, and a series of SESSA simulations for a wide range of nanoparticle dimensions. We obtained very good agreement of the shell thicknesses for cases where elastic scattering within the shell can be neglected, a result that is in accordance with the underlying assumptions of the Shard model. If elastic-scattering effects are important, there can be thickness uncertainties of up to 25 %. Experimental spectra of functionalized gold nanoparticles obtained by Techane et al. were analyzed with SESSA 2.0 both with respect to the relevant peak intensities as well as the spectral shape. Good agreement between experiment and theory was found for both cases. These results show that the single-sphere model for core-shell nanoparticles is valid when just using peak intensities, but more detailed modeling is needed to describe the inelastic background.

  12. Quantitative analysis of povidone-iodine thin films by X-ray photoelectron spectroscopy and their physicochemical properties

    Directory of Open Access Journals (Sweden)

    Sa Anongtip

    2017-06-01

    Full Text Available In this study, povidone-iodine (PVP-I has been formulated as a topical spray to produce a thin film for the controlled release of I2. By means of experimental design, 27 formulations containing glycerol, ethanol, PEG 400, copovidone and HFA 134a as a propellant were prepared. The pH values of all formulations were in the range of 6-7. The viscosity was within the range of 11.9-85.9 mPa s. The surface tensions were 20.3 to 24.6 mN m-1 and the contact angles were between 19.3 and 38.7°. The assays for the iodine contents were within acceptable range (80-120 %. X-ray photoelectron spectroscopy analysis revealed the ionized form of iodine was much higher than the unionized form. The MIC and MBC values of the PVP-I sprays against Staphylococcus aureus, S. epidermidis and Pseudomonas aeruginosa were higher than that of commercial PVP-I solution. The cytotoxicity study confirmed that the PVP-I spray had lower toxic effects on keratinocytes and fibroblasts compared to the commercial PVP-I solution. The formulation containing 59 % ethanol, 18 % copovidone and 12 % PEG 400 showed good antibacterial activity.

  13. Study of the initial oxidation of the U4Zr2Nb alloy by X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Mendonca, Renato de; Ferraz, Wilmar B.; Braga, Daniel M.; Macedo, Waldemar A.A., E-mail: rem@cdtn.b [Centro de Desenvolvimento da Tecnologia Nuclear (CDTN/CNEN-MG), Belo Horizonte, MG (Brazil)

    2009-07-01

    In this work, the initial stages of oxidation of the U4Zr2Nb alloy in O{sub 2} atmosphere were studied in-situ, in ultrahigh vacuum, by X-ray photoelectron spectroscopy (XPS), an advanced surface-sensitive technique. After several hours of Ar{sup +}ion-sputtering to surface cleanness, the O{sub 2} exposures was realized on the sample at room temperature. The evolution of oxide film formed on the sample surface was followed by XPS measures, by using Mg K{sub a}lpha radiation of 1253.6 eV and a CLAM-2 (Vacuum Generator) electron energy analyzer. The changes of U 4f, Nb 3d, Zr 3d and O 1s photoemission peaks with O{sub 2} exposure indicate that the adsorption of oxygen on the U4Zr2Nb alloy surface leads to fast formation of UO{sub 2}. The alloying elements show slower oxidation and different compounds are observed in Nb 3d spectra analysis. This work shows an expressive enlargement of Nb 3d peak at 100 Langmuir exposure, indicating the formation of Nb{sub 2}O{sub 5} and NbO in the oxide. On the other hand, the binding energy of Zr 3d suggests that the ZrO{sub 2} formation is stable as well as uranium dioxide. (author)

  14. The hydrogen bond strength of the phenol-phenolate anionic complex: a computational and photoelectron spectroscopic study.

    Science.gov (United States)

    Buytendyk, Allyson M; Graham, Jacob D; Collins, Kim D; Bowen, Kit H; Wu, Chia-Hua; Wu, Judy I

    2015-10-14

    The phenol-phenolate anionic complex was studied in vacuo by negative ion photoelectron spectroscopy using 193 nm photons and by density functional theory (DFT) computations at the ωB97XD/6-311+G(2d,p) level. We characterize the phenol-phenolate anionic complex as a proton-coupled phenolate pair, i.e., as a low-barrier hydrogen bond system. Since the phenol-phenolate anionic complex was studied in the gas phase, its measured hydrogen bond strength is its maximal ionic hydrogen bond strength. The D(PhO(-)···HOPh) interaction energy (26-30 kcal mol(-1)), i.e., the hydrogen bond strength in the PhO(-)···HOPh complex, is quite substantial. Block-localized wavefunction (BLW) computations reveal that hydrogen bonded phenol rings exhibit increased ring π-electron delocalization energies compared to the free phenol monomer. This additional stabilization may explain the stronger than expected proton donating ability of phenol.

  15. Sodium ions at defect sites at SiO2/Si interfaces as determined by X-ray photoelectron spectroscopy

    Science.gov (United States)

    Grunthaner, F. J.; Masserjian, J.

    1975-01-01

    X-ray photoelectron spectroscopy (XPS) is described in its application as a probe for studying defects such as sodium in SiO2 films. A general description is given of key experimental methods in XPS. Techniques are described for applying and monitoring a fixed bias at the surface of the oxide during the XPS measurement. These methods are shown to be capable of detecting extremely small Na and Cu concentrations in undoped samples (less than 10 to the 11th power per cu cm). In deliberately Na-doped samples, five spectral peaks are distinctly observed and related to different defect states at the vacuum/SiO2 and SiO2/Si interfaces. By applying a bias-temperature stress during the XPS measurements, these peaks change in relative intensity and can be related to the motion of the Na(+) ions between different states occurring at the two interfaces. An attempt is made to correlate the observations with previously reported models.

  16. Band alignment of HfO{sub 2}/AlN heterojunction investigated by X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Ye, Gang [School of Electrical and Electronic Engineering, Nanyang Technological University, Singapore 639798 (Singapore); Wang, Hong, E-mail: ewanghong@ntu.edu.sg [School of Electrical and Electronic Engineering, Nanyang Technological University, Singapore 639798 (Singapore); CNRS-International-NTU-THALES Research Alliances/UMI 3288, 50 Nanyang Drive, Singapore 637553 (Singapore); Ji, Rong [Data Storage Institute, Agency for Science Technology and Research (A-STAR), Singapore 117608 (Singapore)

    2016-04-18

    The band alignment between AlN and Atomic-Layer-Deposited (ALD) HfO{sub 2} was determined by X-ray photoelectron spectroscopy (XPS). The shift of Al 2p core-levels to lower binding energies with the decrease of take-off angles θ indicated upward band bending occurred at the AlN surface. Based on the angle-resolved XPS measurements combined with numerical calculations, valence band discontinuity ΔE{sub V} of 0.4 ± 0.2 eV at HfO{sub 2}/AlN interface was determined by taking AlN surface band bending into account. By taking the band gap of HfO{sub 2} and AlN as 5.8 eV and 6.2 eV, respectively, a type-II band line-up was found between HfO{sub 2} and AlN.

  17. Beta-heterosubstituted acrylonitriles--electronic structure study by UV-photoelectron spectroscopy and quantum chemical calculations.

    Science.gov (United States)

    Chrostowska, Anna; Nguyen, Thi Xuan Mai; Dargelos, Alain; Khayar, Saïd; Graciaa, Alain; Guillemin, Jean-Claude

    2009-03-19

    Beta-heterosubstituted acrylonitriles correspond to the formal addition of nucleophiles on cyanoacetylene. Acrylonitriles substituted with an amino, methoxy, mercapto group, or halogeno atom have been synthesized. Rearrangements between Z and E stereoisomers or tautomerizations have been studied by NMR spectroscopy and by quantum calculations. The photoelectron spectra were recorded and analyzed with the aid of a time-dependent density functional theory, ab initio OVGF, and so-called "corrected" ionization energy calculations. The electronic structure of the studied species was determined, and strong differences between beta-heterosubstituted acrylonitriles and the corresponding nitrile-free heteroalkenes were clearly documented. A "push-pull" effect was noticed, due to the combined donor effect of the substituent on one side of the carbon-carbon double bond and the electron-withdrawing effect of the nitrile group on the other side. Thus, the presence of a nitrile group strongly stabilizes the electronic structure. The efficient pi-donor contribution of the NH(2) and SH groups was evidenced.

  18. In Situ Ambient Pressure X-ray Photoelectron Spectroscopy of Cobalt Perovskite Surfaces under Cathodic Polarization at High Temperatures

    KAUST Repository

    Crumlin, Ethan J.

    2013-08-08

    Heterostructured oxide interfaces have demonstrated enhanced oxygen reduction reaction rates at elevated temperatures (∼500-800 C); however, the physical origin underlying this enhancement is not well understood. By using synchrotron-based in situ ambient pressure X-ray photoelectron spectroscopy (APXPS), we focus on understanding the surface electronic structure, elemental composition, and chemical nature of epitaxial La0.8Sr 0.2CoO3-δ (LSC113), (La 0.5Sr0.5)2CoO4±δ (LSC214), and LSC214-decorated LSC113 (LSC 113/214) thin films as a function of applied electrical potentials (0 to -800 mV) at 520 C and p(O2) of 1 × 10-3 atm. Shifts in the top of the valence band binding energy and changes in the Sr 3d and O 1s spectral components under applied bias reveal key differences among the film chemistries, most notably in the degree of Sr segregation to the surface and quantity of active oxygen sites in the perovskite termination layer. These differences help to identify important factors governing the enhanced activity of oxygen electrocatalysis observed for the LSC113/214 heterostructured surface. © 2013 American Chemical Society.

  19. Derivation of Hamaker Dispersion Energy of Amorphous Carbon Surfaces in Contact with Liquids Using Photoelectron Energy-Loss Spectra

    Science.gov (United States)

    Godet, Christian; David, Denis

    2017-12-01

    Hamaker interaction energies and cutoff distances have been calculated for disordered carbon films, in contact with purely dispersive (diiodomethane) or polar (water) liquids, using their experimental dielectric functions ɛ ( q, ω) obtained over a broad energy range. In contrast with previous works, a q-averaged q is derived from photoelectron energy-loss spectroscopy (XPS-PEELS) where the energy loss function (ELF) q is a weighted average over allowed transferred wave vector values, q, given by the physics of bulk plasmon excitation. For microcrystalline diamond and amorphous carbon films with a wide range of (sp3/sp2 + sp3) hybridization, non-retarded Hamaker energies, A 132 ( L < 1 nm), were calculated in several configurations, and distance and wavenumber cutoff values were then calculated based on A 132 and the dispersive work of adhesion obtained from contact angles. A geometric average approximation, H 0 CVL = ( H 0 CVC H 0 LVL )1/2, holds for the cutoff separation distances obtained for carbon-vacuum-liquid (CVL), carbon-vacuum-carbon (CVC) and liquid-vacuum-liquid (LVL) equilibrium configurations. The linear dependence found for A CVL, A CLC and A CLV values as a function of A CVC, for each liquid, allows predictive relationships for Hamaker energies (in any configuration) using experimental determination of the dispersive component of the surface tension, {γ}_{CV}^d , and a guess value of the cutoff distance H 0 CVC of the solid. [Figure not available: see fulltext.

  20. Reactivity of Au nanoparticles supported over SiO2 and TiO2 studiedby ambient pressure photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Herranz, Tirma; Deng, Xingyi; Cabot, Andreu; Alivisatos, Paul; Liu, Zhi; Soler-Illia, Galo; Salmeron, Miquel

    2009-04-15

    The influence of the metal cluster size and the identity of the support on the reactivity of gold based catalysts have been studied in the CO oxidation reaction. To overcome the structural complexity of the supported catalysts, gold nanoparticles synthesized from colloidal chemistry with precisely controlled size have been used. Those particles were supported over SiO{sub 2} and TiO{sub 2} and their catalytic activity was measured in a flow reactor. The reaction rate was dependent on the particle size and the support, suggesting two reaction pathways in the CO oxidation reaction. In parallel, ambient pressure photoelectron spectroscopy (APPS) has been performed under reaction conditions using bidimensional model catalysts prepared upon supporting the Au nanoparticles over planar polycrystalline SiO{sub 2} and TiO{sub 2} thin films by means of the Langmuir-Blodgett (LB) technique to mimic the characteristic of the powder samples. In this way, the catalytically active surface was characterized under true reaction conditions, revealing that during CO oxidation gold remains in the metallic state.

  1. Adsorption of Saliva Related Protein on Denture Materials: An X-Ray Photoelectron Spectroscopy and Quartz Crystal Microbalance Study

    Directory of Open Access Journals (Sweden)

    Akiko Miyake

    2016-01-01

    Full Text Available The aim of this study was to evaluate the difference in the adsorption behavior of different types of bovine salivary proteins on the PMMA and Ti QCM sensors are fabricated by spin-coating and sputtering onto bare QCM sensors by using QCM and X-ray photoelectron spectroscopy (XPS. SPM, XPS, and contact angle investigations were carried out to determine the chemical composition and surface wettability of the QCM surface. We discuss the quality of each sensor and evaluate the potential of the high-frequency QCM sensors by investigating the binding between the QCM sensor and the proteins albumin and mucin (a salivary-related protein. The SPM image showed a relatively homogeneous surface with nano-order roughness. The XPS survey spectra of the thin films coated on the sensors were similar to the binding energy of the characteristic spectra of PMMA and Ti. Additionally, the amount of salivary-related protein on the PMMA QCM sensor was higher than those on the Ti and Au QCM sensors. The difference of protein adsorption is proposed to be related to the wettability of each material. The PMMA and Ti QCM sensors are useful tools to study the adsorption and desorption of albumin and mucin on denture surfaces.

