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Sample records for s-polarized photoelectron yield

  1. UV photoelectron yield spectroscopy of chalcopyrite structure Cu-In-Se thin films

    International Nuclear Information System (INIS)

    Kohiki, Shigemi; Nishitani, Mikihiko; Negami, Takayuki; Wada, Takahiro; Monjushiro, Hideaki; Watanabe, Iwao; Yokoyama, Yu

    1994-01-01

    Surface-sensitive UV photoelectron yield spectroscopy was employed to study electron acceptor levels at surfaces of chalcopyrite structure Cu-In-Se thin films. Surface Fermi level pinning was observed for Cu-rich films. Shallow acceptor levels ascribable to defects Cu In and V Cu were observed for near-stoichiometric and In-rich films respectively. (orig.)

  2. Formic and acetic acid: Valence threshold photoelectron and photoionisation total ion yield studies

    Energy Technology Data Exchange (ETDEWEB)

    Siggel-King, Michele R.F., E-mail: michele.siggel-king@stfc.ac.uk [Cockcroft Institute, Daresbury Science and Innovation Campus, Daresbury, Warrington WA4 4AD (United Kingdom); Department of Physics, University of Liverpool, Liverpool L69 3BX,UK (United Kingdom); Yencha, Andrew J. [Department of Chemistry, State University of New York at Albany, Albany, NY 12222 (United States); King, George C. [Department of Physics and Astronomy and Photon Science Institute, Manchester University, Manchester M13 9PL (United Kingdom); Malins, Andrew E.R. [Cockcroft Institute, Daresbury Science and Innovation Campus, Daresbury, Warrington WA4 4AD (United Kingdom); Eypper, Marie [School of Chemistry, University of Southampton, Southampton SO17 1BJ (United Kingdom)

    2012-09-15

    Highlights: Black-Right-Pointing-Pointer High-resolution threshold photoelectron spectrum of formic acid. Black-Right-Pointing-Pointer High-resolution total photo-ion yield spectrum of formic acid. Black-Right-Pointing-Pointer High-resolution threshold photoelectron spectrum of acetic acid. Black-Right-Pointing-Pointer High-resolution total photo-ion yield spectrum of acetic acid. -- Abstract: The carboxylic acids (formic and acetic) have been studied using threshold photoelectron (TPE) and total photoion yield (TPIY) spectroscopies; simultaneously obtained spectra of formic acid (HCOOH) were recorded over the entire valence ionisation region from 11-21 eV at a resolution of {approx}12 meV. Higher resolution spectra ({approx}6 meV) were also obtained in the energy region of the lowest two cationic states. Analysis of the TPE spectrum in this energy range agreed very favorably with the best available conventional photoelectron (PE) spectrum of formic acid. Autoionising Rydberg structure was observed in the TPIY spectrum of formic acid and is attributed primarily to the presence of the npa Prime Leftwards-Arrow 8a Prime Rydberg series converging on to the 3{sup 2}A Prime ionic state of formic acid. Preliminary results, at a resolution of {approx}8 meV, were obtained for acetic acid (CH{sub 3}COOH) over the onset of the ionisation energy region. The TPE spectrum was found to be very similar to the best published photoelectron spectrum, but no Rydberg structure was observed in the TPIY spectrum.

  3. Photoelectron yields of scintillation counters with embedded wavelength-shifting fibers read out with silicon photomultipliers

    Energy Technology Data Exchange (ETDEWEB)

    Artikov, Akram; Baranov, Vladimir; Blazey, Gerald C.; Chen, Ningshun; Chokheli, Davit; Davydov, Yuri; Dukes, E. Craig; Dychkant, Alexsander; Ehrlich, Ralf; Francis, Kurt; Frank, M. J.; Glagolev, Vladimir; Group, Craig; Hansen, Sten; Magill, Stephen; Oksuzian, Yuri; Pla-Dalmau, Anna; Rubinov, Paul; Simonenko, Aleksandr; Song, Enhao; Stetzler, Steven; Wu, Yongyi; Uzunyan, Sergey; Zutshi, Vishnu

    2018-05-01

    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.

  4. Measurement of photoelectron yield of the CDEX-10 liquid argon detector prototype

    Science.gov (United States)

    Chen, Qing-Hao; Yue, Qian; Cheng, Jian-Ping; Kang, Ke-Jun; Li, Yuan-Jing; Lin, Shin-Ted; Tang, Chang-Jian; Xing, Hao-Yang; Yu, Xun-Zhen; Zeng, Ming; Zhu, Jing-Jun

    2016-11-01

    The China Dark Matter Experiment (CDEX) is a low background experiment at China Jinping Underground Laboratory (CJPL) designed to directly detect dark matter with a high-purity germanium (HPGe) detector. In the second phase, CDEX-10, which has a 10 kg germanium array detector system, a liquid argon (LAr) anti-Compton active shielding and cooling system is proposed. To study the properties of the LAr detector, a prototype with an active volume of 7 liters of liquid argon was built and operated. The photoelectron yields, as a critically important parameter for the prototype detector, have been measured to be 0.051-0.079 p.e./keV for 662 keV γ rays at different positions. The good agreement between the experimental and simulation results has provided a reasonable understanding and determination of the important parameters such as the surviving fraction of the excimers, the absorption length for 128 nm photons in liquid argon, the reflectivity of Teflon and so on.

  5. 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.

  6. Threshold photoelectron spectroscopy and photoionization total ion yield spectroscopy of simple organic acids, aldehydes, ketones and amines

    International Nuclear Information System (INIS)

    Yencha, Andrew J; Malins, Andrew E R; Siggel-King, Michele R F; Eypper, Marie; King, George C

    2009-01-01

    We have initiated a research program to investigate the ionization behavior of some simple organic molecules containing the carboxyl group (R 2 C=O), where R could be H, OH, NH 2 , or CH 3 or other aliphatic or aromatic carbon groups, using threshold photoelectron spectroscopy and photoionization total ion yield spectroscopy. We report here on the simplest organic acid, formic acid, and two simple aldehydes: acetaldehyde and the simplest unsaturated aldehyde, 2-propenal (acrolein). The objective of this study was to characterize the valence cationic states of these molecules with vibrational structural resolution.

  7. Photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Shirley, D.A.

    1976-01-01

    Research activities in photoelectron spectroscopy at Lawrence Radiation Laboratory during 1976 are described. Topics covered include: the orientation of CO on Pt(III) and Ni(III) surfaces from angle-resolved photoemission; photoemission from CO on Pt(III) in the range 40 eV less than or equal to dirac constant ω less than or equal to 150 eV; photoemission studies of electron states at clean surfaces using synchrotron radiation; angle and energy dependent photoemission studies of plasmon loss structure in Al and In; d-orbital directed photoemission from copper; interpretation of angle-resolved x-ray photoemission from valence bands; atomic cross-section effects in soft x-ray photoemission from Ag, Au, and Pt valence bands; x-ray photoelectron spectroscopic studies of the electronic structure of transition metal difluorides; x-ray photoemission investigation of the density of states of B'-NiAl; the electronic structure of SrTiO 3 and some simple related oxides; fluorescence lifetime measurements of np 5 (n+1)S' states in krypton and xenon; Zeeman beats in the resonance fluorescence of the 3P 1 , states in krypton and xenon; lifetime measurements of rare-gas dimers; configuration interaction effects in the atomic photoelectron spectra of Ba, Sm, Eu, and Yb; glow discharge lamps as electron sources for electron impact excitation; electron impact excitation of electron correlation states in Ca, Sr, and Ba; photoelectron spectroscopy of atomic and molecular bismuth; relativistic effects in the uv photoelectron spectra of group VI diatomic molecules; and relative gas-phase acidities and basicities from a proton potential model

  8. Photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Bosch, A.

    1982-01-01

    In this work examples of the various aspects of photoelectron spectroscopy are given. The investigation was started with the development of an angle-resolved spectrometer so that the first chapters deal with angle-resolved ultra-violet photoelectron spectroscopy. To indicate the possibilities and pitfalls of the technique, in chapter II the theory is briefly reviewed. In chapter III the instrument is described. The system is based on the cylindrical mirror deflection analyzer, which is modified and improved for angle-resolved photoelectron spectroscopy. In combination with a position sensitive detector, a spectrometer is developed with which simultaneously several angle-resolved spectra can be recorded. In chapter IV, the results are reported of angle-integrated UPS experiments on dilute alloys. Using the improved energy resolution of the instrument the author was able to study the impurity states more accurately and shows that the photoemission technique has become an important tool in the study of impurities and the interactions involved. XPS and Auger results obtained from dilute alloys are presented in chapter V. It is shown that these systems are especially suited for the study of correlation effects and can provide interesting problems related to the satellite structure and the interaction of the impurity with the host. In chapter VI, the valence bands of ternary alloys are studied with UPS and compared to recent band structure calculation. The core level shifts are analyzed in a simple, thermodynamic scheme. (Auth.)