  2. Experimental determination of vacuum-level band alignments of SnS-based solar cells by photoelectron yield spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Sugiyama, Mutsumi, E-mail: mutsumi@rs.noda.tus.ac.jp; Shimizu, Tsubasa; Kawade, Daisuke [Department of Electrical Engineering, Faculty of Science and Technology, Tokyo University of Science, 2641 Yamazaki, Noda 278-8510 (Japan); Ramya, Kottadi; Ramakrishna Reddy, K. T. [Department of Physics, Sri Venkateswara University, Tirupati 517502 (India)

    2014-02-28

    Energy band offsets of SnS-based solar cell structure using various n-type semiconductors, such as CdS, SnS{sub 2}, In{sub 2}S{sub 3}, ZnIn{sub 2}Se{sub 4}, ZnO, and Mg{sub 0.3}In{sub 0.7}O, are evaluated by photoelectron yield spectroscopy. The valence band discontinuities are estimated to be 1.6 eV for both SnS/CdS and SnS/SnS{sub 2}, 0.9 eV for SnS/In{sub 2}S{sub 3}, 1.7 eV for SnS/ZnIn{sub 2}Se{sub 4}, and 1.8 eV for both SnS/ZnO and SnS/Mg{sub 0.3}Zn{sub 0.7}O. Using the valence band discontinuity values and the corresponding energy bandgaps of the layers, energy band diagrams are developed. This study implied a type-I heterostructure, appropriate for SnS-based solar cell, for the ZnIn{sub 2}Se{sub 4} or Mg{sub x}Zn{sub 1−x}O (0 ≤ x ≤ 0.3) interface and type-II for other junctions.

  3. Experimental determination of vacuum-level band alignments of SnS-based solar cells by photoelectron yield spectroscopy

    Science.gov (United States)

    Sugiyama, Mutsumi; Shimizu, Tsubasa; Kawade, Daisuke; Ramya, Kottadi; Ramakrishna Reddy, K. T.

    2014-02-01

    Energy band offsets of SnS-based solar cell structure using various n-type semiconductors, such as CdS, SnS2, In2S3, ZnIn2Se4, ZnO, and Mg0.3In0.7O, are evaluated by photoelectron yield spectroscopy. The valence band discontinuities are estimated to be 1.6 eV for both SnS/CdS and SnS/SnS2, 0.9 eV for SnS/In2S3, 1.7 eV for SnS/ZnIn2Se4, and 1.8 eV for both SnS/ZnO and SnS/Mg0.3Zn0.7O. Using the valence band discontinuity values and the corresponding energy bandgaps of the layers, energy band diagrams are developed. This study implied a type-I heterostructure, appropriate for SnS-based solar cell, for the ZnIn2Se4 or MgxZn1-xO (0 ≤ x ≤ 0.3) interface and type-II for other junctions.

  4. Analysis of the surface of tricalcium silicate during the induction period by X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Bellmann, F., E-mail: frank.bellmann@uni-weimar.de [Institute for Building Materials Science, Bauhaus University Weimar, 99423 Weimar (Germany); Sowoidnich, T.; Ludwig, H.-M. [Institute for Building Materials Science, Bauhaus University Weimar, 99423 Weimar (Germany); Damidot, D. [Ecole des Mines de Douai, Civil and Environmental Engineering Department, 941 rue Charles Bourseul, BP 10838, 59508 Doua cedex (France)

    2012-09-15

    X-ray photoelectron spectroscopy allows the analysis of surface layers with a thickness of a few nanometers. The method is sensitive to the chemical environment of the atoms since the binding energy of the electrons depends on the chemical bonds to neighboring atoms. It has been applied to the hydration of tricalcium silicate (Ca{sub 3}SiO{sub 5}, C{sub 3}S) by analyzing a sample after 30 min of hydration. Also two references have been investigated namely anhydrous C{sub 3}S and intermediate phase in order to enable a quantitative evaluation of the experimental data. In the hydrated C{sub 3}S sample, the analyzed volume (0.2 mm{sup 2} surface by 13 nm depth) contained approximately 44 wt.% of C{sub 3}S and 56 wt.% of intermediate phase whereas C-S-H was not detected. Scanning Electron Microscopy data and geometric considerations indicate that the intermediate phase forms a thin layer having a thickness of approximately 2 nm and covers the complete surface instead of forming isolated clusters.

  5. Band alignment of ZnO/multilayer MoS{sub 2} interface determined by x-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Xinke, E-mail: xkliu@szu.edu.cn, E-mail: liuwj@szu.edu.cn; He, Jiazhu; Chen, Le; Li, Kuilong; Jia, Fang; Zeng, Yuxiang; Lu, Youming; Zhu, Deliang; Liu, Wenjun, E-mail: xkliu@szu.edu.cn, E-mail: liuwj@szu.edu.cn [College of Materials Science and Engineering, Nanshan District Key Lab for Biopolymer and Safety Evaluation, Shenzhen University, 3688 Nanhai Ave, Shenzhen 518060 (China); Zhang, Yuan [School of Physics and Electronic Information, Hua Bei Normal University, 100 Dongshan Road, Huai Bei 235000 (China); Liu, Qiang; Yu, Wenjie [State Key Laboratory of Functional Materials for Informatics, Shanghai Institute of Microsystem and Information Technology, CAS, 865 Chang Ning Road, Shanghai 200050 (China); Wu, Jing [Institute of Materials research and Engineering (IMRE), 2 Fusionopolis Way, Innovis, #08-03, 138634 Singapore (Singapore); He, Zhubing [Department of Materials Science and Engineering, South University of Science and Technology of China, 1088 Xueyuan Road, Shenzhen 518055 (China); Ang, Kah-Wee [Department of Electrical and Computer Engineering, National University of Singapore, 4 Engineering Drive 3, 117583 Singapore (Singapore)

    2016-08-15

    The energy band alignment between ZnO and multilayer (ML)-MoS{sub 2} was characterized using high-resolution x-ray photoelectron spectroscopy. The ZnO film was deposited using an atomic layer deposition tool, and ML-MoS{sub 2} was grown by chemical vapor deposition. A valence band offset (VBO) of 3.32 eV and a conduction band offset (CBO) of 1.12 eV were obtained for the ZnO/ML-MoS{sub 2} interface without any treatment. With CHF{sub 3} plasma treatment, a VBO and a CBO across the ZnO/ML-MoS{sub 2} interface were found to be 3.54 eV and 1.34 eV, respectively. With the CHF{sub 3} plasma treatment, the band alignment of the ZnO/ML-MoS{sub 2} interface has been changed from type II or staggered band alignment to type III or misaligned one, which favors the electron-hole pair separation. The band alignment difference is believed to be dominated by the down-shift in the core level of Zn 2p or the interface dipoles, which is caused by the interfacial layer rich in F.

  6. Resonant photoelectron spectroscopy of γ-Al{sub 2}O{sub 3}/SrTiO{sub 3} heterostructures

    Energy Technology Data Exchange (ETDEWEB)

    Schuetz, Philipp; Pfaff, Florian; Zapf, Michael; Gabel, Judith; Dudy, Lenart; Berner, Goetz; Sing, Michael; Claessen, Ralph [Wuerzburg Univ. (Germany). Physikalisches Inst. and Roentgen Center for Complex Material Systems (RCCM); Chen, Yunzhong; Pryds, Nini [Technical Univ. of Denmark, Risoe (Denmark). Dept. of Energy Conversion and Storage; Rogalev, Victor; Strocov, Vladimir [Paul Scherrer Institut, Villigen (Switzerland). Swiss Light Source; Schlueter, Christoph; Lee, Tien-Lin [Diamond Light Source Ltd., Didcot (United Kingdom)

    2015-07-01

    The spinel/perovskite heterointerface between the band insulators γ-Al{sub 2}O{sub 3} and SrTiO{sub 3} hosts a two-dimensional electron system (2DES) with exceptionally high electron mobility. Soft X-ray resonant photoelectron spectroscopy at the Ti L absorption edge is used to probe the Ti 3d derived interface states. Marked differences in the resonance behavior are found for the SrTiO{sub 3} valence band and the different interface states, which are observed in the band gap of SrTiO{sub 3}. A comparison to X-ray absorption spectra of Ti 3d{sup 0} and Ti 3d{sup 1} systems reveals the presence of different types of electronic states with Ti 3d character, i.e., oxygen vacancy induced, trapped in-gap states and itinerant states contributing to the 2DES. Furthermore, exposure to low doses of oxygen during irradiation allows for the controlled and reversible manipulation of the interfacial electronic structure, i.e., the in-gap state intensity and the valence band offset between SrTiO{sub 3} and γ-Al{sub 2}O{sub 3}.

  7. On the nature of citrate-derived surface species on Ag nanoparticles: Insights from X-ray photoelectron spectroscopy

    Science.gov (United States)

    Mikhlin, Yuri L.; Vorobyev, Sergey A.; Saikova, Svetlana V.; Vishnyakova, Elena A.; Romanchenko, Alexander S.; Zharkov, Sergey M.; Larichev, Yurii V.

    2018-01-01

    Citrate is an important stabilizing, reducing, and complexing reagent in the wet chemical synthesis of nanoparticles of silver and other metals, however, the exact nature of adsorbates, and its mechanism of action are still uncertain. Here, we applied X-ray photoelectron spectroscopy, soft X-ray absorption near-edge spectroscopy, and other techniques in order to determine the surface composition and to specify the citrate-related species at Ag nanoparticles immobilized from the dense hydrosol prepared using room-temperature reduction of aqueous Ag+ ions with ferrous ions and citrate as stabilizer (Carey Lea method). It was found that, contrary to the common view, the species adsorbed on the Ag nanoparticles are, in large part, products of citrate decomposition comprising an alcohol group and one or two carboxylate bound to the surface Ag, and minor unbound carboxylate group; these may also be mixtures of citrate with lower molecular weight anions. No ketone groups were specified, and very minor surface Ag(I) and Fe (mainly, ferric oxyhydroxides) species were detected. Moreover, the adsorbates were different at AgNPs having various size and shape. The relation between the capping and the particle growth, colloidal stability of the high-concentration sol and properties of AgNPs is briefly considered.

  8. Tapping mode microwave impedance microscopy

    KAUST Repository

    Lai, K.

    2009-01-01

    We report tapping mode microwave impedance imaging based on atomic force microscope platforms. The shielded cantilever probe is critical to localize the tip-sample interaction near the tip apex. The modulated tip-sample impedance can be accurately simulated by the finite-element analysis and the result agrees quantitatively to the experimental data on a series of thin-film dielectric samples. The tapping mode microwave imaging is also superior to the contact mode in that the thermal drift in a long time scale is totally eliminated and an absolute measurement on the dielectric properties is possible. We demonstrated tapping images on working nanodevices, and the data are consistent with the transport results. © 2009 American Institute of Physics.

  9. Macroscopic (and microscopic massless modes

    Directory of Open Access Journals (Sweden)

    Michael C. Abbott

    2015-05-01

    Full Text Available We study certain spinning strings exploring the flat directions of AdS3×S3×S3×S1, the massless sector cousins of su(2 and sl(2 sector spinning strings. We describe these, and their vibrational modes, using the D(2,1;α2 algebraic curve. By exploiting a discrete symmetry of this structure which reverses the direction of motion on the spheres, and alters the masses of the fermionic modes s→κ−s, we find out how to treat the massless fermions which were previously missing from this formalism. We show that folded strings behave as a special case of circular strings, in a sense which includes their mode frequencies, and we are able to recover this fact in the worldsheet formalism. We use these frequencies to calculate one-loop corrections to the energy, with a version of the Beisert–Tseytlin resummation.

  10. Quasiadiabatic modes from viscous inhomogeneities

    CERN Document Server

    Giovannini, Massimo

    2016-04-20

    The viscous inhomogeneities of a relativistic plasma determine a further class of entropic modes whose amplitude must be sufficiently small since curvature perturbations are observed to be predominantly adiabatic and Gaussian over large scales. When the viscous coefficients only depend on the energy density of the fluid the corresponding curvature fluctuations are shown to be almost adiabatic. After addressing the problem in a gauge-invariant perturbative expansion, the same analysis is repeated at a non-perturbative level by investigating the nonlinear curvature inhomogeneities induced by the spatial variation of the viscous coefficients. It is demonstrated that the quasiadiabatic modes are suppressed in comparison with a bona fide adiabatic solution. Because of its anomalously large tensor to scalar ratio the quasiadiabatic mode cannot be a substitute for the conventional adiabatic paradigm so that, ultimately, the present findings seems to exclude the possibility of a successful accelerated dynamics solely...

  11. Soft mode and acoustic mode ferroelectric properties of deuterated ...

    Indian Academy of Sciences (India)

    SO4 crystal by a theoretical model which is extended with two sublattice pseudospin lattice coupled mode model by adding third, fourth and fifth order phonon anharmonic interaction terms as well as external electric field term in the crystal ...

  12. Enhancement-mode operation of multilayer MoS{sub 2} transistors with a fluoropolymer gate dielectric layer

    Energy Technology Data Exchange (ETDEWEB)

    Yoo, Geonwook; Choi, Sol Lea; Lee, Suelbe; Yoo, Byungwook; Oh, Min Suk, E-mail: ohms@keti.re.kr [Display Materials and Components Research Center, Korea Electronics Technology Institute, Gyeonggi 463-816 (Korea, Republic of); Kim, Sunkook [Multi-Functional Bio/Nano Laboratory, Kyung Hee University, Gyeonggi 446-701 (Korea, Republic of)

    2016-06-27

    Enhancement-mode multilayer molybdenum disulfide (MoS{sub 2}) field-effect transistors (FETs), which are an immensely important component toward low-power electronics based on a two-dimensional layered semiconductor, are demonstrated using the fluoropolymer CYTOP as a gate dielectric. The fabricated devices exhibit threshold voltage (V{sub TH}) of ∼5.7 V with field-effect mobility (μ{sub FE}) of up to 82.3 cm{sup 2}/V s, and the characteristics are compared with the depletion-mode characteristics of MoS{sub 2} FETs with the cross-linked Poly(4-vinylphenol) gate dielectric (V{sub TH} ∼ −7.8 V). UV photoelectron spectroscopy analysis indicates that increased surface potential due to the surface dipole effect of the fluorine group influences the positive V{sub TH} shift.