  9. 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.

  10. Performance of the SRRC scanning photoelectron microscope

    International Nuclear Information System (INIS)

    Hong, I.-H.; Lee, T.-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

  11. Threshold photoelectron spectroscopy of acetaldehyde and acrolein

    International Nuclear Information System (INIS)

    Yencha, Andrew J.; Siggel-King, Michele R.F.; King, George C.; Malins, Andrew E.R.; Eypper, Marie

    2013-01-01

    Highlights: •High-resolution threshold photoelectron spectrum of acetaldehyde. •High-resolution threshold photoelectron spectrum of acrolein. •High-resolution total photoion yield spectrum of acetaldehyde. •High-resolution total photoion yield spectrum of acrolein. •Determination of vertical ionization potentials in acetaldehyde and acrolein. -- Abstract: High-resolution (6 meV and 12 meV) threshold photoelectron (TPE) spectra of acetaldehyde and acrolein (2-propenal) have been recorded over the valence binding energy region 10–20 eV, employing synchrotron radiation and a penetrating-field electron spectrometer. These TPE spectra are presented here for the first time. All of the band structures observed in the TPE spectra replicate those found in their conventional HeI photoelectron (PE) spectra. However, the relative band intensities are found to be dramatically different in the two types of spectra that are attributed to the different dominant operative formation mechanisms. In addition, some band shapes and their vertical ionization potentials are found to differ in the two types of spectra that are associated with the autoionization of Rydberg states in the two molecules

  12. High-resolution threshold photoelectron-photoion coincidence experiments performed on beamline 9.0.2.2: Kinetic energy release study of the process SF{sub 6} + hv {yields} SF{sub 5}{sup +} F + e{sup -}

    Energy Technology Data Exchange (ETDEWEB)

    Evans, M.; Ng, C.Y. [Ames Lab., IA (United States); Hsu, C.W.; Heimann, P. [Lawrence Berkeley National Lab., CA (United States)

    1997-04-01

    Vacuum ultraviolet (VUV) photoionization mass spectrometry has been used extensively to determine the energetics of neutral radicals and radical cations, as well as to study the dynamics of the dissociative photoionization process. Very often these measurements are concerned with determining the appearance energy (AE) for a dissociative ionization process, as well as determining the heats of formation of the species involved. One such photoionization mass spectrometric technique employed on End Station 2 of the Chemical Dynamics Beamline (9.0.2.2) at the Advanced Light Source is the threshold photoelectron-photoion coincidence (TPEPICO) method. TPEPICO involves measuring the time-of-flight (TOF) mass spectrum of a given cation in coincidence with threshold photoelectrons at a known photoionization energy.

  13. 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.

  14. X-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Attekum, P.M.T.M. van.

    1979-01-01

    The methods and results of X-ray photoelectron spectroscopy in the study of plasmons, alloys and gold compounds are discussed. After a comprehensive introduction, seven papers by the author, previously published elsewhere, are reprinted and these cover a wide range of the uses of X-ray photoelectron spectroscopy. (W.D.L.)

  15. 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.

  16. Photoelectron spectroscopy principles and applications

    CERN Document Server

    Hüfner, Stefan

    1995-01-01

    Photoelectron Spectroscopy presents an up-to-date introduction to the field by treating comprehensively the electronic structures of atoms, molecules, solids and surfaces Brief descriptions are given of inverse photoemission, spin-polarized photoemission and photoelectron diffraction Experimental aspects are considered throughout the book, and the results are carefully interpreted by theory A wealth of measured data is presented in the form of tables for easy use by experimentalists

  17. Optimization of s-Polarization Sensitivity in Apertureless Near-Field Optical Microscopy

    Directory of Open Access Journals (Sweden)

    Yuika Saito

    2012-01-01

    Full Text Available It is a general belief in apertureless near-field microscopy that the so-called p-polarization configuration, where the incident light is polarized parallel to the axis of the probe, is advantageous to its counterpart, the s-polarization configuration, where the incident light is polarized perpendicular to the probe axis. While this is true for most samples under common near-field experimental conditions, there are samples which respond better to the s-polarization configuration due to their orientations. Indeed, there have been several reports that have discussed such samples. This leads us to an important requirement that the near-field experimental setup should be equipped with proper sensitivity for measurements with s-polarization configuration. This requires not only creation of effective s-polarized illumination at the near-field probe, but also proper enhancement of s-polarized light by the probe. In this paper, we have examined the s-polarization enhancement sensitivity of near-field probes by measuring and evaluating the near-field Rayleigh scattering images constructed by a variety of probes. We found that the s-polarization enhancement sensitivity strongly depends on the sharpness of the apex of near-field probes. We have discussed the efficient value of probe sharpness by considering a balance between the enhancement and the spatial resolution, both of which are essential requirements of apertureless near-field microscopy.

  18. Advances in BNL's polarized ion source development

    Energy Technology Data Exchange (ETDEWEB)

    Alessi, J.; DeVito, B.; Herschcovitch, A.; Kponou, A.; Meitzler, C.

    1988-01-01

    Polarized protons have been accelerated in the AGS to 22/yield/ GeV. The polarized source presently used produces 30-40 ..mu..A of /rvec char/H/sup -/ at 75-80% polarization, in 500 ..mu..s pulses, 0.5 Hz. This is three orders of magnitude lower in intensity than normal H/sup -/ operation, and higher intensities are desired. There is a program in the AGS department to develop a higher intensity source. This is a ground state atomic beam source with an atomic beam cooled to 6 K, spin selection and focusing via a superconducting solenoid (shown) or a sextupole system, and an ionizer for /rvec char/H/sup -/ production based on the charge exchange of /rvec char/H/degree/ with D/sup -/. Work is in progress on all three components, and will be described in this paper. 6 refs., 7 figs.

  19. Synchrotron-based photoelectron microscopy

    International Nuclear Information System (INIS)

    Barinov, Alexei; Dudin, Pavel; Gregoratti, Luca; Locatelli, Andrea; Onur Mentes, Tevfik; Angel Nino, Miquel; Kiskinova, Maya

    2009-01-01

    The paper is a brief overview of the operation principles and the potentials of the scanning photoelectron microscopes (SPEM) and X-ray photoemission electron microscopes (XPEEM) operating at synchrotron facilities. Selected results will illustrate the impact of high spatial resolution for micro-characterization of the surface composition and electronic structure, a key issue for analysis of technologically relevant materials and for fundamental understanding of many unexplored surface phenomena.

  20. Maximum-information photoelectron metrology

    Science.gov (United States)

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

    2015-07-01

    Photoelectron interferograms, manifested in photoelectron angular distributions (PADs), are high-information, coherent observables. In order to obtain the maximum information from angle-resolved photoionization experiments it is desirable to record the full, three-dimensional (3D), photoelectron momentum distribution. Here we apply tomographic reconstruction techniques to obtain such 3D distributions from multiphoton ionization of potassium atoms, and fully analyze the energy and angular content of the 3D data. The PADs obtained as a function of energy indicate good agreement with previous 2D data and detailed analysis [Hockett et al., Phys. Rev. Lett. 112, 223001 (2014), 10.1103/PhysRevLett.112.223001] concerning the main spectral features, but also indicate unexpected symmetry breaking in certain regions of momentum space, thus revealing additional continuum interferences which cannot otherwise be observed. These observations reflect the presence of additional ionization pathways and, most generally, illustrate the power of maximum-information measurements of coherent observables for quantum metrology of complex systems.

  1. Time relative single-photon (photoelectron) method

    International Nuclear Information System (INIS)

    Luo Binqiao

    1988-01-01

    A single-photon (photoelectron) measuring system is designed. It researches various problems in single-photon (photoelectron) method. The electronic resolving time is less than 25 ps. The resolving time of single-photon (photoelectron) measuring system is 25 to 65 ps

  2. Femtosecond photoelectron point projection microscope

    International Nuclear Information System (INIS)

    Quinonez, Erik; Handali, Jonathan; Barwick, Brett

    2013-01-01

    By utilizing a nanometer ultrafast electron source in a point projection microscope we demonstrate that images of nanoparticles with spatial resolutions of the order of 100 nanometers can be obtained. The duration of the emission process of the photoemitted electrons used to make images is shown to be of the order of 100 fs using an autocorrelation technique. The compact geometry of this photoelectron point projection microscope does not preclude its use as a simple ultrafast electron microscope, and we use simple analytic models to estimate temporal resolutions that can be expected when using it as a pump-probe ultrafast electron microscope. These models show a significant increase in temporal resolution when comparing to ultrafast electron microscopes based on conventional designs. We also model the microscopes spectroscopic abilities to capture ultrafast phenomena such as the photon induced near field effect

  3. Materials characterization by photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Nascente, P.A.P.

    2010-01-01

    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)

  4. a near ambient pressure UV photoelectron spectroscopy

    Indian Academy of Sciences (India)

    Manoj Kumar Ghosalya

    2018-03-02

    Mar 2, 2018 ... VB photoelectron spectroscopy with low energy photons is an important tool to access mostly sur- face specific electronic changes. Indeed, near ambient pressure (NAP) ultraviolet photoelectron spectroscopy. (NAP-UPS) is fully relevant to explore silver-oxygen interaction, since Ag 4d and O 2p orbitals ...