  13. Nonlinear oscillations of TM-mode gyrotrons

    Science.gov (United States)

    Chang, Tsun-Hsu; Yao, Hsin-Yu; Su, Bo-Yuan; Huang, Wei-Chen; Wei, Bo-Yuan

    2017-12-01

    This study investigates the interaction between the relativistic electrons and the waves in cavities with fixed field profiles. Both the transverse electric (TE) and the transverse magnetic (TM) cavity modes are examined, including three first-axial modes, TE011, TM011, and TM111, and two zero-axial modes, TM010 and TM110. The first-axial modes have the same resonant frequency, so a direct comparison can be made. By sweeping the electron pitch factor (α) and the electron transit angle (Θ), the optimal converting efficiency of TM modes occurs at α = 1.5 and Θ = 1.5π, unlike the TE mode of α = 2.0 and Θ = 1.0π. The converting efficiencies of both the first-axial TM modes are much lower than that of TE011 mode. The starting currents of TM011 and TM111 modes are four times higher than that of TE011 mode, indicating that these two TM modes are very difficult to oscillate. This evidences that under the traditional operating conditions, the TM-mode gyrotrons are insignificant. However, the two unique, zero-axial TM modes have relatively high converting efficiency. The highest converting efficiency of TM110 is 27.4%, the same value as that of TE011 mode. The starting currents of TM110 mode and TE011 mode are at the same level. The results suggest that some TM-mode gyrotron oscillators are feasible and deserve further theoretical and experimental studies.

  14. Dually-mode-locked ND: YAG laser

    Science.gov (United States)

    Osmundson, J.; Rowe, E.; Santarpia, D.

    1974-01-01

    Mode-locking is stabilized effectively by conventional loss-modulator and phase-modulator, mode-locking elements placed in laser cavity in optical series with one another. Resulting dually-mode-locked system provides pulses with constant phase relative to mode-lock drive signal without presence of relaxation oscillation noise.

  15. Rubble Mound Breakwater Failure Modes

    DEFF Research Database (Denmark)

    Burcharth, H. F.; Z., Liu

    1995-01-01

    The RMBFM-Project (Rubble Mound Breakwater Failure Modes) is sponsored by the Directorate General XII of the Commission of the European Communities under the Contract MAS-CT92- 0042, with the objective of contributing to the development of rational methods for the design of rubble mound breakwate...

  16. Mode structure of active resonators

    NARCIS (Netherlands)

    Ernst, G.J.; Witteman, W.J.

    1973-01-01

    An analysis is made of the mode structure of lasers when the interaction with the active medium is taken into account. We consider the combined effect of gain and refractive-index variations for arbitrary mirror configurations. Using a dimensionless round-trip matrix for a medium with a quadratic

  17. Single-mode optical fibres

    CERN Document Server

    Cancellieri, G

    1991-01-01

    This book describes signal propagation in single-mode optical fibres for telecommunication applications. Such description is based on the analysis of field propagation, considering waveguide properties and also some of the particular characteristics of the material fibre. The book covers such recent advances as, coherent transmissions; optical amplification; MIR fibres; polarization maintaining; polarization diversity and photon counting.

  18. Theory of Modes and Impulses

    Science.gov (United States)

    Apsche, Jack A.

    2005-01-01

    In his work on the Theory of Modes, Beck (1996) suggested that there were flaws with his cognitive theory. He suggested that though there are shortcomings to his cognitive theory, there were not similar shortcomings to the practice of Cognitive Therapy. The author suggests that if there are shortcomings to cognitive theory the same shortcomings…

  19. Photoionization-photoelectron research

    Energy Technology Data Exchange (ETDEWEB)

    Berkowitz, J.; Ruscic, B. [Argonne National Laboratory, IL (United States)

    1993-12-01

    The photoionization research program is aimed at understanding the basic processes of interaction of vacuum ultraviolet (VUV) light with atoms and molecules. This research provides valuable information on both thermochemistry and dynamics. Recent studies include atoms, clusters, hydrides, sulfides and an important fluoride.

  20. Two-mode Nonlinear Coherent States

    OpenAIRE

    Wang, Xiao-Guang

    2000-01-01

    Two-mode nonlinear coherent states are introduced in this paper. The pair coherent states and the two-mode Perelomov coherent states are special cases of the two-mode nonlinear coherent states. The exponential form of the two-mode nonlinear coherent states is given. The photon-added or photon-subtracted two-mode nonlinear coherent states are found to be two-mode nonlinear coherent states with different nonlinear functions. The parity coherent states are introduced as examples of two-mode nonl...

  1. Electronic structure and spectroscopy of nucleic acid bases: Ionization energies, ionization-induced structural changes, and photoelectron spectra

    Energy Technology Data Exchange (ETDEWEB)

    Bravaya, Ksenia B.; Kostko, Oleg; Dolgikh, Stanislav; Landau, Arie; Ahmed, Musahid; Krylov, Anna I.

    2010-08-02

    We report high-level ab initio calculations and single-photon ionization mass spectrometry study of ionization of adenine (A), thymine (T), cytosine (C) and guanine (G). For thymine and adenine, only the lowest-energy tautomers were considered, whereas for cytosine and guanine we characterized five lowest-energy tautomeric forms. The first adiabatic and several vertical ionization energies were computed using equation-of-motion coupled-cluster method for ionization potentials with single and double substitutions. Equilibrium structures of the cationic ground states were characterized by DFT with the {omega}B97X-D functional. The ionization-induced geometry changes of the bases are consistent with the shapes of the corresponding molecular orbitals. For the lowest-energy tautomers, the magnitude of the structural relaxation decreases in the following series G > C > A > T, the respective relaxation energies being 0.41, 0.32, 0.25 and 0.20 eV. The computed adiabatic ionization energies (8.13, 8.89, 8.51-8.67 and 7.75-7.87 eV for A,T,C and G, respectively) agree well with the onsets of the photoionization efficiency (PIE) curves (8.20 {+-} 0.05, 8.95 {+-} 0.05, 8.60 {+-} 0.05 and 7.75 {+-} 0.05 eV). Vibrational progressions for the S{sub 0}-D{sub 0} vibronic bands computed within double-harmonic approximation with Duschinsky rotations are compared with previously reported experimental photoelectron spectra.

  2. Band offset in zinc oxy-sulfide/cubic-tin sulfide interface from X-ray photoelectron spectroscopy

    Science.gov (United States)

    K. C., Sanal; Nair, P. K.; Nair, M. T. S.

    2017-02-01

    Zinc oxy-sulfide, ZnOxS1-x, has been found to provide better band alignment in thin film solar cells of tin sulfide of orthorhombic crystalline structure. Here we examine ZnOxS1-x/SnS-CUB interface, in which the ZnOxS1-x thin film was deposited by radio frequency (rf) magnetron sputtering on SnS thin film of cubic (CUB) crystalline structure with a band gap (Eg) of 1.72 eV, obtained via chemical deposition. X-ray photoelectron spectroscopy provides the valence band maxima of the materials and hence places the conduction band offset of 0.41 eV for SnS-CUB/ZnO0.27S0.73 and -0.28 eV for SnS-CUB/ZnO0.88S0.12 interfaces. Thin films of ZnOxS1-x with 175-240 nm in thickness were deposited from targets prepared with different ZnO to ZnS molar ratios. With the target of molar ratio of 1:13.4, the thin films are of composition ZnO0.27S0.73 with hexagonal crystalline structure and with that of 1:1.7 ratio, it is ZnO0.88S0.12. The optical band gap of the ZnOxS1-x thin films varies from 2.90 eV to 3.21 eV as the sulfur to zinc ratio in the film increases from 0.12:1 to 0.73:1 as determined from X-ray diffraction patterns. Thus, band offsets sought for absorber materials and zinc oxy-sulfide in solar cells may be achieved through a choice of ZnO:ZnS ratio in the sputtering target.

  3. Uniqueness plots: A simple graphical tool for identifying poor peak fits in X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Singh, Bhupinder; Diwan, Anubhav; Jain, Varun [Department of Chemistry and Biochemistry, Brigham Young University, Provo, UT, 84606 (United States); Herrera-Gomez, Alberto [CINVESTAV-Unidad Queretaro, Queretaro, 76230 (Mexico); Terry, Jeff [Department of Physics, Illinois Institute of Technology, Chicago, IL, 60616 (United States); Linford, Matthew R., E-mail: mrlinford@chem.byu.edu [Department of Chemistry and Biochemistry, Brigham Young University, Provo, UT, 84606 (United States)

    2016-11-30

    Highlights: • Uniqueness plots are introduced as a new tool for identifying poor XPS peak fits. • Uniqueness plots are demonstrated on real XPS data sets. • A horizontal line in a uniqueness plot indicates a poor fit, i.e., fit parameter correlation. • A parabolic shape in a uniqueness plot indicates that a fit may be appropriate. - Abstract: Peak fitting is an essential part of X-ray photoelectron spectroscopy (XPS) narrow scan analysis, and the Literature contains both good and bad examples of peak fitting. A common cause of poor peak fitting is the inclusion of too many fit parameters, often without a sound chemical and/or physical basis for them, and/or the failure to reasonably constrain them. Under these conditions, fit parameters are often correlated, and therefore lacking in statistical meaning. Here we introduce the uniqueness plot as a simple graphical tool for identifying bad peak fits in XPS, i.e., fit parameter correlation. These plots are widely used in spectroscopic ellipsometry. We illustrate uniqueness plots with two data sets: a C 1s narrow scan from ozone-treated carbon nanotube forests and an Si 2p narrow scan from an air-oxidized silicon wafer. For each fit, we consider different numbers of parameters and constraints on them. As expected, the uniqueness plots are parabolic when fewer fit parameters and/or more constraints are applied. However, they fan out and eventually become horizontal lines as more unconstrained parameters are included in the fits. Uniqueness plots are generated by plotting the chi squared (χ{sup 2}) value for a fit vs. a systematically varied value of a parameter in the fit. The Abbe criterion is also considered as a figure of merit for uniqueness plots in the Supporting Information. We recommend that uniqueness plots be used by XPS practitioners for identifying inappropriate peak fits.

  4. X-ray emission and photoelectron spectra of Pr0.5Sr0.5MnO3

    Science.gov (United States)

    Kurmaev, E. Z.; Korotin, M. A.; Galakhov, V. R.; Finkelstein, L. D.; Zabolotzky, E. I.; Efremova, N. N.; Lobachevskaya, N. I.; Stadler, S.; Ederer, D. L.; Callcott, T. A.; Zhou, L.; Moewes, A.; Bartkowski, S.; Neumann, M.; Matsuno, J.; Mizokawa, T.; Fujimori, A.; Mitchell, J.

    1999-05-01

    The results of measurements of x-ray photoelectron (XPS), x-ray emission (XES), and x-ray absorption spectra and local spin-density approximation band structure (LSDA) calculations of Pr0.5Sr0.5MnO3 are presented. The excitation energy dependence of Mn L2,3 and O Kα x-ray emission spectra of Pr0.5Sr0.5MnO3 is measured using tunable synchrotron radiation. The XES measurements yielded no photon energy dependence for the O Kα spectra, but the Mn L2,3 spectra yielded inelastic scattering losses of 2 and 6 eV, corresponding to features in the structure of the occupied part of the valence band. Comparing XPS and XES measurements with LSDA band-structure calculations, one concludes that the electronic structure of the compound consists mainly of Mn 3d and O 2p states. States of 3d character localized at the Mn site predominate near the top of the valence band (VB). Some differences in the Mn 3d distribution in this part of the XPS valence band and Mn L3 XES with d symmetry due to spin-selection rules that govern the Mn L3 XES. In addition, the Mn 3d states distribution is hybridized with the O 2p part of the VB. Mn L3 XES spectra were determined relative to the Fermi energy by assuming normal x-ray emission begins from the lowest level of the p5dn+1L intermediate state (which is the Mn 2p ionizatation threshold). From the local spin-density approximation, the orbital character of the Mn 3d electrons can be assigned eg symmetry at the top of the valence band T2g in the central part of the VB, and equal contributions of eg and t2g states at the bottom of the valence band.

  5. Angle resolved x-ray photoelectron spectroscopy (ARXPS) analysis of lanthanum oxide for micro-flexography printing

    Energy Technology Data Exchange (ETDEWEB)

    Hassan, S., E-mail: suhaimihas@uthm.edu.my; Yusof, M. S., E-mail: mdsalleh@uthm.edu.my; Maksud, M. I., E-mail: midris1973@gmail.com [Faculty of Mechanical and Manufacturing Engineering, Universiti Tun Hussein Onn Malaysia, 86400 Batu Pahat, Johor (Malaysia); Embong, Z., E-mail: zaidi@uthm.edu.my [Faculty of Science, Technology and Human Development, Universiti Tun Hussein Onn Malaysia, 86400 Batu Pahat, Johor (Malaysia)

    2016-01-22

    Micro-flexography printing was developed in patterning technique from micron to nano scale range to be used for graphic, electronic and bio-medical device on variable substrates. In this work, lanthanum oxide (La{sub 2}O{sub 3}) has been used as a rare earth metal candidate as depositing agent. This metal deposit was embedded on Carbon (C) and Silica (Si) wafer substrate using Magnetron Sputtering technique. The choose of Lanthanum as a target is due to its wide application in producing electronic devices such as thin film battery and printed circuit board. The La{sub 2}O{sub 3} deposited on the surface of Si wafer substrate was then analyzed using Angle Resolve X-Ray Photoelectron Spectroscopy (ARXPS). The position for each synthetic component in the narrow scan of Lanthanum (La) 3d and O 1s are referred to the electron binding energy (eV). The La 3d narrow scan revealed that the oxide species of this particular metal is mainly contributed by La{sub 2}O{sub 3} and La(OH){sub 3}. The information of oxygen species, O{sup 2-} component from O 1s narrow scan indicated that there are four types of species which are contributed from the bulk (O{sup 2−}), two chemisorb component (La{sub 2}O{sub 3}) and La(OH){sub 3} and physisorp component (OH). Here, it is proposed that from the adhesive and surface chemical properties of La, it is suitable as an alternative medium for micro-flexography printing technique in printing multiple fine solid lines at nano scale. Hence, this paper will describe the capability of this particular metal as rare earth metal for use in of micro-flexography printing practice. The review of other parameters contributing to print fine lines will also be described later.