  5. Laser photoelectron spectrometry of Sc- and Y-

    International Nuclear Information System (INIS)

    Feigerle, C.S.; Herman, Z.; Lineberger, W.C.

    1981-01-01

    The photoelectron spectra of Sc - and Y - have been obtained in a crossed ion- and laser-beam experiment. Analysis of the Sc - spectrum yields two bound terms of 3d4s 2 4p configuration ( 1 D 0 and 3 D 0 ), with EA(Sc) = 0.189 +- 0.020 eV and an excited-state binding energy of 0.042 +- 0.020 eV. Similarly, the (4d5s 2 5p) 1 D 0 ground state of Y - is bound by 0.308 +- 0.012 eV and a (4d5s 2 5p) 3 D 0 excited term is bound by 0.165 +- 0.025 eV. With the determination of the bound electronic configuration of Sc - as 3d4s 2 4p, the order of filling of electron shells of the first transition series negative ions is found to be 4s 2 ep, 3d4s 2 4p, the order of filling of electron shells of the first transition series negative ions is found to be 4s 2 4p, 3d4s 2 4p, followed by 3dsup(k) 4s 2 (k = 3, 4, ..., 10). (orig.)

  6. UV lamp for photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Cardoso, M.J.B.; Landers, R.; Sundaram, V.S.

    1983-01-01

    An UV lamp and a differential pumping system which enables to couple the lamp to an ultra-high vacuum chamber (10 -9 torr) without using windows, are described. The differential between the pressure inside the discharge chamber and the one in de UHV region, which is of 10 8 -10 9 , is achieved with two pumping states separated by pyrex capillaries having an internal diameter of 0.6 mm. In the first stage, a mechanical pump (10 -3 torr) is used; in the second stage, a diffusor pump with a cryogenic trap (N 2 liq - 10 -7 torr) is employed. The lamp produces, when used with high purity He, narrow lines almost clear at 21.2 eV and 40.8 eV, depending on the discharge chamber pressure, thus eliminating the need of a monochromator. As a high voltage source (3 KV), a commercial unit with a good current control was used, ensuring UV beam stability - an essential characteristic for this lamp if it is employed for photoelectron excitation of crystalline samples. (C.L.B.) [pt

  7. 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...

  8. Polarization Effects in Attosecond Photoelectron Spectroscopy

    DEFF Research Database (Denmark)

    Baggesen, Jan Conrad; Madsen, Lars Bojer

    2010-01-01

    following the field instead. We show that polarization effects may lead to an apparent temporal shift that needs to be properly accounted for in the analysis. The effect may be isolated and studied by angle-resolved photoelectron spectroscopy from oriented polar molecules. We also show that polarization...... effects will lead to an apparent temporal shift of 50 as between photoelectrons from a 2p and 1s state in atomic hydrogen....

  9. Near threshold studies of photoelectron satellites

    International Nuclear Information System (INIS)

    Heimann, P.A.

    1986-11-01

    Photoelectron spectroscopy and synchrotron radiation have been used to study correlation effects in the rare gases: He, Ne, Ar, Kr, and Xe. Two kinds of time-of-flight electron analyzers were employed to examine photoionization very close to threshold and at higher kinetic energies. Partial cross sections and angular distributions have been measured for a number of photoelectron satellites. The shake-off probability has been determined at some inner-shell resonances. 121 refs., 28 figs., 13 tabs

  10. Restoration of s-polarized evanescent waves and subwavelength imaging by a single dielectric slab

    International Nuclear Information System (INIS)

    El Gawhary, Omar; Schilder, Nick J; Costa Assafrao, Alberto da; Pereira, Silvania F; Paul Urbach, H

    2012-01-01

    It was predicted a few years ago that a medium with negative index of refraction would allow for perfect imaging. Although no material has been found so far that behaves as a perfect lens, some experiments confirmed the theoretical predictions in the near-field, or quasi-static, regime where the behaviour of a negative index medium can be mimicked by a thin layer of noble metal, such as silver. These results are normally attributed to the excitation of surface plasmons in the metal, which only leads to the restoration of p-polarized evanescent waves. In this work, we show that the restoration of s-polarized evanescent waves and, correspondingly, sub-wavelength imaging by a single dielectric slab are possible. Specifically, we show that at λ = 632 nm a thin layer of GaAs behaves as a superlens for s-polarized waves. Replacing the single-metal slab by a dielectric is not only convenient from a technical point of view, it being much easier to deposit and control the thickness and flatness of dielectric films than metal ones, but also invites us to re-think the connection between surface plasmon excitation and the theory of negative refraction. (paper)

  11. Carrier-envelope phase dependent photoelectron energy spectra in low intensity regime.

    Science.gov (United States)

    Li, Yang; Li, Min; Zhou, Yueming; Ma, Xiaomeng; Xie, Hui; Lan, Pengfei; Lu, Peixiang

    2017-05-15

    We study the carrier-envelope phase (CEP) dependent photoelectron energy spectra from above-threshold ionization by numerically solving the time-dependent Schrödinger equation of hydrogen atom in a few-cycle laser field at intensities in the range of (2-10) × 10 13 W/cm 2 . Depending on the electron energy and the laser intensity, the yield of the photoelectron reveals clear oscillations with respect to the CEP. At high laser intensities (larger than ~3 × 10 13 W/cm 2 ), the yield of the high-energy photoelectrons (larger than 2U p , with U p being the ponderomotive potential) shows two kinds of oscillations with the CEP for different electron energies. There is a clear phase jump for those two kinds of oscillations. In contrast, at low laser intensities (smaller than ~3 × 10 13 W/cm 2 ), the phase of the oscillation for the high-energy photoelectron yield with the CEP is nearly independent on the electron energy, which will reduce the sensitivity of the retrieval of single-shot CEP using the method reported by T. Wittmann et al. [Nat. Phys. 5, 357 (2009)] at low laser intensities. We further show that the low-energy photoelectrons display distinct CEP-dependent intercycle interference fringes, providing an alternative approach to retrieve the CEP with high sensitivity in a few-cycle laser field with low intensity.

  12. Photoelectron spectroscopic and microspectroscopic probes of ferroelectrics

    Science.gov (United States)

    Tǎnase, Liviu C.; Abramiuc, Laura E.; Teodorescu, Cristian M.

    2017-12-01

    This contribution is a review of recent aspects connected with photoelectron spectroscopy of free ferroelectric surfaces, metals interfaced with these surfaces, graphene-like layers together with some exemplifications concerning molecular adsorption, dissociations and desorptions occurring from ferroelectrics. Standard photoelectron spectroscopy is used nowadays in correlation with other characterization techniques, such as piezoresponse force microscopy, high resolution transmission electron spectroscopy, and ferroelectric hysteresis cycles. In this work we will concentrate mainly on photoelectron spectroscopy and spectro-microscopy characterization of ferroelectric thin films, starting from atomically clean ferroelectric surfaces of lead zirco-titanate, then going towards heterostructures using this material in combination with graphene-like carbon layers or with metals. Concepts involving charge accumulation and depolarization near surface will be revisited by taking into account the newest findings in this area.

  13. Coherent control of photoelectron wavepacket angular interferograms

    International Nuclear Information System (INIS)

    Hockett, P; Wollenhaupt, M; Baumert, T

    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, 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. (paper)

  14. 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.

  15. Calculated characteristics of multichannel photoelectron multipliers

    International Nuclear Information System (INIS)

    Vasil'chenko, V.G.; Dajkovskij, A.G.; Milova, N.V.; Rakhmatov, V.E.; Rykalin, V.I.

    1990-01-01

    Structural features and main calculated characteristics of some modifications of position-sensitive two-coordinate multichannel photoelectron multipliers (PEM) with plate-type multiplying systems are described. The presented PEM structures are free from direct optical and ion feedbacks, provide coordinate resolution ≅ 1 mm with efficiency of photoelectron detection ≅ 90%. Capabilities for using silicon field-effect photocathodes, providing electron extraction into vacuum, as well as prospects of using multichannel multiplying systems for readout of the data from solid detectors are considered

  16. Polarity of wurtzite crystals by photoelectron diffraction

    Czech Academy of Sciences Publication Activity Database

    Bartoš, Igor; Romanyuk, Olexandr

    2014-01-01

    Roč. 315, OCT (2014), s. 506-509 ISSN 0169-4332 Grant - others:AVČR(CZ) M100101201 Institutional support: RVO:68378271 Keywords : wurtzite semiconductors * surface polarity * X-ray photoelectron diffraction * XPD Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.711, year: 2014 http://www.sciencedirect.com/science/article/pii/S016943321400066X

  17. Photoelectron Spectroscopy in Advanced Placement Chemistry

    Science.gov (United States)

    Benigna, James

    2014-01-01

    Photoelectron spectroscopy (PES) is a new addition to the Advanced Placement (AP) Chemistry curriculum. This article explains the rationale for its inclusion, an overview of how the PES instrument records data, how the data can be analyzed, and how to include PES data in the course. Sample assessment items and analysis are included, as well as…

  18. 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.

  19. Classical ultraviolet photoelectron spectroscopy of polymers

    International Nuclear Information System (INIS)

    Salaneck, W.R.

    2009-01-01

    Although X-ray photoelectron spectroscopy of polymers was well established by Clark and coworkers in the 1970s, ultraviolet photoelectron spectroscopy of polymer films, was developed later. Previous to the 1970s, the first attempts to use ultraviolet light on polymer films took the form of appearance potential (valence band edge) measurements. Only some years later could the full valence band region of thin polymer films, including insulating polymers, semiconducting polymers and electrically conducting polymers. The development of what might be termed 'classical ultraviolet photoelectron spectroscopy' of polymer films may be loosely based upon a variety of issues, including adapting thin polymer film technology to ultra high vacuum studies, the widespread use of helium resonance lamps for studies of solid surfaces, the combined advent of practical and sufficient theoretical-computational methods. The advent of, and the use of, easily available synchrotron radiation for multi-photon spectroscopies, nominally in the area of the near UV, is not included in the term 'classical'. At the same time, electrically conducting polymers were discovered, leading to applications of the corresponding semiconducting polymers, which added technologically driven emphasis to this development of ultraviolet photoelectron spectroscopy for polymer materials. This paper traces a limited number of highlights in the evolution of ultraviolet photoelectron spectroscopy of polymers, from the 1970s through to 2008. Also, since this issue is dedicated to Prof. Kazuhiko Seki, who has been a friend and competitor for over two decades, the author relies on some of Prof. Seki's earlier research, unpublished, on who-did-what-first. Prof. Seki's own contributions to the field, however, are discussed in other articles in this issue.

  20. Ultraviolet photoelectron spectroscopy of transient species

    International Nuclear Information System (INIS)

    Leeuw, D.M. de.

    1979-01-01

    Transient species are studied in the isolation of the gas phase using ultraviolet photoelectron spectroscopy (PES). A description of the equipment used and a discussion of some theoretical topics, which play a role in the interpretation of PE spectra, are given. Koopmans' theorem, Hartree-Fock-Slater (HFS) calculations and the sum rule are discussed. A versatile ultraviolet PE spectrometer, designed specifically for this purpose, has been built and the construction and performance of this instrument are described. (Auth.)

  1. Photoelectronic Sensor with Gold Nanoparticle Plasmon Antenna

    Science.gov (United States)

    2016-07-20

    result will open new doors for ultra-small biosensor chips integrated with multi-functional solid-state devices. 15. SUBJECT TERMS Photoelectronic Sensor...detected with the hybrid device. This result will open new doors for ultra-small biosensor chips integrated with multi-functional solid-state devices...been applied for high-sensitivity biosensors . The frequency and intensity of surface Plasmon absorption bands are sensitive to the type of material

  2. X-ray Photoelectron Spectroscopy Database (Version 4.1)

    Science.gov (United States)

    SRD 20 X-ray Photoelectron Spectroscopy Database (Version 4.1) (Web, free access)   The NIST XPS Database gives access to energies of many photoelectron and Auger-electron spectral lines. The database contains over 22,000 line positions, chemical shifts, doublet splittings, and energy separations of photoelectron and Auger-electron lines.

  3. X-Ray photoelectron Spectroscopy Applications

    Energy Technology Data Exchange (ETDEWEB)

    Engelhard, Mark H.; Droubay, Timothy C.; Du, Yingge

    2017-01-03

    With capability for obtaining quantitative elemental composition, chemical and electronic state, and overlayer thickness information from the top ~10 nm of a sample surface, X-ray Photoelectron Spectroscopy (XPS) or Electron Spectroscopy for Chemical Analysis (ESCA) is a versatile and widely used technique for analyzing surfaces. The technique is applied to a host of materials, from insulators to conductors in virtually every scientific field and sub-discipline. More recently, XPS has been extended under in-situ and operando conditions. Following a brief introduction to XPS principles and instrument components, this article exemplifies widely ranging XPS applications in material and life sciences.

  4. $X_{b}$ Search and Measurement of the $Y(1)$, $(2S)$ and $Y(3S)$ Polarization

    Energy Technology Data Exchange (ETDEWEB)

    Marino, Claudia [Karlsruhe Inst. of Technology (KIT) (Germany)

    2009-10-30

    There are two studies presented in this analysis. The rst one is the measurement of the Υ(1S), Υ(2S) and Υ(3S) polarization in two orthogonal frames: the helicity and the Collins-Soper frame. The second is the search for a possible bottom counterpart of the X(3872) which would show up as a narrow resonance in the Υ(1S)π+ π- nal state.

  5. Graphene Membranes for Atmospheric Pressure Photoelectron Spectroscopy.

    Science.gov (United States)

    Weatherup, Robert S; Eren, Baran; Hao, Yibo; Bluhm, Hendrik; Salmeron, Miquel B

    2016-05-05

    Atmospheric pressure X-ray photoelectron spectroscopy (XPS) is demonstrated using single-layer graphene membranes as photoelectron-transparent barriers that sustain pressure differences in excess of 6 orders of magnitude. The graphene serves as a support for catalyst nanoparticles under atmospheric pressure reaction conditions (up to 1.5 bar), where XPS allows the oxidation state of Cu nanoparticles and gas phase species to be simultaneously probed. We thereby observe that the Cu(2+) oxidation state is stable in O2 (1 bar) but is spontaneously reduced under vacuum. We further demonstrate the detection of various gas-phase species (Ar, CO, CO2, N2, O2) in the pressure range 10-1500 mbar including species with low photoionization cross sections (He, H2). Pressure-dependent changes in the apparent binding energies of gas-phase species are observed, attributable to changes in work function of the metal-coated grids supporting the graphene. We expect atmospheric pressure XPS based on this graphene membrane approach to be a valuable tool for studying nanoparticle catalysis.

  6. 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...

  7. Saturn's polar ionospheric flows and their relation to the main auroral oval

    Directory of Open Access Journals (Sweden)

    S. W. H. Cowley

    2004-04-01

    Full Text Available We consider the flows and currents in Saturn's polar ionosphere which are implied by a three-component picture of large-scale magnetospheric flow driven both by planetary rotation and the solar wind interaction. With increasing radial distance in the equatorial plane, these components consist of a region dominated by planetary rotation where planetary plasma sub-corotates on closed field lines, a surrounding region where planetary plasma is lost down the dusk tail by the stretching out of closed field lines followed by plasmoid formation and pinch-off, as first described for Jupiter by Vasyliunas, and an outer region driven by the interaction with the solar wind, specifically by reconnection at the dayside magnetopause and in the dawn tail, first discussed for Earth by Dungey. The sub-corotating flow on closed field lines in the dayside magnetosphere is constrained by Voyager plasma observations, showing that the plasma angular velocity falls to around half of rigid corotation in the outer magnetosphere, possibly increasing somewhat near the dayside magnetopause, while here we provide theoretical arguments which indicate that the flow should drop to considerably smaller values on open field lines in the polar cap. The implied ionospheric current system requires a four-ring pattern of field-aligned currents, with distributed downward currents on open field lines in the polar cap, a narrow ring of upward current near the boundary of open and closed field lines, and regions of distributed downward and upward current on closed field lines at lower latitudes associated with the transfer of angular momentum from the planetary atmosphere to the sub-corotating planetary magnetospheric plasma. Recent work has shown that the upward current associated with sub-corotation is not sufficiently intense to produce significant auroral acceleration and emission. Here we suggest that the observed auroral oval at Saturn instead corresponds to the ring of

  8. Atomic photoelectron-spectroscopy studies using synchrotron radiation

    International Nuclear Information System (INIS)

    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

  9. Reduction of the photoelectron induced gas desorption in the PETRA vacuum system by in situ argon flow discharge cleaning

    International Nuclear Information System (INIS)

    Kouptsidis, J.; Mathewson, A.G.