  6. X-ray photoelectron spectroscopy study of pyrolytically coated graphite platforms submitted to simulated electrothermal atomic absorption spectrometry conditions

    Energy Technology Data Exchange (ETDEWEB)

    Ruiz, Frine [Laboratorio de Quimica Analitica, Centro de Quimica, Instituto Venezolano de Investigaciones Cientificas, IVIC, Apartado Postal 21827, Caracas 1020-A (Venezuela); Benzo, Zully [Laboratorio de Quimica Analitica, Centro de Quimica, Instituto Venezolano de Investigaciones Cientificas, IVIC, Apartado Postal 21827, Caracas 1020-A (Venezuela); Quintal, Manuelita [Laboratorio de Quimica Analitica, Centro de Quimica, Instituto Venezolano de Investigaciones Cientificas, IVIC, Apartado Postal 21827, Caracas 1020-A (Venezuela); Garaboto, Angel [Laboratorio de Quimica Analitica, Centro de Quimica, Instituto Venezolano de Investigaciones Cientificas, IVIC, Apartado Postal 21827, Caracas 1020-A (Venezuela); Albornoz, Alberto [Laboratorio de Fisicoquimica de Superficies, Centro de Quimica, Instituto Venezolano de Investigaciones Cientificas, IVIC, Apartado Postal 21827, Caracas 1020-A (Venezuela); Brito, Joaquin L. [Laboratorio de Fisicoquimica de Superficies, Centro de Quimica, Instituto Venezolano de Investigaciones Cientificas, IVIC, Apartado Postal 21827, Caracas 1020-A (Venezuela)]. E-mail: joabrito@ivic.ve

    2006-10-15

    The present work is part of an ongoing project aiming to a better understanding of the mechanisms of atomization on graphite furnace platforms used for electrothermal atomic absorption spectrometry (ETAAS). It reports the study of unused pyrolytic graphite coated platforms of commercial origin, as well as platforms thermally or thermo-chemically treated under simulated ETAAS analysis conditions. X-ray photoelectron spectroscopy (XPS) was employed to study the elements present at the surfaces of the platforms. New, unused platforms showed the presence of molybdenum, of unknown origin, in concentrations up to 1 at.%. Species in two different oxidations states (Mo{sup 6+} and Mo{sup 2+}) were detected by analyzing the Mo 3d spectral region with high resolution XPS. The analysis of the C 1s region demonstrated the presence of several signals, one of these at 283.3 eV related to the presence of Mo carbide. The O 1s region showed also various peaks, including a signal that can be attributed to the presence of MoO{sub 3}. Some carbon and oxygen signals were consistent with the presence of C=O and C-O- (probably C-OH) groups on the platforms surfaces. Upon thermal treatment up to 2900 deg. C, the intensity of the Mo signal decreased, but peaks due to Mo oxides (Mo{sup 6+} and Mo{sup 5+}) and carbide (Mo{sup 2+}) were still apparent. Thermo-chemical treatment with 3 vol.% HCl solutions and heating up to 2900 deg. C resulted in further diminution of the Mo signal, with complete disappearance of Mo carbide species. Depth profiling of unused platforms by Ar{sup +} ion etching at increasing time periods demonstrated that, upon removal of several layers of carbonaceous material, the Mo signal disappears suggesting that this contamination is present only at the surface of the pyrolytic graphite platform.

  7. Angle resolved x-ray photoelectron spectroscopy (ARXPS) analysis of lanthanum oxide for micro-flexography printing

    Science.gov (United States)

    Hassan, S.; Yusof, M. S.; Embong, Z.; Maksud, M. I.

    2016-01-01

    Micro-flexography printing was developed in patterning technique from micron to nano scale range to be used for graphic, electronic and bio-medical device on variable substrates. In this work, lanthanum oxide (La2O3) has been used as a rare earth metal candidate as depositing agent. This metal deposit was embedded on Carbon (C) and Silica (Si) wafer substrate using Magnetron Sputtering technique. The choose of Lanthanum as a target is due to its wide application in producing electronic devices such as thin film battery and printed circuit board. The La2O3 deposited on the surface of Si wafer substrate was then analyzed using Angle Resolve X-Ray Photoelectron Spectroscopy (ARXPS). The position for each synthetic component in the narrow scan of Lanthanum (La) 3d and O 1s are referred to the electron binding energy (eV). The La 3d narrow scan revealed that the oxide species of this particular metal is mainly contributed by La2O3 and La(OH)3. The information of oxygen species, O2- component from O 1s narrow scan indicated that there are four types of species which are contributed from the bulk (O2-), two chemisorb component (La2O3) and La(OH)3 and physisorp component (OH). Here, it is proposed that from the adhesive and surface chemical properties of La, it is suitable as an alternative medium for micro-flexography printing technique in printing multiple fine solid lines at nano scale. Hence, this paper will describe the capability of this particular metal as rare earth metal for use in of micro-flexography printing practice. The review of other parameters contributing to print fine lines will also be described later.

  8. X-ray photoelectron emission spectromicroscopic analysis of arborescent lycopsid cell wall composition and Carboniferous coal ball preservation

    Energy Technology Data Exchange (ETDEWEB)

    Boyce, C. Kevin [Department of the Geophysical Sciences, University of Chicago, Chicago, IL 60637 (United States); Abrecht, Mike; Zhou, Dong; Gilbert, P.U.P.A. [Department of Physics, University of Wisconsin, Madison, WI 53706 (United States)

    2010-08-01

    Two alternative processes complicate understanding of the biochemical origins and geochemical alteration of organic matter over geologic time: selective preservation of original biopolymers and in situ generation of new geopolymers. One of the best constrained potential sources of bio- and geochemical information about extinct fossil plants is frequently overlooked. Permineralized anatomically preserved plant fossils allow analysis of individual cell and tissue types that have an original biochemical composition already known from living plants. The original composition of more enigmatic fossils can be constrained by geochemical comparisons to tissues of better understood fossils from the same locality. This strategy is possible using synchrotron-based techniques for submicron-scale imaging with X-rays over a range of frequencies in order to provide information concerning the relative abundance of different organic bonds with X-ray Absorption Near Edge Spectroscopy. In this study, X-ray PhotoElectron Emission spectroMicroscopy (X-PEEM) was used to analyze the tissues of Lepidodendron, one of the lycopsid trees that were canopy dominants of many Pennsylvanian coal swamp forests. Its periderm or bark - the single greatest biomass contributor to many Late Paleozoic coals - is found to have a greater aliphatic content and an overall greater density of organic matter than lignified wood. Because X-PEEM allows simultaneous analysis of organic matter and matrix calcite in fully mineralized fossils, this technique also has great potential for analysis of fossil preservation, including documentation of significant traces of organic matter entrained in the calcite crystal fabric that fills the cell lumens. (author)

  9. High resolution, low hν photoelectron spectroscopy with the use of a microwave excited rare gas lamp and ionic crystal filters.

    Science.gov (United States)

    Suga, S; Sekiyama, A; Funabashi, G; Yamaguchi, J; Kimura, M; Tsujibayashi, M; Uyama, T; Sugiyama, H; Tomida, Y; Kuwahara, G; Kitayama, S; Fukushima, K; Kimura, K; Yokoi, T; Murakami, K; Fujiwara, H; Saitoh, Y; Plucinski, L; Schneider, C M

    2010-10-01

    The need for not only bulk sensitive but also extremely high resolution photoelectron spectroscopy for studying detailed electronic structures of strongly correlated electron systems is growing rapidly. Moreover, easy access to such a capability in one's own laboratory is desirable. Demonstrated here is the performance of a microwave excited rare gas (Xe, Kr, and Ar) lamp combined with ionic crystal filters (sapphire, CaF(2), and LiF), which can supply three strong lines near the photon energy of hnyu hν=8.4, 10.0, and 11.6 eV, with the hν resolution of better than 600 μeV for photoelectron spectroscopy. Its performance is demonstrated on some materials by means of both angle-integrated and angle-resolved measurements.

  10. Theoretical X-ray photoelectron and emission spectra of Si- and S-containing polymers by density-functional theory calculations using model molecules

    Science.gov (United States)

    Endo, K.; Shimada, S.; Ida, T.; Suhara, M.; Kurmaev, E. Z.; Moewes, A.; Chong, D. P.

    2001-04-01

    The X-ray photoelectron and emission spectra (XPS and XES) of Si- and S-containing polymers [(-Si{-CH 2-} 3) n (PCS), (-Si(CH 3)(OH)-O-) n (PMHSO), (-Si(C 6H 5)(OH)-O-) n (PTES), (-Si(C 6H 5)(OH)-O-Si(CH 3)(OH)-O-) n (PPMHSO), (-C 6H 4-O-C 6H 4-SO 2-) n (PES)] were simulated by the deMon density-functional theory (DFT) calculations using the model molecules. The theoretical valence photoelectron and C Kα X-ray emission spectra showed good accordance with some experimental ones. The combined analysis of the valence XPS and C and O Kα XES enables us to divide the observed valence electronic distribution into the individual contributions for pσ-, pπ- and non-bonding MOs of the polymers.

  11. Use of x-ray fluorescence microprobe and x-ray photoelectron spectroscopy to study variations in bulk and surface chemistry of minerals

    Energy Technology Data Exchange (ETDEWEB)

    Perry, D.L.; Schlueter, E.M. [Lawrence Berkeley National Lab., CA (United States)

    1996-12-31

    Two experimental approaches, synchrotron x-ray fluorescence microprobe and x-ray photoelectron spectroscopy, can be used to study the chemistry of minerals. The former technique yields data at the micron level of depth, whereas the latter approach gives data at the Angstrom level and thus more indicative of the surface conditions of the sample. The present work makes use of the difference in depths being sampled by the two techniques and using them in conjunction with lateral microscopic profiling to study bulk and surface chemistry in oxide and sulfide minerals. A complementary method, angle resolved x-ray photoelectron spectroscopy, is also discussed with respect to both the bulk chemistry and multiple layer films that can occur as reactions products on the surfaces of minerals.

  12. Surface characterization of colossal magnetoresistive manganites La{sub 1-x}Sr {sub x}MnO{sub 3} using photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Mannella, N. [Department of Physics, UC Davis, Davis, CA 95616 (United States) and Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States)]. E-mail: NMannella@lbl.gov; Rosenhahn, A. [Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States); Nambu, A. [Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States); Department of Chemistry, University of Tokyo, Tokyo 113-0033 (Japan); Sell, B.C. [Department of Physics, UC Davis, Davis, CA 95616 (United States); Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States); Mun, B.S. [Department of Physics, UC Davis, Davis, CA 95616 (United States); Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States); Yang, S.-H. [Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States); Marchesini, S. [Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States); Watanabe, M. [Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States); RIKEN, HYOGO 679-5148 (Japan); Ibrahim, K. [Beijing Synchrotron Radiation Laboratory, Beijing (China); Ritchey, S.B. [Department of Physics, UC Davis, Davis, CA 95616 (United States); Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States); Tomioka, Y. [National Institute for Advanced Industrial Science and Technolog (AIST), Tsukuba Central 4, Tsukuba 305-8562 (Japan); Fadley, C.S. [Department of Physics, UC Davis, Davis, CA 95616 (United States); Materials Sciences Division, LBNL, Berkeley, CA 94720 (United States)

    2006-08-15

    We have studied the temperature and time dependence of Surface chemical composition and atomic structure of in situ fractured colossal magnetoresistive perovskites La{sub 1-x}Sr {sub x}MnO (x = 0.3, 0.4) using core-level photoelectron spectroscopy and diffraction, simultaneous with observing marked changes in both core and valence electronic structure on going above the Curie temperature [N. Mannella et al., Phys. Rev. Lett. 92 (2004) 166401]. Stoichiometric analyses via core-level intensity ratios show that the near-surface composition is very nearly the same as that of the nominal (bulk) stoichiometry and further show that, during duration of our experiments, the degree of surface stoichiometry alteration or contamination has been minimal. The effects of photoelectron diffraction on such analyses are also explored. We comment on the degree to which near-surface composition or atomic-structure alterations might influence spectroscopic investigations of these manganites, or other strongly correlated materials.

  13. An in situ x-ray photoelectron spectroscopy study of the initial stages of rf magnetron sputter deposition of indium tin oxide on p-type Si substrate

    Energy Technology Data Exchange (ETDEWEB)

    Rein, M. H.; Holt, A. O. [Institute for Energy Technology, Department of Solar Energy, Instituttveien 18, 2008 Kjeller (Norway); Hohmann, M. V.; Klein, A. [Technische Universitaet Darmstadt, Institute of Materials Science, Surface Science Division, Petersenstrasse 32, D-64287 Darmstadt (Germany); Thogersen, A. [SINTEF-Materials and Chemistry Syntesis and Properties, Forskningsveien 1, Pb. 124 Blindern, 0314 Oslo (Norway); Mayandi, J. [Department of Materials Science, School of Chemistry, Madurai Kamaraj University, Tamil Nadu, Madurai (India); Monakhov, E. V. [Institute for Energy Technology, Department of Solar Energy, Instituttveien 18, 2008 Kjeller (Norway); Department of Physics/Centre for Materials Science and Nanotechnology, University of Oslo, 0316 Oslo (Norway)

    2013-01-14

    The interface between indium tin oxide and p-type silicon is studied by in situ X-ray photoelectron spectroscopy (XPS). This is done by performing XPS without breaking vacuum after deposition of ultrathin layers in sequences. Elemental tin and indium are shown to be present at the interface, both after 2 and 10 s of deposition. In addition, the silicon oxide layer at the interface is shown to be composed of mainly silicon suboxides rather than silicon dioxide.

  14. Correlations Between Variations in Solar EUV and Soft X-Ray Irradiance and Photoelectron Energy Spectra Observed on Mars and Earth

    Science.gov (United States)

    Peterson, W. K.; Brain, D. A.; Mitchell, D. L.; Bailey, S. M.; Chamberlin, P. C.

    2013-01-01

    Solar extreme ultraviolet (EUV; 10-120 nm) and soft X-ray (XUV; 0-10 nm) radiation are major heat sources for the Mars thermosphere as well as the primary source of ionization that creates the ionosphere. In investigations of Mars thermospheric chemistry and dynamics, solar irradiance models are used to account for variations in this radiation. Because of limited proxies, irradiance models do a poor job of tracking the significant variations in irradiance intensity in the EUV and XUV ranges over solar rotation time scales when the Mars-Sun-Earth angle is large. Recent results from Earth observations show that variations in photoelectron energy spectra are useful monitors of EUV and XUV irradiance variability. Here we investigate photoelectron energy spectra observed by the Mars Global Surveyor (MGS) Electron Reflectometer (ER) and the FAST satellite during the interval in 2005 when Earth, Mars, and the Sun were aligned. The Earth photoelectron data in selected bands correlate well with calculations based on 1 nm resolution observations above 27 nm supplemented by broadband observations and a solar model in the 0-27 nm range. At Mars, we find that instrumental and orbital limitations to the identifications of photoelectron energy spectra in MGS/ER data preclude their use as a monitor of solar EUV and XUV variability. However, observations with higher temporal and energy resolution obtained at lower altitudes on Mars might allow the separation of the solar wind and ionospheric components of electron energy spectra so that they could be used as reliable monitors of variations in solar EUV and XUV irradiance than the time shifted, Earth-based, F(10.7) index currently used.

  15. Wake-field and space charge effects on high brightness beams calculations and measured results for the laser driven photoelectrons at BNL-ATF

    Energy Technology Data Exchange (ETDEWEB)

    Parsa, Z.

    1993-05-01

    We discuss the formalism used to study the effects of the interactions between the highly charged particles and the fields in the accelerating structure, including space charge and wake fields. Some of our calculations and numerical simulation results obtained for the Brookhaven National Laboratory (BNL) high-brightness photoelectron beam at the Accelerator Test Facility (ATF) and the measured data at ATF are also included.

  16. Suppression of high order modes employing active self-imaging mode filter in large mode area strongly pumped fiber amplifier

    Science.gov (United States)

    Zhao, Xiang; Bai, Gang; Zheng, Ye; Chen, Xiaolong; Yang, Yifeng; Qi, Yunfeng; He, Bing; Zhou, Jun

    2017-10-01

    To suppress high order modes and improve the beam quality, an active self-imaging mode filter based on multimode interference and self-imaging effect is proposed in large mode area (LMA) fiber amplifier. With this filter structure, transverse mode competition and individual transverse mode power distributions in strongly pumped fiber amplifiers are theoretically demonstrated. Employing this mode selection technique in 30/400 LMA strongly pumped fiber amplifier, the percentage of the fundamental mode rises from 27.8% (without filter) to 96.3%. By the modal power decomposition, the M2 parameter of beam quality decrease dramatically from 2.24 to 1.11 (0 relative phase) and from 3.01 to 1.24 (π/2 relative phase). This study provides a new method to achieve single mode in LMA fiber amplifier and this filter would be extended to larger mode area fiber amplifier to improve the beam quality.

  17. Scaling Fiber Lasers to Large Mode Area: An Investigation of Passive Mode-Locking Using a Multi-Mode Fiber

    Science.gov (United States)

    Ding, Edwin; Lefrancois, Simon; Kutz, Jose Nathan; Wise, Frank W.

    2011-01-01

    The mode-locking of dissipative soliton fiber lasers using large mode area fiber supporting multiple transverse modes is studied experimentally and theoretically. The averaged mode-locking dynamics in a multi-mode fiber are studied using a distributed model. The co-propagation of multiple transverse modes is governed by a system of coupled Ginzburg–Landau equations. Simulations show that stable and robust mode-locked pulses can be produced. However, the mode-locking can be destabilized by excessive higher-order mode content. Experiments using large core step-index fiber, photonic crystal fiber, and chirally-coupled core fiber show that mode-locking can be significantly disturbed in the presence of higher-order modes, resulting in lower maximum single-pulse energies. In practice, spatial mode content must be carefully controlled to achieve full pulse energy scaling. This paper demonstrates that mode-locking performance is very sensitive to the presence of multiple waveguide modes when compared to systems such as amplifiers and continuous-wave lasers. PMID:21731106

  18. A Monte Carlo study of backscattering effects in the photoelectron emission from CsI into CH$_{4}$ and Ar-CH$_{4}$ mixtures

    CERN Document Server

    Escada, J; Rachinhas, P J B M; Lopes, J A M; Santos, F P; Távora, L M N; Conde, C A N; Stauffer, A D

    2007-01-01

    Monte Carlo simulation is used to investigate photoelectron backscattering effects in the emission from a CsI photocathode into CH4 and Ar-CH4 mixtures for incident monochromatic photons with energies Eph in the range 6.8 eV to 9.8 eV (182 nm to 127 nm), and photons from a continuous VUV Hg(Ar) lamp with a spectral distribution peaked at Eph = 6.7 eV (185 nm), considering reduced applied electric fields E/N in the 0.1 Td to 40 Td range. The addition of CH4 to a noble gas efficiently increases electron transmission and drift velocity, due to vibrational excitation of the molecules at low electron energies. Results are presented for the photoelectron transmission efficiencies f, where f is the fraction of the number of photoelectrons emitted from CsI which are transmitted through the gas as compared to vacuum. The dependence of f on Eph, E/N, and mixture composition is analyzed and explained in terms of electron scattering in the different gas media, and results are compared with available measurements. Electro...

  19. Application of high-resolution photoelectron spectroscopy: Vibrational resolved C 1s and O 1s spectra of CO adsorbed on Ni(100)

    Energy Technology Data Exchange (ETDEWEB)

    Foehlisch, A.; Nilsson, A.; Martensson, N. [Uppsala Univ. (Sweden)] [and others

    1997-04-01

    There are various effects which determine the line shape of a core-level electron spectrum. These are due to the finite life-time of the core hole, inelastic scattering of the outgoing photoelectron, electronic shake-up and shake-off processes and vibrational excitations. For free atoms and molecules the different contributions to the observed line shapes can often be well separated. For solids, surfaces and adsorbates the line shapes are in general much broader and it has in the past been assumed that no separation of the various contributions can be made. In the present report the authors will show that this is indeed not the case. Surprisingly, the vibrational fine structure of CO adsorbed on Ni(100) can be resolved in the C 1s and O 1s electron spectra. This was achieved by the combination of highly monochromatized soft X-rays from B18.0 with a high resolution Scienta 200 mm photoelectron spectrometer. X-ray photoelectron spectroscopy (XPS) with tunable excitation energy yields as a core level spectroscopy atomic and site-specific information. The presented measurements allow for a determination of internuclear distances and potential energy curves in corehole ionized adsorbed molecules. The authors analysis of the c(2x2) phase CO/Ni(100) on {open_quotes}top{close_quotes} yielded a vibrational splitting of 217 +/- 2 meV for C 1s ionization. For O 1s ionization a splitting of 173 +/- 8 meV was found.

  20. All-fiber 6-mode multiplexers based on fiber mode selective couplers.

    Science.gov (United States)

    Chang, Sun Hyok; Moon, Sang-Rok; Chen, Haoshuo; Ryf, Roland; Fontaine, Nicolas K; Park, Kyung Jun; Kim, Kwangjoon; Lee, Joon Ki

    2017-03-06

    All-fiber 6-mode multiplexer composed of two consecutive LP11-mode selective couplers (MSC), two LP21-MSCs and an LP02-MSC is fully characterized by wavelength-swept interferometer technique. The MSCs are fabricated by polished-type fiber couplers coupling LP01 mode of a single mode fiber into a higher-order mode of a few mode fiber. A pair of the mode multiplexers has minimum mode dependent loss of 4 dB and high mode group selectivity of over 15 dB. Mode division multiplexed transmission enabled by the all-fiber mode multiplexers is demonstrated over fiber spans of 117 km employing an in-line multi-mode optical amplifier. 6 modes of 120 Gb/s dual polarization quadrature phase shift keying signals combined with 30 wavelength channels are successfully transmitted.

  1. Modes of an endlessly single-mode photonic crystal fiber: a finite element investigation

    NARCIS (Netherlands)

    Uranus, H.P.; Hoekstra, Hugo; van Groesen, Embrecht W.C.

    2004-01-01

    Using a finite-element mode solver, the modes of a commercial endlessly single-mode photonic crystal fiber (ESM-PCF) were investigated. Based on the loss discrimination between the dominant and the nearest higher order mode, we set-up a criterion for the single-modeness. Using that measure, we

  2. Vainshtein solutions without superluminal modes

    Science.gov (United States)

    Gabadadze, Gregory; Kimura, Rampei; Pirtskhalava, David

    2015-06-01

    The Vainshtein mechanism suppresses the fifth force at astrophysical distances, while enabling it to compete with gravity at cosmological scales. Typically, Vainshtein solutions exhibit superluminal perturbations. However, a restricted class of solutions with special boundary conditions was shown to be devoid of the faster-than-light modes. Here we extend this class by finding solutions in a theory of quasidilaton, amended by derivative terms consistent with its symmetries. Solutions with Minkowski asymptotics are not stable, while the ones that exhibit the Vainshtein mechanism by transitioning to cosmological backgrounds are free of ghosts, tachyons, gradient instability, and superluminality, for all propagating modes present in the theory. These solutions require a special choice of the strength and signs of nonlinear terms, as well as a choice of asymptotic cosmological boundary conditions.

  3. Hypersonic modes in nanophononic semiconductors.

    Science.gov (United States)

    Hepplestone, S P; Srivastava, G P

    2008-09-05

    Frequency gaps and negative group velocities of hypersonic phonon modes in periodically arranged composite semiconductors are presented. Trends and criteria for phononic gaps are discussed using a variety of atomic-level theoretical approaches. From our calculations, the possibility of achieving semiconductor-based one-dimensional phononic structures is established. We present results of the location and size of gaps, as well as negative group velocities of phonon modes in such structures. In addition to reproducing the results of recent measurements of the locations of the band gaps in the nanosized Si/Si{0.4}Ge{0.6} superlattice, we show that such a system is a true one-dimensional hypersonic phononic crystal.

  4. Evaluation of Advanced Bionics high resolution mode.

    Science.gov (United States)

    Buechner, Andreas; Frohne-Buechner, Carolin; Gaertner, Lutz; Lesinski-Schiedat, Anke; Battmer, Rolf-Dieter; Lenarz, Thomas

    2006-07-01

    The objective of this paper is to evaluate the advantages of the Advanced Bionic high resolution mode for speech perception, through a retrospective analysis. Forty-five adult subjects were selected who had a minimum experience of three months' standard mode (mean of 10 months) before switching to high resolution mode. Speech perception was tested in standard mode immediately before fitting with high resolution mode, and again after a maximum of six months high resolution mode usage (mean of two months). A significant improvement was found, between 11 and 17%, depending on the test material. The standard mode preference does not give any indication about the improvement when switching to high resolution. Users who are converted within any study achieve a higher performance improvement than those converted in the clinical routine. This analysis proves the significant benefits of high resolution mode for users, and also indicates the need for guidelines for individual optimization of parameter settings in a high resolution mode program.

  5. Dual Mode Slotted Monopole Antenna

    Science.gov (United States)

    2017-01-05

    of 15 DUAL MODE SLOTTED MONOPOLE ANTENNA STATEMENT OF GOVERNMENT INTEREST [0001] The invention described herein may be manufactured and used by...REFERENCE TO OTHER PATENT APPLICATIONS [0002] None. BACKGROUND OF THE INVENTION (1) Field of the Invention [0003] The present invention is directed...such as this that is capable of radiating at a different frequency below this cutoff. The present invention provides a means by which the overall

  6. Substructuring and Component Mode Synthesis

    Directory of Open Access Journals (Sweden)

    P. Seshu

    1997-01-01

    Full Text Available Substructuring and component mode synthesis (CMS, is a very popular method of model reduction for large structural dynamics problems. Starting from the pioneering works on this technique in the early 1960s, many researchers have studied and used this technique in a variety of applications. Besides model reduction, CMS offers several other crucial advantages. The present work aims to provide a review of the available literature on this important technique.

  7. Quantitative modelling of the electrostatic sheath around a photo-electron emitting spacecraft and of the possible influence on magnetospheric plasma instruments

    Science.gov (United States)

    Hilgers, A.; Thiebault, B.; Forest, J.; Escoubet, P.; Fehringer, M.; Laakso, H.