    1976-09-01

    In this paper the authors calculate the photon energy distribution of the synchrotron radiation for the 5-19 GeV energy range of PETRA and from published values of the experimentally measured photoelectric yield of Al they calculate the total number of photoelectrons produced. (orig./HW) [de

  10. Advances in threshold photoelectron spectroscopy (TPES) and threshold photoelectron photoion coincidence (TPEPICO).

    Science.gov (United States)

    Baer, Tomas; Tuckett, Richard P

    2017-04-12

    The history and evolution of molecular threshold photoelectron spectroscopy and threshold photoelectron photoion coincidence spectroscopy (TPEPICO) over the last fifty years are reviewed. Emphasis is placed on instrumentation and the extraction of dynamical information about energy selected ion dissociation, not on the detailed spectroscopy of certain molecules. Three important advances have expanded greatly the power of the technique, and permitted its implementation on modern synchrotron radiation beamlines. The use of velocity focusing of threshold electrons onto an imaging detector in the 1990s simultaneously improved the sensitivity and electron energy resolution, and also facilitated the subtraction of hot electron background in both threshold electron spectroscopy and TPEPICO studies. The development of multi-start multi-stop collection detectors for both electrons and ions in the 2000s permitted the use of the full intensity of modern synchrotron radiation thereby greatly improving the signal-to-noise ratio. Finally, recent developments involving imaging electrons in a range of energies as well as ions onto separate position-sensitive detectors has further improved the collection sensitivity so that low density samples found in a variety of studies can be investigated. As a result, photoelectron photoion coincidence spectroscopy is now well positioned to address a range of challenging problems that include the quantitative determination of compositions of isomer mixtures, and the detection and spectroscopy of free radicals produced in pyrolysis or discharge sources as well as in combustion studies.

  11. Equity yields

    NARCIS (Netherlands)

    Vrugt, E.; van Binsbergen, J.H.; Koijen, R.S.J.; Hueskes, W.

    2013-01-01

    We study a new data set of dividend futures with maturities up to ten years across three world regions: the US, Europe, and Japan. We use these asset prices to construct equity yields, analogous to bond yields. We decompose the equity yields to obtain a term structure of expected dividend growth

  12. Excitation of a surface wave by an s-polarized electromagnetic wave incident upon a boundary of a dense magnetoactive plasma

    International Nuclear Information System (INIS)

    Dragila, R.; Vukovic, S.

    1988-01-01

    The properties of surfave waves that are associated with a boundary between a rare plasma and a dense magnetoactive plasma and that propagate along a dc magnetic field are investigated. It is shown that the presence of the magnetic field introduces symmetry in terms of the polarization of the incident electromagnetic wave that excites the surface waves. A surface wave excited by an incident p-polarized (s-polarized) electromagnetic wave leaks in the form of an s-polarized (p-polarized) electromagnetic wave. The rate of rotation of polarization is independent of the polarization of the incident wave. Because a surface wave can leak in the form of an s-polarized electromagnetic wave, it can also be pumped by such a wave, and conditions were found for excitation of a surface wave by an s-polarized incident electromagnetic wave

  13. X-Ray photoelectron spectroscopic investigation of phenosafranine ...

    Indian Academy of Sciences (India)

    The phenosafranine adsorbed onto the micro and mesoporous materials prepared by ion exchange method and interaction of the dye with host materials were studied by X-ray photoelectron spectroscopy to elucidate the influence of the host matrix on the binding energy of N 1s orbital. Core level N 1s X-ray photoelectron ...

  14. 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.

  15. 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.

  16. Tagging multiphoton ionization events by two-dimensional photoelectron spectroscopy

    NARCIS (Netherlands)

    de Groot, Mattijs; Broos, Jaap; Buma, Wybren Jan

    2007-01-01

    Two-dimensional photoelectron spectroscopy has been used to supply process-specific labels to multiphoton ionization events. Employing these tags, the authors can construct excitation and photoelectron spectra along predefined excitation routes in the neutral manifold and ionization routes to the

  17. 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).

  18. Photoelectron spectrometer for attosecond spectroscopy of liquids and gases.

    Science.gov (United States)

    Jordan, I; Huppert, M; Brown, M A; van Bokhoven, J A; Wörner, H J

    2015-12-01

    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.

  19. 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.

  20. Practical scaling law for photoelectron angular distributions

    International Nuclear Information System (INIS)

    Guo Dongsheng; Zhang Jingtao; Xu Zhizhan; Li Xiaofeng; Fu Panming; Freeman, R.R.

    2003-01-01

    A practical scaling law that predicts photoelectron angular distributions (PADs) is derived using angular distribution formulas which explicitly contain spontaneous emission. The scaling law is used to analyze recent PAD measurements in above-threshold ionization, and to predict results of future experiments. Our theoretical and numerical studies show that, in the non-relativistic regime and long-wavelength approximation, the shapes of PADs are determined by only three dimensionless numbers: (1) u p ≡U p /(ℎ/2π)ω, the ponderomotive number (ponderomotive energy in units of laser photon energy); (2) ε b ≡E b /(ℎ/2π)ω, the binding number (atomic binding energy in units of the laser photon energy); (3) j, the absorbed-photon number. The scaling law is shown to be useful in predictions of results from strong-field Kapitza-Dirac effect measurements; specifically, the application of this scaling law to recently reported Kapitza-Dirac diffraction is discussed. Possible experimental tests to verify the scaling law are suggested

  1. Bimolecular reaction dynamics from photoelectron spectroscopy of negative ions

    International Nuclear Information System (INIS)

    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 → 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 + CH 3 0H,F + C 2 H 5 OH,F + OH and F + H 2 . 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( 3 P, 1 D) + HF and F + H 2 . 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 + H 2 system, comparisons with three-dimensional quantum calculations are made

  2. Photoelectron spectroscopy of boron aluminum hydride cluster anions

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Haopeng; Zhang, Xinxing; Ko, Yeon Jae; Gantefoer, Gerd; Bowen, Kit H., E-mail: kbowen@jhu.edu, E-mail: kiran@mcneese.edu [Department of Chemistry, Johns Hopkins University, Baltimore, Maryland 21218 (United States); Li, Xiang [Center for Space Science and Technology, University of Maryland–Baltimore County, Baltimore, Maryland 21250 (United States); Kiran, Boggavarapu, E-mail: kbowen@jhu.edu, E-mail: kiran@mcneese.edu [Department of Chemistry and Physics, McNeese State University, Lake Charles, Louisiana 70609 (United States); Kandalam, Anil K. [Department of Physics, West Chester University, West Chester, Pennsylvania 19383 (United States)

    2014-04-28

    Boron aluminum hydride clusters are studied through a synergetic combination of anion photoelectron spectroscopy and density functional theory based calculations. Boron aluminum hydride cluster anions, B{sub x}Al{sub y}H{sub z}{sup −}, were generated in a pulsed arc cluster ionization source and identified by time-of-flight mass spectrometry. After mass selection, their photoelectron spectra were measured by a magnetic bottle-type electron energy analyzer. The resultant photoelectron spectra as well as calculations on a selected series of stoichiometries reveal significant geometrical changes upon substitution of aluminum atoms by boron atoms.

  3. Photoelectron spectroscopy of boron aluminum hydride cluster anions.

    Science.gov (United States)

    Wang, Haopeng; Zhang, Xinxing; Ko, Yeon Jae; Gantefoer, Gerd; Bowen, Kit H; Li, Xiang; Kiran, Boggavarapu; Kandalam, Anil K

    2014-04-28

    Boron aluminum hydride clusters are studied through a synergetic combination of anion photoelectron spectroscopy and density functional theory based calculations. Boron aluminum hydride cluster anions, BxAlyHz(-), were generated in a pulsed arc cluster ionization source and identified by time-of-flight mass spectrometry. After mass selection, their photoelectron spectra were measured by a magnetic bottle-type electron energy analyzer. The resultant photoelectron spectra as well as calculations on a selected series of stoichiometries reveal significant geometrical changes upon substitution of aluminum atoms by boron atoms.

  4. YIELD INDICATORS

    African Journals Online (AJOL)

    International Institute of Tropical Agriculture, East and Southern Africa, Centre, P.O. Box 7878,. Kampala, Uganda. Makerere ... would have great potential in terms of human nutrition. Storage root yield , the ... Inter-relationships among traits and path analysis for yield components of cassava. 604 collected included plant ...

  5. The Electron-Phonon Interaction as Studied by Photoelectron Spectroscopy

    International Nuclear Information System (INIS)

    Lynch, D.W.