    2003-04-01

    It is well known that photo-electrons emitted from sunlit surfaces in space may affect plasma measurements by several processes, e.g., via the resulting (i) surface potential, (ii) space charge effects, or/and (iii) direct propagation to detectors [e.g. Szita et al., 2001; Pedersen et al., 1984]. We have used a fully kinetic particle-in-cell code, PicUp3D [Forest et al., 2001] which is now made available in public domain, for modelling in three dimensions the electrostatic sheath and photo-electron cloud around a conductive volume representative of a spacecraft like Cluster in a typical magnetospheric plasma environment. The model shows several features of key interest for the interpretation of the measurements and for optimizing the design of future instruments. It is found that photo-electrons fill a large volume around the spacecraft where they can dominate over the ambient environment and a significant part of photo-electrons propagates to the antisunward sector. The resulting space charge has been found to generate negative potential barriers under certain conditions. Also long wire booms which are generally used for mounting electrostatic sensors away from the influence of the spacecraft are found to induce significant transport of the spacecraft generated photo-electrons toward the boom mounted detectors. In this presentation the feature of the computer code and the results of the numerical model are reviewed and the implications for plasma instruments are discussed. Forest J., L. Eliasson, A. Hilgers, A New Spacecraft Plasma Simulation Software, PicUp3D/SPIS, ESA Special Publication, SP-476, ISBN No 92-9092-745-3, pp.515-520, ESA-ESTEC, Noordwijk, The Netherlands, 2001. Pedersen, A., C. A. Cattel, C.-G. Faelthammar, V. Formisano, P.-A. Lindqvist, F. Mozer, and R. Torbert, Quasistatic electric field measurements with spherical double probes on the GEOS and ISEE satellites, Space Sci. Rev., 37, pp 269-312, 1984. Szita, S., A. N. Fazakerley, P. J. Carter, A. M

  8. Mode pumping experiments on biomolecules

    Energy Technology Data Exchange (ETDEWEB)

    Austin, R.H.; Erramilli, S. [Princeton Univ., NJ (United States); Xie, A.; Schramm, A.

    1995-12-31

    We will explore several aspects of protein dynamics and energy transfer that can be explored by using the intense, picosecond, tunable mid-IR output of the FEL. In order of appearance they are: (1) Saturation recovery and inter-level coupling of the low temperature amide-I band in acetanilide. This is a continuation of earlier experiments to test soliton models in crystalline hydrogen bonded solids. In this experiment we utilize the sub-picosecond time resolution and low repetition rate of the Stanford SCLA FEL to do both T{sub 1} and T{sub 2} relaxation measurements at 1650 cm{sup -1}. (2) Probing the influence of collective dynamics in sensory rhodopsin. In this experiment we use the FIR output of the Stanford FIREFLY FEL to determine the lifetime of collective modes in the photo-active protein sensory rhodopsin, and begin experiments on the influence of collective modes on retinal reaction dynamics. (3) Probing the transition states of enzymes. This experiment, in the initial stages, attempts to use the intense IR output of the FEL to probe and influence the reaction path of a transition state analog for the protein nucleoside hydrolase. The transition state of the inosine substrate is believed to have critical modes softened by the protein so that bond-breaking paths show absorption at approximately 800 cm{sup -1}. A form of action spectrum using FEL excitation will be used to probe this state.

  9. A History of Emerging Modes?

    Directory of Open Access Journals (Sweden)

    Schmitz Michael

    2016-03-01

    Full Text Available In this paper I first introduce Tomasello’s notion of thought and his account of its emergence and development through differentiation, arguing that it calls into question the theory bias of the philosophical tradition on thought as well as its frequent atomism. I then raise some worries that he may be overextending the concept of thought, arguing that we should recognize an area of intentionality intermediate between action and perception on the one hand and thought on the other. After that I argue that the co-operative nature of humans is reflected in the very structure of their intentionality and thought: in co-operative modes such as the mode of joint attention and action and the we-mode, they experience and represent others as co-subjects of joint relations to situations in the world rather than as mere objects. In conclusion, I briefly comment on what Tomasello refers to as one of two big open questions in the theory of collective intentionality, namely that of the irreducibility of jointness.

  10. Protected Edge Modes without Symmetry

    Directory of Open Access Journals (Sweden)

    Michael Levin

    2013-05-01

    Full Text Available We discuss the question of when a gapped two-dimensional electron system without any symmetry has a protected gapless edge mode. While it is well known that systems with a nonzero thermal Hall conductance, K_{H}≠0, support such modes, here we show that robust modes can also occur when K_{H}=0—if the system has quasiparticles with fractional statistics. We show that some types of fractional statistics are compatible with a gapped edge, while others are fundamentally incompatible. More generally, we give a criterion for when an electron system with Abelian statistics and K_{H}=0 can support a gapped edge: We show that a gapped edge is possible if and only if there exists a subset of quasiparticle types M such that (1 all the quasiparticles in M have trivial mutual statistics, and (2 every quasiparticle that is not in M has nontrivial mutual statistics with at least one quasiparticle in M. We derive this criterion using three different approaches: a microscopic analysis of the edge, a general argument based on braiding statistics, and finally a conformal field theory approach that uses constraints from modular invariance. We also discuss the analogous result for two-dimensional boson systems.

  11. Signal restoration method for restraining the range walk error of Geiger-mode avalanche photodiode lidar in acquiring a merged three-dimensional image.

    Science.gov (United States)

    Xu, Lu; Zhang, Yu; Zhang, Yong; Wu, Long; Yang, Chenghua; Yang, Xu; Zhang, Zijing; Zhao, Yuan

    2017-04-10

    The fluctuation in the number of signal photoelectrons will cause a range walk error in a Geiger-mode avalanche photodiode (Gm-APD) lidar, which significantly depends on the target intensity. For a nanosecond-pulsed laser, the range walk error of traditional time-of-flight will cause deterioration. A new signal restoration method, based on the Poisson probability response model and the center-of-mass algorithm, is proposed to restrain the range walk error. We obtain a high-precision depth and intensity merged 3D image using this method. The range accuracy is 0.6 cm, and the intensity error is less than 3%.

  12. Mixed-Mode-Bending Delamination Apparatus

    Science.gov (United States)

    Crews, John H., Jr.; Reeder, James R.

    1991-01-01

    Mixed-mode-bending delamination apparatus generates two types of delamination stress simultaneously in specimen from single externally applied point load. In technique, indivial mode I and mode II contributions to delamination in specimen analyzed by use of simple beam-theory equations, eliminating need for time-consuming, difficult numerical analysis. Allows wider range of mode I/mode II ratios than possible with many other methods. Mixed-mode delamination testing of interest in all fields utilizing composite materials, used mostly in aerospace field, but also used in automobiles, lightweight armored military vehicles, boats, and sporting equipment. Useful in general lumber, plywood, and adhesive industries, as well.

  13. Digital holograms for laser mode multiplexing

    CSIR Research Space (South Africa)

    Mhlanga, T

    2014-10-02

    Full Text Available the sensitivity of the setup to misalignment, that leads to mode-coupling. It is also important that the injected modes ha a uniform power spectrum so that are weighted equally. The size of the multi-modes is highly dependent on the resolution of the SLM. Keywords...: spatial modes, multiplex, mode coupling 1. INTRODUCTION Optical networks form a foundation of modern communications networks since the replacement of copper wires with optical fibres in the 1980’s. This fibre technology has been based on single mode fibres...

  14. Predicting the Diversity of Foreign Entry Modes

    DEFF Research Database (Denmark)

    Hashai, Niron; Geisler Asmussen, Christian; Benito, Gabriel

    2007-01-01

    This paper expands entry mode literature by referring to multiple modes exerted in different value chain activities within and across host markets, rather than to a single entry mode at the host market level. Scale of operations and knowledge intensity are argued to affect firms' entry mode...... diversity across value chain activities and host markets. Analyzing a sample of Israeli based firms we show that larger firms exhibit a higher degree of entry mode diversity both across value chain activities and across host markets. Higher levels of knowledge intensity are also associated with more...... diversity in firms' entry modes across both dimensions....

  15. Mixed-Mode Crack Growth in Wood

    Directory of Open Access Journals (Sweden)

    Octavian POP

    2012-09-01

    Full Text Available In timber elements the mixed mode dependsessentially of wood anatomy and load configuration.In these conditions, in order to evaluate the materialbehavior and the fracture process, it’s necessary toseparate the part of each mode. The mixed modeseparation allows evaluating the amplitude offracture mode. In the present paper, using a mixedmodecrack growth specimen made in Douglas fir,the mixed mode crack growth process is studythanks to marks tracking method. Using the markstracking method the characteristic displacementsassociated to opening and shear mode aremeasured. From the experimental measurements,the energy release rate associated to opening andshear modes is calculated into to account the crackadvancement during the test.

  16. Chalcopyrite dissolution: Scanning photoelectron microscopy examination of the evolution of sulfur species with and without added iron or pyrite

    Science.gov (United States)

    Li, Yubiao; Qian, Gujie; Brown, Paul L.; Gerson, Andrea R.

    2017-09-01

    Dissolution and oxidation of sulfide minerals play key roles in both acid and metalliferous rock drainage and supergene enrichment. Surface speciation heterogeneity, critical to understanding mechanisms of mineral sulfide dissolution, has to date largely not been considered. To this end synchrotron scanning photoelectron microscopy (SPEM) was employed to examine freshly fractured and partially dissolved chalcopyrite (CuFeS2) surfaces (pH 1.0 HClO4 solution, redox potential 650 mV relative to a standard hydrogen electrode, 75 °C). S2- (bulk), S22- and Sn2- were found to be present on all samples at varying concentrations. Oxidation was observed to take place heterogeneously at the sub-micron scale. As compared to chalcopyrite partially dissolved for 5 days, extended dissolution to 10 days did not show appreciably enhanced oxidation of surface species; however surface roughness increased markedly due to the growth/overlap of oxidised sulfur species. On addition of 4 mM iron both S0 and SO42- were observed but not SO32-, indicating that the greater Fe3+ activity/concentration promotes heterogeneous sulfur oxidation. On contact of pyrite (FeS2) with chalcopyrite, significantly greater chalcopyrite surface oxidation was observed than for the other systems examined, with S0, SO32- and SO42- being identified heterogeneously across the surface. It is proposed that chalcopyrite oxidative dissolution is enhanced by increasing its cathodic area, e.g. contacting with pyrite, while increased Fe3+ activity/concentration also contributes to increased dissolution rates. The high degree of surface heterogeneity of these surface products indicates that these surfaces are not passivated by their formation. These results suggest that chalcopyrite dissolution will be accelerated when in contact with pyrite at solution redox potential intermediate between the rest potentials of chalcopyrite and pyrite (560 mV and 660 mV, respectively) and/or iron rich acidic waters with resulting

  17. Dissociation of internal energy-selected methyl bromide ion revealed from threshold photoelectron-photoion coincidence velocity imaging

    Energy Technology Data Exchange (ETDEWEB)

    Tang, Xiaofeng [Hefei National Laboratory for Physical Sciences at the Microscale and Department of Chemical Physics, University of Science and Technology of China, Hefei 230026 (China); National Synchrotron Radiation Laboratory, University of Science and Technology of China, Hefei 230029 (China); Zhou, Xiaoguo, E-mail: xzhou@ustc.edu.cn, E-mail: yanbing@jlu.edu.cn; Liu, Shilin [Hefei National Laboratory for Physical Sciences at the Microscale and Department of Chemical Physics, University of Science and Technology of China, Hefei 230026 (China); Synergetic Innovation Center of Quantum Information and Quantum Physics, University of Science and Technology of China, Hefei, Anhui 230026 (China); Sun, Zhongfa [Hefei National Laboratory for Physical Sciences at the Microscale and Department of Chemical Physics, University of Science and Technology of China, Hefei 230026 (China); Liu, Fuyi; Sheng, Liusi [National Synchrotron Radiation Laboratory, University of Science and Technology of China, Hefei 230029 (China); Yan, Bing, E-mail: xzhou@ustc.edu.cn, E-mail: yanbing@jlu.edu.cn [Institute of Atomic and Molecular Physics, Jilin University, Changchun 130012 (China)

    2014-01-28

    Dissociative photoionization of methyl bromide (CH{sub 3}Br) in an excitation energy range of 10.45–16.90 eV has been investigated by using threshold photoelectron-photoion coincidence (TPEPICO) velocity imaging. The coincident time-of-flight mass spectra indicate that the ground state X{sup 2}E of CH{sub 3}Br{sup +} is stable, and both A{sup 2}A{sub 1} and B{sup 2}E ionic excited states are fully dissociative to produce the unique fragment ion of CH{sub 3}{sup +}. From TPEPICO 3D time-sliced velocity images of CH{sub 3}{sup +} dissociated from specific state-selected CH{sub 3}Br{sup +} ion, kinetic energy release distribution (KERD) and angular distribution of CH{sub 3}{sup +} fragment ion are directly obtained. Both spin-orbit states of Br({sup 2}P) atom can be clearly observed in fast dissociation of CH{sub 3}Br{sup +}(A{sup 2}A{sub 1}) ion along C–Br rupture, while a KERD of Maxwell-Boltzmann profile is obtained in dissociation of CH{sub 3}Br{sup +}(B{sup 2}E) ion. With the aid of the re-calculated potential energy curves of CH{sub 3}Br{sup +} including spin-orbit coupling, dissociation mechanisms of CH{sub 3}Br{sup +} ion in A{sup 2}A{sub 1} and B{sup 2}E states along C–Br rupture are revealed. For CH{sub 3}Br{sup +}(A{sup 2}A{sub 1}) ion, the CH{sub 3}{sup +} + Br({sup 2}P{sub 1/2}) channel is occurred via an adiabatic dissociation by vibration, while the Br({sup 2}P{sub 3/2}) formation is through vibronic coupling to the high vibrational level of X{sup 2}E state followed by rapid dissociation. C–Br bond breaking of CH{sub 3}Br{sup +}(B{sup 2}E) ion can occur via slow internal conversion to the excited vibrational level of the lower electronic states and then dissociation.