    2004-01-01

    With recent advances in energy and angle resolution, the effects of electron-phonon interactions are manifest in many valence-band photoelectron spectra (PES) for states near the Fermi level in metals

  6. Repeatable intensity calibration of an X-ray photoelectron spectrometer

    International Nuclear Information System (INIS)

    Seah, M.P.; Spencer, S.J.

    2006-01-01

    Ten years ago, NPL developed an infrastructure for calibrating the intensity response functions of electron spectrometers for Auger electron and for X-ray photoelectron spectroscopies. Two software systems were developed: one for Auger electron spectrometers or for Auger electron and X-ray photoelectron spectrometers combined, and one for X-ray photoelectron spectrometers on their own; the latter being applied if no suitable electron gun is available. The system for Auger electron and X-ray photoelectron spectrometers combined has been used regularly to calibrate the Metrology Spectrometer II at NPL and experience shows that this gives an instrumental intensity consistency of 0.4% over 10 years. Evaluations have not previously been reported at this level. The system for Auger electron and X-ray photoelectron spectrometers combined is used here in preference to the system solely for X-ray photoelectron spectrometers since it is more robust to the sample condition and can be used over a wider energy range. These issues, and how observed variations in the instrument intensity response may arise, are explained

  7. Full k-space visualization of photoelectron diffraction

    International Nuclear Information System (INIS)

    Denlinger, J.D.; Rotenberg, E.; Kevan, S.D.; Tonner, B.P.

    1997-01-01

    The development of photoelectron holography has promoted the need for larger photoelectron diffraction data sets in order to improve the quality of real-space reconstructed images (by suppressing transformational artifacts and distortions). The two main experimental and theoretical approaches to holography, the transform of angular distribution patterns for a coarse selection of energies or the transform of energy-scanned profiles for several directions, represent two limits to k-space sampling. The high brightness of third-generation soft x-ray synchrotron sources provides the opportunity to rapidly measure large high-density x-ray photoelectron diffraction (XPD) data sets with approximately uniform k-space sampling. In this abstract, the authors present such a photoelectron data set acquired for Cu 3p emission from Cu(001). Cu(001) is one of the most well-studied systems for understanding photoelectron diffraction structure and for testing photoelectron holography methods. Cu(001) was chosen for this study in part due to the relatively inert and unreconstructed clean surface, and it served to calibrate and fine-tune the operation of a new synchrotron beamline, electron spectrometer and sample goniometer. In addition to Cu, similar open-quotes volumeclose quotes XPD data sets have been acquired for bulk and surface core-level emission from W(110), from reconstructed Si(100) and Si(111) surfaces, and from the adsorbate system of c(2x2) Mn/Ni(100)

  8. 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.

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

    International Nuclear Information System (INIS)

    Liu, Yuzhu; Knopp, Gregor; Qin, Chaochao; Gerber, Thomas

    2015-01-01

    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 2 to S 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 2 state to the vibrationally hot S 1 state. The second relaxation process is attributed to the redistributions and depopulation of secondarily populated high vibronic S 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

  10. Two-dimensional s-polarized solitary waves in plasmas. II. Stability, collisions, electromagnetic bursts, and post-soliton evolution

    International Nuclear Information System (INIS)

    Sanchez-Arriaga, G.; Lefebvre, E.

    2011-01-01

    The dynamics of two-dimensional s-polarized solitary waves is investigated with the aid of particle-in-cell (PIC) simulations. Instead of the usual excitation of the waves with a laser pulse, the PIC code was directly initialized with the numerical solutions from the fluid plasma model. This technique allows the analysis of different scenarios including the theoretical problems of the solitary wave stability and their collision as well as features already measured during laser-plasma experiments such as the emission of electromagnetic bursts when the waves reach the plasma-vacuum interface, or their expansion on the ion time scale, usually named post-soliton evolution. Waves with a single density depression are stable whereas multihump solutions decay to several waves. Contrary to solitons, two waves always interact through a force that depends on their relative phases, their amplitudes, and the distance between them. On the other hand, the radiation pattern at the plasma-vacuum interface was characterized, and the evolution of the diameter of different waves was computed and compared with the ''snow plow'' model.

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

    Science.gov (United States)

    Khuseynov, Dmitry; Blackstone, Christopher C; Culberson, Lori M; Sanov, Andrei

    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(-) 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.

  12. 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.

  13. A model of the plasma flow and current in Saturn's polar ionosphere under conditions of strong Dungey cycle driving

    Directory of Open Access Journals (Sweden)

    C. M. Jackman

    2006-05-01

    Full Text Available We propose a simple model of the flow and currents in Saturn's polar ionosphere. This model is motivated by theoretical reasoning, and guided quantitatively by in situ field and flow data from space missions, ground-based IR Doppler measurements, and Hubble Space Telescope images. The flow pattern consists of components which represent (1 plasma sub-corotation in the middle magnetosphere region resulting from plasma pick-up and radial transport from internal sources; (2 the Vasyliunas-cycle of internal plasma mass-loss down the magnetospheric tail at higher latitudes; and (3 the polar Dungey-cycle flow driven by the solar wind interaction. Upstream measurements of the interplanetary magnetic field (IMF indicate the occurrence of both extended low-field rarefaction intervals with essentially negligible Dungey-cycle flow, and few-day high-field compression regions in which the Dungey-cycle voltage peaks at a few hundred kV. Here we model the latter conditions when the Dungey-cycle is active, advancing on previous axi-symmetric models which may be more directly applicable to quiet conditions. For theoretical convenience the overall flow pattern is constructed by adding together two components - a purely rotational flow similar to previous axi-symmetric models, and a sun-aligned twin vortex representing the dawn-dusk asymmetry effects associated with the Vasyliunas-and Dungey-cycle flows. We calculate the horizontal ionospheric current associated with the flow and the field-aligned current from its divergence. These calculations show that a sheet of upward-directed field-aligned current flows at the boundary of open field lines which is strongly modulated in local-time by the Dungey-cycle flows. We then consider implications of the field-aligned current for magnetospheric electron acceleration and aurorae using two plasma source populations (hot outer magnetospheric electrons and cool dense magnetosheath electrons. Both sources display a

  14. Photoelectron diffraction and holography: Present status and future prospects

    Energy Technology Data Exchange (ETDEWEB)

    Fadley, C.S. [California Univ., Davis, CA (United States). Dept. of Physics]|[Lawrence Berkeley Lab., CA (United States); Thevuthasan, S. [California Univ., Davis, CA (United States). Dept. of Physics; Kaduwela, A.P. [Lawrence Berkeley Lab., CA (United States)] [and others

    1993-07-01

    Photoelectron diffraction and photoelectron holography, a newly developed variant of it, can provide a rich range of information concerning surface structure. These methods are sensitive to atomic type, chemical state, and spin state. The theoretical prediction of diffraction patterns is also well developed at both the single scattering and multiple scattering levels, and quantitative fits of experiment to theory can lead to structures with accuracies in the {plus_minus}0.03 {Angstrom} range. Direct structural information can also be derived from forward scattering in scanned-angle measurements at higher energies, path length differences contained in scanned-energy data at lower energies, and holographic inversions of data sets spanning some region in angle and energy space. Diffraction can also affect average photoelectron emission depths. Circular dichroism in core-level emission can be fruitfully interpreted in terms of photoelectron diffraction theory, as can measurements with spin-resolved core-spectra, and studies of surface magnetic structures and phase transitions should be possible with these methods. Synchrotron radiation is a key element of fully utilizing these techniques.

  15. Angular distribution of photoelectrons from atomic oxygen, nitrogen, and carbon

    Science.gov (United States)

    Manson, S. T.; Kennedy, D. J.; Starace, A. F.; Dill, D.

    1974-01-01

    The angular distribution of photoelectrons from atomic oxygen is investigated using Hartree-Fock (HF) wave functions. The correct formulation is used to compare HS and HF results. Agreement between these results is good and the HS calculations have been extended to atomic nitrogen and carbon as well.

  16. X-ray photoelectron spectroscopy (XPS) studies of rhenium catalyst

    International Nuclear Information System (INIS)

    Mohd Ambar Yarmo; Che Seman Mahmood

    2000-01-01

    Rhenium oxide on alumina (Re 2 O 7 /Al 2 O 3 ) is a very active catalyst system for olefin metathesis reaction. The catalyst can be prepared by wet impregnation of ammonium perrhenate (NH 4 ReO 4 ) solution onto alumina (γ-AI 2 O 3 ) support followed by drying and calcination in air. In this study, rhenium catalysts at different treatment conditions namely active, non-active and during propylene metathesis reaction were investigated using X-ray photoelectron spectroscopy (XPS) technique. Analysis of O 1s , photoelectron peak shows that some chemical interaction between rhenium oxides and the support have been established through Re-O-Al linkage. Analysis of Re 4f7/2 photoelectron peak by using a systematic deconvolution procedure, shows that the metal was in a mixed and varied oxidation states from Re(IV) to Re(VII) depending on their treatment condition. The presence of the metal-carbene complex, the reaction intermediate, could possibly be observed by analysing the C 1s , photoelectron peak. However, a much higher vacuum (i.e. 10 -10 - 10 -11 torr) is needed in the spectroscopy system in order to have the improved detection sensitivity. (Author)

  17. 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

  18. 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 ...

  19. 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.

  20. The PhotoElectron Boundary as observed by MAVEN instruments

    Science.gov (United States)

    Garnier, P.; Steckiewicz, M.; Mazelle, C. X.; Xu, S.; Mitchell, D. L.; Holmberg, M.; Halekas, J. S.; Andersson, L.; Brain, D.; Connerney, J. E. P.; Espley, J. R.; Lillis, R. J.; Luhmann, J. G.; Savaud, J. A.; Jakosky, B. M.

    2017-12-01

    Photoelectron peaks in the 20-30 eV energy range are commonly observed in planetary atmospheres (Earth, Mars, Titan...), produced by the intense photoionization from solar 30.4 nm photons. At Mars, these photoelectrons result from the ionization of CO2 and O atmospheric neutrals, and are known to escape the planet down its tail, making them tracers for the atmospheric escape (Frahm et al., 2006). Furthermore, their presence or absence allows us to define the so-called PhotoElectron Boundary (PEB), that separates the sunlit photoelectron-dominated ionosphere from the solar wind controlled environment, as initially observed by the Mars Global Surveyor (MGS) MAG/ER instrument (Mitchell et al. (2000, 2001). We provide here a detailed statistical analysis of the location and properties of the PEB based on the Mars Atmosphere and Volatile Evolution (MAVEN) mission electron and magnetic field data. Our dataset includes 1696 dayside PEB crossings obtained from September 2014 until May 2016 (the observations of escaping photoelectrons in the wake being not included). The PEB appears as mostly sensitive to the solar wind dynamic and crustal magnetic fields pressures, for which a quantitative dependance is derived and compared with two other important boundaries : the bow shock and magnetic pileup boundary. The PEB altitude is highly variable, leading to a variable wake cross section for escape (up to +- 50%), which is important for deriving global escape rates from in situ photoelectron escape rates. The PEB is not always sharp, and is, despite a strong variability, characterized on average by : a magnetic field topology typical for the edge of the Magnetic Pile Up Region above it, more field aligned fluxes above than below, and a clear change of the altitude dependence of both electron fluxes and total density (that appears different from the ionopause). The PEB thus appears as a transition region between two plasma and field configurations which is determined by the

  1. 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

  2. Effect of plasma instability on F region photoelectron distributions

    International Nuclear Information System (INIS)

    Bloomberg, H.W.

    1975-01-01

    Ionospheric suprathermal photoelectrons have relatively large cross sections for selected energies. In particular, electrons with energies of about 2.5 eV strongly excite nitrogen vibrational modes, while metastable states of oxygen are excited at about 5 eV. Thus an energy distribution based on chemical kinetic considerations gives rise to a maximum at around 4 eV in the F region below 250 km. However, rocket experiments have shown that the expected peaks in the flux spectrum are relatively weak. This discrepancy is explained by the development of a linear instability leading to a wave-particle interaction. the linear mode is driven by the photoelectrons near the 4-eV maximum in the presence of a magnetic field. The effect is shown to be ineffective at sufficiently low altitudes, where collisionless theory fails

  3. 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.

  4. Effect of plasma instability on F region photoelectron distributions

    International Nuclear Information System (INIS)

    Bloomberg, H.W.

    1975-01-01

    Ionospheric suprathermal photoelectrons have relatively large cross sections for selected energies. In particular, electrons with energies of about 2.5 eV strongly excite nitrogen vibrational modes, while metastable states of oxygen are excited at about 5 eV. Thus an energy distribution based on chemical kinetic considerations give rise to a maximum at around 4 eV in the F region below 250 km. However, rocket experiments have shown that the expected peaks in the flux spectrum are relatively weak. This discrepancy is explained by the development of a linear instability leading to a wave-particle interaction. The linear mode is driven by the photoelectrons near the 4-eV maximum in the presence of a magnetic field. The effect is shown to be ineffective at sufficiently low altitudes, where collisionless theory fails. (auth)

  5. High resolution photoelectron spectroscopy of clusters of Group V elements

    International Nuclear Information System (INIS)

    Wang, Lai-sheng; Niu, B.; Lee, Y.T.; Shirley, D.A.

    1989-07-01

    High resolution HeI (580 angstrom) photoelectron spectra of As 2 , As 4 , and P 4 were obtained with a newly-built high temperature molecular beam source. Vibrational structure was resolved in the photoelectron spectra of the three cluster species. The Jahn-Teller effect is discussed for the 2 E and 2 T 2 states of P 4 + and As 4 + . As a result of the Jahn-Teller effect, the 2 E state splits into two bands, and the 2 T 2 state splits into three bands, in combination with the spin-orbit effect. It was observed that the ν 2 normal vibrational mode was involved in the vibronic interaction of the 2 E state, while both the ν 2 and ν 3 modes were active in the 2 T 2 state. 26 refs., 5 figs., 3 tabs

  6. Photoelectron spectroscopy via electronic spectroscopy of molecular ions

    International Nuclear Information System (INIS)

    Khan, Z.H.

    1990-01-01

    In this work, a new aspect of the correlation between optical and photoelectron spectra is discussed on the basis of which the first ionization potentials of condensed-ring aromatics can be estimated from certain features in the electronic spectra of their positive ions. Furthermore, it is noticed that the first IP's are very sensitive to molecular size as the latter's inclusion in the regression formulas improves the results considerably. Once the first ionization potential for a molecule is determined, its higher IP's may be computed if the lower-energy electronic bands for its cation are known. This procedure is especially useful for such systems whose uv photoelectron spectra are unknown. (author). 11 refs, 10 figs, 1 tab

  7. Molecular photoelectron holography with circularly polarized laser pulses.

    Science.gov (United States)

    Yang, Weifeng; Sheng, Zhihao; Feng, Xingpan; Wu, Miaoli; Chen, Zhangjin; Song, Xiaohong

    2014-02-10

    We investigate the photoelectron momentum distribution of molecular-ion H2+driven by ultrashort intense circularly polarized laser pulses. Both numerical solutions of the time-dependent Schrödinger equation (TDSE) and a quasiclassical model indicate that the photoelectron holography (PH) with circularly polarized pulses can occur in molecule. It is demonstrated that the interference between the direct electron wave and rescattered electron wave from one core to its neighboring core induces the PH. Moreover, the results of the TDSE predict that there is a tilt angle between the interference pattern of the PH and the direction perpendicular to the molecular axis. Furthermore, the tilt angle is sensitively dependent on the wavelength of the driven circularly polarized pulse, which is confirmed by the quasiclassical calculations. The PH induced by circularly polarized laser pulses provides a tool to resolve the electron dynamics and explore the spatial information of molecular structures.

  8. Photoelectron spectroscopic study of carbon aluminum hydride cluster anions

    Science.gov (United States)

    Zhang, Xinxing; Wang, Haopeng; Ganteför, Gerd; Eichhorn, Bryan W.; Kiran, Boggavarapu; Bowen, Kit H.

    2016-10-01

    Numerous previously unknown carbon aluminum hydride cluster anions were generated in the gas phase, identified by time-of-flight mass spectrometry and characterized by anion photoelectron spectroscopy, revealing their electronic structure. Density functional theory calculations on the CAl5-9H- and CAl5-7H2- found that several of them possess unusually high carbon atom coordination numbers. These cluster compositions have potential as the basis for new energetic materials.

  9. 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).

  10. Ionization, photoelectron dynamics and elastic scattering in relativistic, ultra-strong field

    Science.gov (United States)

    Luo, Sui

    wave-function spread. A relativistic rescattering enhancement occurs at 2 x 1018 W/cm2, commensurate with relativistic motion of a classical electron in a single field cycle. The good comparison between the results with available experiments suggests the theory approach is well suited to modeling scattering in the ultrastrong intensity regime. We investigate the elastic scattering process as it changes from strong to ultrastrong fields with the photoelectron angular distributions from Ne, Ar, and Xe. Noble gas species with Hartree-Fock scattering potentials show a reduction in elastic rescattering with the increasing energy of ultrastrong fields. It is found that as one increases the returning photoelectron energy, rescattering becomes the dominating mechanism behind the yield distribution as the emission angle for all the species extends from 0° to 90°. The relativistic effects and the magnetic field do not change the angular distribution until one is well into the Gamma r "1 regime where the Lorentz defection significantly reduces the yield. As we proceed to the highest energy, the angular emission range narrows as the mechanism changes over to backscattering into narrow angles along the electric field.