  18. CO2-selective methanol steam reforming on In-doped Pd studied by in situ X-ray photoelectron spectroscopy

    Science.gov (United States)

    Rameshan, Christoph; Lorenz, Harald; Mayr, Lukas; Penner, Simon; Zemlyanov, Dmitry; Arrigo, Rosa; Haevecker, Michael; Blume, Raoul; Knop-Gericke, Axel; Schlögl, Robert; Klötzer, Bernhard

    2012-01-01

    In situ X-ray photoelectron spectroscopy (in situ XPS) was used to study the structural and catalytic properties of Pd–In near-surface intermetallic phases in correlation with previously studied PdZn and PdGa. Room temperature deposition of ∼4 monolayer equivalents (MLEs) of In metal on Pd foil and subsequent annealing to 453 K in vacuum yields a ∼1:1 Pd/In near-surface multilayer intermetallic phase. This Pd1In1 phase exhibits a similar “Cu-like” electronic structure and indium depth distribution as its methanol steam reforming (MSR)-selective multilayer Pd1Zn1 counterpart. Catalytic characterization of the multilayer Pd1In1 phase in MSR yielded a CO2-selectivity of almost 100% between 493 and 550 K. In contrast to previously studied In2O3-supported PdIn nanoparticles and pure In2O3, intermediate formaldehyde is only partially converted to CO2 using this Pd1In1 phase. Strongly correlated with PdZn, on an In-diluted PdIn intermetallic phase with “Pd-like” electronic structure, prepared by thermal annealing at 623 K, methanol steam reforming is suppressed and enhanced CO formation via full methanol dehydrogenation is observed. To achieve CO2-TOF values on the isolated Pd1In1 intermetallic phase as high as on supported PdIn/In2O3, at least 593 K reaction temperature is required. A bimetal-oxide synergism, with both bimetallic and oxide synergistically contributing to the observed catalytic activity and selectivity, manifests itself by accelerated formaldehyde-to-CO2 conversion at markedly lowered temperatures as compared to separate oxide and bimetal. Combination of suppression of full methanol dehydrogenation to CO on Pd1In1 inhibited inverse water–gas-shift reaction on In2O3 and fast water activation/conversion of formaldehyde is the key to the low-temperature activity and high CO2-selectivity of the supported catalyst. PMID:23226689

  19. CO(2)-selective methanol steam reforming on In-doped Pd studied by in situ X-ray photoelectron spectroscopy.

    Science.gov (United States)

    Rameshan, Christoph; Lorenz, Harald; Mayr, Lukas; Penner, Simon; Zemlyanov, Dmitry; Arrigo, Rosa; Haevecker, Michael; Blume, Raoul; Knop-Gericke, Axel; Schlögl, Robert; Klötzer, Bernhard

    2012-11-01

    In situ X-ray photoelectron spectroscopy (in situ XPS) was used to study the structural and catalytic properties of Pd-In near-surface intermetallic phases in correlation with previously studied PdZn and PdGa.Room temperature deposition of ∼4 monolayer equivalents (MLEs) of In metal on Pd foil and subsequent annealing to 453 K in vacuum yields a ∼1:1 Pd/In near-surface multilayer intermetallic phase. This Pd(1)In(1) phase exhibits a similar "Cu-like" electronic structure and indium depth distribution as its methanol steam reforming (MSR)-selective multilayer Pd(1)Zn(1) counterpart.Catalytic characterization of the multilayer Pd(1)In(1) phase in MSR yielded a CO(2)-selectivity of almost 100% between 493 and 550 K. In contrast to previously studied In(2)O(3)-supported PdIn nanoparticles and pure In(2)O(3), intermediate formaldehyde is only partially converted to CO(2) using this Pd(1)In(1) phase. Strongly correlated with PdZn, on an In-diluted PdIn intermetallic phase with "Pd-like" electronic structure, prepared by thermal annealing at 623 K, methanol steam reforming is suppressed and enhanced CO formation via full methanol dehydrogenation is observed.To achieve CO(2)-TOF values on the isolated Pd(1)In(1) intermetallic phase as high as on supported PdIn/In(2)O(3), at least 593 K reaction temperature is required. A bimetal-oxide synergism, with both bimetallic and oxide synergistically contributing to the observed catalytic activity and selectivity, manifests itself by accelerated formaldehyde-to-CO(2) conversion at markedly lowered temperatures as compared to separate oxide and bimetal. Combination of suppression of full methanol dehydrogenation to CO on Pd(1)In(1) inhibited inverse water-gas-shift reaction on In(2)O(3) and fast water activation/conversion of formaldehyde is the key to the low-temperature activity and high CO(2)-selectivity of the supported catalyst.

  20. The photoionization dynamics of methyl iodide (CH{sub 3}I): a joint photoelectron and mass spectrometric investigation

    Energy Technology Data Exchange (ETDEWEB)

    Locht, R; Leyh, B [Departement de Chimie, Institut de Chimie, Laboratoire de Dynamique Moleculaire, Bat. B6c, Universite de Liege, Sart-Tilman par B-4000 Liege 1 (Belgium); Dehareng, D [Centre d' Ingenierie des Proteines, Institut de Chimie, Bat. B6a, Universite de Liege, Sart-Tilman par B-4000 Liege 1 (Belgium); Hottmann, K; Jochims, H W; Baumgaertel, H, E-mail: robert.locht@ulg.ac.b [Institut fuer Physikalische und Theoretische Chemie, Freie Universitaet Berlin, Takustrasse 3, D-14195 Berlin (Germany)

    2010-05-28

    Threshold photoelectron (TPES) and photoionization mass spectrometric (PIMS) studies of CH{sub 3}I in the 8-20 eV photon energy range are presented. The interpretation and assignments are supported by ab initio calculations. The TPES study shows many new discrete features in the Jahn-Teller split ground (tilde X) {sup 2}E ({sup 2}A'-{sup 2}A'') state of CH{sub 3}I{sup +}. A new continuous band starting at about 11.7 eV is detected. These observations are essentially correlated with autoionizing transitions. This interpretation is supported by constant ion state (CIS) spectroscopy. A large enhancement of the transitions to the (tilde A) {sup 2}A and (tilde B) {sup 2}E is ascribed to large autoionizing contributions. Based on the present calculations, the weak to very weak bands in the 18.0-23.0 eV photon energy range are mainly assigned to 2a{sup -1}{sub 1} ionization and to double excitations corresponding essentially to the 2e{sup -2} 4a{sup 1}{sub 1} and 3a{sup -1}{sub 1}2e{sup -1}4a{sup 1}{sub 1} configurations. The PIMS study allowed us to investigate in detail the ionization and dissociation of CH{sub 3}I{sup +} leading to CH{sup +}{sub 2}, CH{sup +}{sub 3}, I{sup +} and CH{sub 2}I{sup +} from the threshold up to 20 eV photon energy. The experimental data are compared to ab initio calculated dissociation energies. The threshold of appearance of CH{sup +}{sub 3}, I{sup +} and CH{sub 2}I{sup +} fragments is concentrated in the 12.2-12.7 eV photon energy range. All three exit channels are correlated with the ground state of CH{sub 3}I{sup +} via non-adiabatic transitions. All three fragment ions have to appear through predissociation of the ionic (tilde X){sup 2}E state and autoionizing dissociation from the ({sup 2}E{sub 3/2})6p Rydberg state. This interpretation is strongly supported by the photoabsorption spectrum measured recently in the same photon energy range. At higher energies, besides direct or predissociation of the (tilde A) {sup 2}A

  1. In situ, real-time characterization of silicide nanostructure coarsening dynamics by photo-electron emission microscopy

    Science.gov (United States)

    Zeman, Matthew Casimir

    Photo-electron emission microscopy (PEEM) was used to observe the growth and coarsening dynamics of transition metal (TM) silicide and rare earth (RE) silicide nanostructures on silicon surfaces in real-time with high lateral resolution during in situ annealing. Evidence was obtained indicating that the coarsening of the silicide islands is strongly influenced by local variations in the size, shape, and number of nanostructures on the surface. The titanium, hafnium, and zirconium silicide nanostructures were observed to grow via Ostwald ripening and attractive migration and coalescence (AMC) at temperatures as high as ~1200°C. Ostwald ripening is a classic coarsening process in which larger nanostructures grow at the expense of smaller surrounding structures as per the Gibbs-Thompson relation. Attractive migration and coalescence is a newly discovered coarsening pathway where nearby islands are observed to migrate attractively towards each other and subsequently coalesce in response to local adatom concentration variations on the surface. A shape distortion of the normally compact and rounded TM silicide islands has been observed during these coarsening processes. The shape distortion suggests that the nanostructures are exchanging mass with each other via diffusion limited processes and these observations support the AMC model. The dysprosium and erbium silicide nanostructures exhibit a distinct faceted morphology and primarily coarsen via Ostwald ripening. The RE silicides form highly elongated nanowires and compact rectangular nanostructures on Si(001) and triangular or hexagonal structures on Si(111). We show that the wires are metastable structures which decay in favor of the larger rectangular islands at high temperatures. Additionally, the rectangular shape and faceted morphology of the RE silicide nanostructures strongly influences their coarsening dynamics. A separate PEEM study explored the thermal stability of thin films of TM oxides (TiO2, ZrO2, HfO2

  2. Flexible Acyclic Polyol-Chloride Anion Complexes and Their Characterization by Photoelectron Spectroscopy and Variable Temperature Binding Constant Determinations

    Energy Technology Data Exchange (ETDEWEB)

    Shokri, Alireza; Wang, Xue B.; Wang, Yangping; O' Doherty, George A.; Kass, Steven R.

    2016-03-17

    Flexible acyclic alcohols with 1–5 hydroxyl groups were bound to chloride anion and these complexes were interrogated by negative ion photoelectron spectroscopy and companion density functional theory computations. The resulting vertical detachment energies are reproduced on average to 0.10 eV by M06-2X/aug-cc-pVTZ predictions and range from 4.45 – 5.96 eV. These values are 0.84 – 2.35 eV larger than the adiabatic detachment energy of Cl– as a result of the larger hydrogen bond networks in the bigger polyols. Adiabatic detachment energies of the alcohol–Cl– clusters are more difficult to determine both experimentally and computationally. This is due to the large geometry changes that occur upon photodetachment and the large bond dissociation energy of H–Cl which enables the resulting chlorine atom to abstract a hydrogen from any of the methylene (CH2) or methine (CH) positions. Both ionic and non-ionic hydrogen bonds (i.e., OH•••Cl– and OH•••OH•••Cl–) form in the larger polyols complexes, and are found to be energetically comparable. Subtle structural differences, consequently can lead to the formation of different types of hydrogen bonds and maximizing the ionic ones is not always preferred. Solution equilibrium binding constants between the alcohols and tetrrabuylammonium chloride (TBACl) in acetonitrile at -24.2, 22.0, and 53.6 °C were also determined. The free energies of association are nearly identical for all of the substrates (i.e., ΔG° = -2.8 ± 0.7 kcal mol–1). Compensating enthalpy and entropy values reveal, contrary to expectation and the intrinsic gas-phase preferences, that the bigger systems with more hydroxyl groups are entropically favored and enthalpically disfavored relative to the smaller species. This suggests that more solvent molecules are released upon binding TBACl to alcohols with more hydroxyl groups and is consistent with the measured negative heat capacities. These quantities increase with

  3. X-ray photoelectron spectroscopic and morphologic studies of Ru nanoparticles deposited onto highly oriented pyrolytic graphite

    Science.gov (United States)

    Bavand, R.; Yelon, A.; Sacher, E.

    2015-11-01

    Ruthenium nanoparticles (Ru NPs) function as effective catalysts in specific reactions, such as methanation and Fischer-Tropsch syntheses. It is our purpose to physicochemically characterize their surfaces, at which catalysis occurs, by surface-sensitive X-ray photoelectron spectroscopy (XPS), using the symmetric peak component anaylsis technique developed in our laboratory to reveal previously hidden components. Ru NPs were deposited by evaporation (0.25-1.5 nm nominal deposition range) onto highly oriented pyrolytic graphite (HOPG). In addition to their surfaces being characterized by XPS, an indication of morphology was obtained from transmission electron microscopy (TEM). Our use of symmetric peak component XPS analysis has revealed detailed information on a previously unidentified surface oxide initially formed, as well as on the valence electronic structure and its variation with NP size, information that is of potential importance in the use of these NPs in catalysis. Each of the several Ru core XPS spectra characterized (3d, 3p and 3s) was found to be composed of three symmetric components. Together with two metal oxide O1s components, these give evidence of a rather complex, previously unidentified oxide that is initially formed. The Ru valence band (4d and 5s) spectra clearly demonstrate a loss of metallicity, a simultaneous increase of the Kubo gap, and an abrupt transfer in valence electron density from the 4d to the 5s orbitals (known as electron spill-over), as the NP size decreases below 0.5 nm. TEM photomicrographs, as a function of deposition rate, show that, at a rate that gives insufficient time for the NP condensation energy to dissipate, the initially well-separated NPs are capable of diffusing laterally and aggregating. This indicates weak NP bonding to the HOPG substrate. Carbide is formed, at both high and low deposition rates, at Ru deposition thicknesses greater than 0.25 nm, its formation explained by Ru NPs reacting with residual

  4. Optically controllable dual-mode switching in single-mode Fabry-Pérot laser diode subject to one side-mode feedback and external single mode injection

    Science.gov (United States)

    Wu, Jian-Wei; Won, Yong Hyub

    2017-06-01

    In this paper, broadly tunable dual-mode lasing system is presented and demonstrated based on single-mode Fabry-Pérot laser diode subject to the feedback of one side mode amplified by an erbium-doped fiber amplifier in the external feedback cavity. The spacing between two resonance modes in output lasing spectrum is broadly tuned by introducing differently amplified side mode into the single-mode laser via the external cavity consisted of amplifier, filter, and polarization controller so that two difference frequencies of 1 THz and 0.6 THz are given to display the tunable behavior of dual-mode emission in this work. Therefore, under an external injection mode into the laser condition, the power dependent injection locking and optical bistability of generated dual-mode emission are discussed in detail. At different wavelength detunings, the emitted two resonance modes including the dominant and feedback modes are switched to on- or off-state by selecting proper high-low power level of the external injection mode. As a consequence, the maximum value of achieved dual-mode on-off ratio is as high as up to 45 dB.

  5. Competition and evolution of dielectric waveguide mode and plasmonic waveguide mode

    Science.gov (United States)

    Yuan, Sheng-Nan; Fang, Yun-Tuan

    2017-10-01

    In order to study the coupling and evolution law of the waveguide mode and two plasmonic surface modes, we construct a line defect waveguide based on hexagonal honeycomb plasmonic photonic crystal. Through adjusting the radius of the edge dielectric rods, the competition and evolution behaviors occur between dielectric waveguide mode and plasmonic waveguide mode. There are three status: only plasmonic waveguide modes occur for rA 0.25a; two kinds of modes coexist for 0.09a slow light.

  6. All-fiber mode selective couplers for mode-division-multiplexed optical transmission

    Science.gov (United States)

    Chang, Sun Hyok; Kim, Kwangjoon; Lee, Joon Ki

    2017-01-01

    All-fiber mode selective coupler (MSC) is comprised of a few mode fiber (FMF) and a single mode fiber (SMF), coupling the LP01 mode of the SMF to a specific higher-order mode (HOM) of the FMF. In order to achieve high coupling ratio and low insertion loss, phase-matching condition between the LP01 mode of SMF arm and the HOM of FMF arm should be satisfied. A polished-type MSC is made by getting their cores into intimate contact. Prism coupling with a polished coupler block can measure the effective refractive index of the mode accurately. We propose and demonstrate three kinds of allfiber mode multiplexer that is composed of consecutive MSCs. 4-mode multiplexer can multiplex 4 modes of LP01, LP11, LP21, and LP02 by cascading LP11, LP21, and LP02 MSCs. It is used for MDM transmission of three modes with 120 Gb/s DP-QPSK signals. In order to enhance the signal transmission performance by receiving degenerate LP modes simultaneously, a mode multiplexer to utilize two-fold degenerate LP11 modes is proposed. It is composed of two consecutive LP11 MSCs that allows the multiplexing of LP01 mode and two orthogonal LP11 modes. We demonstrates WDM transmission of 30 wavelength channels with 33.3 GHz spacing, each carrying 3 modes, over 560 km of FMF. 6- mode multiplexer can multiplex 6 modes of LP01, LP11a, LP11b, LP21a, LP21b, LP02 modes. We demonstrated WDM-MDM transmission with the all-fiber 6-mode multiplexer. In this paper, the manufacturing method and the recent advancements of the all-fiber mode multiplexer based on the MSCs are reviewed. Long-distance mode division multiplexing (MDM) optical signal transmissions with the all-fiber mode multiplexer are experimentally demonstrated.

  7. Automobile Road Vibration Reproduction using Sliding Modes

    NARCIS (Netherlands)

    Monsees, G.; Scherpen, J.M.A.

    2001-01-01

    Sliding mode controllers have a reputation for their robustness against parameter variations, modeling errors and disturbances. They have been successfully applied in several practical situations which demonstrated the potential of sliding mode control for other control problems. However research

  8. Higher order mode optical fiber Raman amplifiers

    DEFF Research Database (Denmark)

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

    2016-01-01

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

  9. Transverse mode-locking in microcavity lasers

    Science.gov (United States)

    Gordon, R.; Heberle, A. P.; Cleaver, J. R. A.

    2002-12-01

    We experimentally demonstrate mode-locking between the transverse modes of a laser. A vertical-cavity surface-emitting laser with evenly-spaced transverse modes is shown to emit a train of 2.1±0.1 ps pulses with an 11 ps repetition rate and a timing jitter of 235±30 fs. Transverse mode-locking in microcavity lasers has potential to improve the compactness, stability, integrability, repetition rate tunability, and efficiency of ultrafast optical communication sources.

  10. Language Differences and Operation Mode

    DEFF Research Database (Denmark)

    Dasi, Angels; Pedersen, Torben

    2013-01-01

    Language serves different purposes depending on the international activity in question. Language has many dimensions and firms’ communicative requirements vary by operational platform. We argue that different dimensions of language vary in their importance depending on the operation mode chosen...... for a foreign market, so that language distance matters in the case of a home-based sales force, while language incidence is key when operating through a local agent. The hypotheses are tested on a large data set encompassing 462 multinational corporations headquartered in Finland, South Korea, New Zealand......, and Sweden that have undertaken a business operation in a foreign country....

  11. Applications of sliding mode control

    CERN Document Server

    Ghommam, Jawhar; Zhu, Quanmin

    2017-01-01

    This book presents essential studies and applications in the context of sliding mode control, highlighting the latest findings from interdisciplinary theoretical studies, ranging from computational algorithm development to representative applications. Readers will learn how to easily tailor the techniques to accommodate their ad hoc applications. To make the content as accessible as possible, the book employs a clear route in each paper, moving from background to motivation, to quantitative development (equations), and lastly to case studies/illustrations/tutorials (simulations, experiences, curves, tables, etc.). Though primarily intended for graduate students, professors and researchers from related fields, the book will also benefit engineers and scientists from industry. .

  12. Squint mode SAR processing algorithms

    Science.gov (United States)

    Chang, C. Y.; Jin, M.; Curlander, J. C.

    1989-01-01

    The unique characteristics of a spaceborne SAR (synthetic aperture radar) operating in a squint mode include large range walk and large variation in the Doppler centroid as a function of range. A pointing control technique to reduce the Doppler drift and a new processing algorithm to accommodate large range walk are presented. Simulations of the new algorithm for squint angles up to 20 deg and look angles up to 44 deg for the Earth Observing System (Eos) L-band SAR configuration demonstrate that it is capable of maintaining the resolution broadening within 20 percent and the ISLR within a fraction of a decibel of the theoretical value.

  13. A comparison of short distance transport modes

    NARCIS (Netherlands)

    Bouwman, M.E.; Sucharov, LJ

    2000-01-01

    This paper presents a comparison of seven transport modes in both urban and rural settings, based on four characteristics of transport modes: space use, energy use, costs and travel time. The characteristics are calculated with a computer model and based on these results the modes can be ranked.

  14. MDM: A Mode Diagram Modeling Framework

    DEFF Research Database (Denmark)

    Wang, Zheng; Pu, Geguang; Li, Jianwen

    2012-01-01

    Periodic control systems used in spacecrafts and automotives are usually period-driven and can be decomposed into different modes with each mode representing a system state observed from outside. Such systems may also involve intensive computing in their modes. Despite the fact that such control...

  15. Silicon Photonic Integrated Circuit Mode Multiplexer

    DEFF Research Database (Denmark)

    Ding, Yunhong; Ou, Haiyan; Xu, Jing

    2013-01-01

    We propose and demonstrate a novel silicon photonic integrated circuit enabling multiplexing of orthogonal modes in a few-mode fiber (FMF). By selectively launching light to four vertical grating couplers, all six orthogonal spatial and polarization modes supported by the FMF are successfully exc...

  16. Viscoelastic modes in chiral liquid crystals

    Indian Academy of Sciences (India)

    amit@fs.rri.local.net (Amit Kumar Agarwal)

    our studies on the viscoelastic modes of some chiral liquid crystals using dynamic light scattering. We discuss viscoelastic modes corresponding to the C director fluctuations in the chiral smectic C phase and the behaviour of the Goldstone-mode near the chiral smectic C–smectic A phase transition. In cholesteric liquid ...

  17. PLC-based mode multi/demultiplexers for mode division multiplexing

    Science.gov (United States)

    Saitoh, Kunimasa; Hanzawa, Nobutomo; Sakamoto, Taiji; Fujisawa, Takeshi; Yamashita, Yoko; Matsui, Takashi; Tsujikawa, Kyozo; Nakajima, Kazuhide

    2017-02-01

    Recently developed PLC-based mode multi/demultiplexers (MUX/DEMUXs) for mode division multiplexing (MDM) transmission are reviewed. We firstly show the operation principle and basic characteristics of PLC-based MUX/DEMUXs with an asymmetric directional coupler (ADC). We then demonstrate the 3-mode (2LP-mode) multiplexing of the LP01, LP11a, and LP11b modes by using fabricated PLC-based mode MUX/DEMUX on one chip. In order to excite LP11b mode in the same plane, a PLC-based LP11 mode rotator is introduced. Finally, we show the PLC-based 6-mode (4LP-mode) MUX/DEMUX with a uniform height by using ADCs, LP11 mode rotators, and tapered waveguides. It is shown that the LP21a mode can be excited from the LP11b mode by using ADC, and the two nearly degenerated LP21b and LP02 modes can be (de)multiplexed separately by using tapered mode converter from E13 (E31) mode to LP21b (LP02) mode.

  18. Adaptive Batch Mode Active Learning.

    Science.gov (United States)

    Chakraborty, Shayok; Balasubramanian, Vineeth; Panchanathan, Sethuraman

    2015-08-01

    Active learning techniques have gained popularity to reduce human effort in labeling data instances for inducing a classifier. When faced with large amounts of unlabeled data, such algorithms automatically identify the exemplar and representative instances to be selected for manual annotation. More recently, there have been attempts toward a batch mode form of active learning, where a batch of data points is simultaneously selected from an unlabeled set. Real-world applications require adaptive approaches for batch selection in active learning, depending on the complexity of the data stream in question. However, the existing work in this field has primarily focused on static or heuristic batch size selection. In this paper, we propose two novel optimization-based frameworks for adaptive batch mode active learning (BMAL), where the batch size as well as the selection criteria are combined in a single formulation. We exploit gradient-descent-based optimization strategies as well as properties of submodular functions to derive the adaptive BMAL algorithms. The solution procedures have the same computational complexity as existing state-of-the-art static BMAL techniques. Our empirical results on the widely used VidTIMIT and the mobile biometric (MOBIO) data sets portray the efficacy of the proposed frameworks and also certify the potential of these approaches in being used for real-world biometric recognition applications.

  19. X-ray photoelectron spectroscopic and morphologic studies of Ru nanoparticles deposited onto highly oriented pyrolytic graphite

    Energy Technology Data Exchange (ETDEWEB)

    Bavand, R.; Yelon, A.; Sacher, E., E-mail: edward.sacher@polymtl.ca

    2015-11-15

    Highlights: • Ru nanoparticle 3d, 3p, and 3s core XPS spectra were found to be composed of three symmetric components. The first component, Ru1, is due to zerovalent R, while components Ru2 and Ru3 are attributed to surface oxide species. • The nanoparticle surface additionally possesses a carbon-rich surface, from residual gas hydrocarbons present in the vacuum. • TEM photomicrographs show the aggregation and partial coalescence of nanoparticles deposited at high deposition rates, provoked by the high rate of release of the heat of condensation, indicating weak bonding to the HOPG substrate. • The analysis of the valence band indicates an increase of the Kubo gap with decreasing NP size, accompanied by an abrupt electron spill-over from the 4d to the 5s orbital. - Abstract: Ruthenium nanoparticles (Ru NPs) function as effective catalysts in specific reactions, such as methanation and Fischer-Tropsch syntheses. It is our purpose to physicochemically characterize their surfaces, at which catalysis occurs, by surface-sensitive X-ray photoelectron spectroscopy (XPS), using the symmetric peak component anaylsis technique developed in our laboratory to reveal previously hidden components. Ru NPs were deposited by evaporation (0.25–1.5 nm nominal deposition range) onto highly oriented pyrolytic graphite (HOPG). In addition to their surfaces being characterized by XPS, an indication of morphology was obtained from transmission electron microscopy (TEM). Our use of symmetric peak component XPS analysis has revealed detailed information on a previously unidentified surface oxide initially formed, as well as on the valence electronic structure and its variation with NP size, information that is of potential importance in the use of these NPs in catalysis. Each of the several Ru core XPS spectra characterized (3d, 3p and 3s) was found to be composed of three symmetric components. Together with two metal oxide O1s components, these give evidence of a rather complex

  20. Band offset in zinc oxy-sulfide/cubic-tin sulfide interface from X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Sanal, K.C.; Nair, P.K.; Nair, M.T.S., E-mail: mtsn@ier.unam.mx

    2017-02-28

    Highlights: • Zinc oxy-sulfide thin films, 175–240 nm, deposited by rf-sputtering from targets of ZnO + ZnS. • Oxygen content in thin films is enhanced 3–4 times compared with that in ZnO:ZnS targets. • Thin film ZnO{sub x}S{sub 1−x} with x = 0.88–0.27 and optical band gap 2.8–3.2 eV is suitable for solar cells. • The conduction band offset with SnS of cubic structure studied by XPS are +0.41 to −0.28 eV. - Abstract: Zinc oxy-sulfide, ZnO{sub x}S{sub 1−x}, has been found to provide better band alignment in thin film solar cells of tin sulfide of orthorhombic crystalline structure. Here we examine ZnO{sub x}S{sub 1−x}/SnS-CUB interface, in which the ZnO{sub x}S{sub 1−x} thin film was deposited by radio frequency (rf) magnetron sputtering on SnS thin film of cubic (CUB) crystalline structure with a band gap (E{sub g}) of 1.72 eV, obtained via chemical deposition. X-ray photoelectron spectroscopy provides the valence band maxima of the materials and hence places the conduction band offset of 0.41 eV for SnS-CUB/ZnO{sub 0.27}S{sub 0.73} and −0.28 eV for SnS-CUB/ZnO{sub 0.88}S{sub 0.12} interfaces. Thin films of ZnO{sub x}S{sub 1−x} with 175–240 nm in thickness were deposited from targets prepared with different ZnO to ZnS molar ratios. With the target of molar ratio of 1:13.4, the thin films are of composition ZnO{sub 0.27}S{sub 0.73} with hexagonal crystalline structure and with that of 1:1.7 ratio, it is ZnO{sub 0.88}S{sub 0.12}. The optical band gap of the ZnO{sub x}S{sub 1−x} thin films varies from 2.90 eV to 3.21 eV as the sulfur to zinc ratio in the film increases from 0.12:1 to 0.73:1 as determined from X-ray diffraction patterns. Thus, band offsets sought for absorber materials and zinc oxy-sulfide in solar cells may be achieved through a choice of ZnO:ZnS ratio in the sputtering target.