  11. 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-.

  12. Angle-resolved photoelectron cross section of CF4

    International Nuclear Information System (INIS)

    Carlson, T.A.; Fahlman, A.; Svensson, W.A.; Krause, M.O.; Whitley, T.A.; Grimm, F.A.; Piancastelli, M.N.; Taylor, J.W.

    1984-01-01

    Partial photoelectron cross sections sigma and angular distribution parameters β were obtained for the first five valence orbitals in CF 4 : 1t 1 , 4t 2 , 1e, 3t 2 , and 4a 1 , as a function of photon energy from 17 to 70 eV. These data were taken with the aid of angle-resolved photoelectron spectroscopy and synchrotron radiation. The results were compared with earlier data on CCl 4 . Substantial differences were found. These are explained partly in terms of the absence of a Cooper minimum with a fluorine compound as opposed to the presence of a Cooper minimum with chlorine compounds and partly in terms of the position of shape resonances. Data on CF 4 were also compared with recent calculations of Stephens et al., who used the multiple-scattering Xα method. Structure in the photoelectron spectrum of CF 4 lying on the low energy side of the third band was identified as due to autoionization and evidence is given as to its specific nature

  13. Imaging photoelectron photoion coincidence spectroscopy with velocity focusing electron optics

    International Nuclear Information System (INIS)

    Bodi, Andras; Johnson, Melanie; Gerber, Thomas; Gengeliczki, Zsolt; Sztaray, Balint; Baer, Tomas

    2009-01-01

    An imaging photoelectron photoion coincidence spectrometer at the vacuum ultraviolet (VUV) beamline of the Swiss Light Source is presented and a few initial measurements are reported. Monochromatic synchrotron VUV radiation ionizes the cooled or thermal gas-phase sample. Photoelectrons are velocity focused, with better than 1 meV resolution for threshold electrons, and also act as start signal for the ion time-of-flight analysis. The ions are accelerated in a relatively low, 40-80 V cm -1 field, which enables the direct measurement of rate constants in the 10 3 -10 7 s -1 range. All electron and ion events are recorded in a triggerless multiple-start/multiple-stop setup, which makes it possible to carry out coincidence experiments at >100 kHz event frequencies. As examples, the threshold photoelectron spectrum of the argon dimer and the breakdown diagrams for hydrogen atom loss in room temperature methane and the chlorine atom loss in cold chlorobenzene are shown and discussed.

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

    International Nuclear Information System (INIS)

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

    2011-01-01

    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 photo emitted 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. (authors)

  15. Precise analysis of the metal package photomultiplier single photoelectron spectra

    International Nuclear Information System (INIS)

    Chirikov-Zorin, I.E.; Fedorko, I.; Sykora, I.; Tokar, S.; Menzione, A.

    2000-01-01

    A deconvolution method based on a sophisticated photomultiplier response function was used to analyse the compact metal package photomultiplier spectra taken in single photoelectron mode. The spectra taken by Hamamtsu R5600 and R5900 photomultipliers have been analysed. The detailed analysis shows that the method appropriately describes the process of charge multiplication in these photomultipliers in a wide range of working regimes and the deconvoluted parameters are established with about 1% accuracy. The method can be used for a detailed analysis of photomultiplier noise and for calibration purposes

  16. Accuracy of single photoelectron time spread measurement of fast photomultipliers

    International Nuclear Information System (INIS)

    Leskovar, B.

    1975-01-01

    The accuracy of time spread measurements of fast photomultipliers was investigated, using single photoelectrons. The effect of the finite light pulse width on the measurement accuracy was determined and discussed. Experimental data were obtained on a special measuring system for light pulse widths ranging from 200 psec to 10 nsec, using fast photomultipliers 8850 and C31024 with optimized operating conditions for minimum transit time spread. A modified exponential function expression and curve-fitting parameters are given, which fit closely the experimentally obtained data over a wide dynamic range of light pulse widths. (U.S.)

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

    DEFF Research Database (Denmark)

    Baggesen, Jan Conrad; Madsen, Lars Bojer

    2009-01-01

    an analytical model based on an approximate solution to Boltzmann's transport equation to account for the amount and energy distribution of these secondary electrons. Our theory is in good agreement with the electron spectrum found in a recent attosecond streaking experiment. To suppress the background and gain......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...

  18. Time-resolved photoelectron spectroscopy of nitrobenzene and its aldehydes

    Science.gov (United States)

    Schalk, Oliver; Townsend, Dave; Wolf, Thomas J. A.; Holland, David M. P.; Boguslavskiy, Andrey E.; Szöri, Milan; Stolow, Albert

    2018-01-01

    We report the first femtosecond time-resolved photoelectron spectroscopy study of 2-, 3- and 4-nitrobenzaldehyde (NBA) and nitrobenzene (NBE) in the gas phase upon excitation at 200 nm. In 3- and 4-NBA, the dynamics follow fast intersystem crossing within 1-2 picoseconds. In 2-NBA and NBE, the dynamics are faster (∼ 0.5 ps). 2-NBA undergoes hydrogen transfer similar to solution phase dynamics. NBE either releases NO2 in the excited state or converts internally back to the ground state. We discuss why these channels are suppressed in the other nitrobenzaldehydes.

  19. Automation of an X-ray photoelectron spectrometer

    International Nuclear Information System (INIS)

    Ashury, M.R.

    2003-02-01

    The Institute of Solid State Physics of the Vienna University of Technology is established with an X-ray Photoelectron Spectrometer Kratos XSAM 800. In its original state the instrument enables measurements of photoelectron spectra in a semiautomatical mode. After mounting of the specimen an eventual surface cleaning by argon ion sputtering is possible. Next steps are setting of x-ray tube high voltage and current, start energy and energy range of spectrum and time of measurement. Data are obtained by an x-t plotter and evaluations are performed from the registration charts. If necessary, measured spectra have to be digitized by means of a scanner. In the Introduction of this thesis the principle of X-ray photoelectron spectrometry is treated including a number of practical examples. It shows that an automation allows an extension of the performance of the instrument. Details are remote controlled experiments, wider energy ranges with improved energy resolution. Furthermore, the digitized data treatment enables background subtration, determination of line positions and integrated signal strengths, and is the detection of lowlevel of lines (the peak with lowamplitude) possible. A further advantage is the computer assisted documentation and comparison of results from different specimens. After this description of the essential requirements different possible solutions of an automation are discussed. Thus, it is decided to develop a completely new hardware for a perfect control of the spectrometer. A further decision is to be made on the most efficient kind of micro processor. From the considerations follows a completely new control board with a transputer as multi tasking processor. The complete control unit consists of a digital system, an analog system and a power unit. The digital system controls settings and spectra accumulation and includes the transputer board, the pc-link card, the i/o-card and the step scanning control board. The analog system controls the

  20. Photoelectron Spectroscopy of 4-Bromochlorobenzene Dimer and Trimer Anions

    International Nuclear Information System (INIS)

    Kim, Namdoo

    2013-01-01

    I investigated the electron attachment to 4-BCB dimer and trimer anions using anion photoelectron spectroscopy and theoretical calculations. I found that an excess electron can be delocalized to these clusters through extended π-network. However, the nature of the ion core is different for the dimer and trimer. For the heterodimer anions, the geometry is determined by the differences in electronegativity of the molecules. Dimer anions with a large electronegativity difference have T-shaped geometries and those with a small electronegativity difference have PD geometries

  1. Polarization of photoelectrons produced from atoms by synchrotron radiation

    International Nuclear Information System (INIS)

    Hughes, V.W.; Lu, D.C.; Huang, K.N.

    1981-01-01

    The polarization of photoelectrons from stoms has proved to be an important tool for studying correlation effects in atoms, as well as relativistic effects such as the spin-orbit interaction. Extensive experimental and theoretical studies have been made of the Fano effect, which is the production of polarized electrons by photoionization of unpolarized atoms by circularly polarized light. The experiments have dealt mostly with alkali atoms and with photon energies slightly above the ionization thresholds. Measurements that could be made to utilize polarized radiation are discussed

  2. Determination of the photoelectron reference plane in nanostructured surfaces

    International Nuclear Information System (INIS)

    Lobo-Checa, Jorge; Mugarza, Aitor; Ortega, Jose Enrique; Michel, Enrique G

    2011-01-01

    In angle-resolved photoemission (ARPES) from crystalline solids, wave-vector conservation applies to the two-dimensional (2D) surface, which may thus be defined as the reference plane in ARPES. We investigate whether such reference varies for photoemitted electrons in nanometer-sized systems that expose different crystal planes. To this aim, we exploit the structural tunability of the Ag/Cu(223) system which is capable of offering surfaces with periodic arrays of nanofacets of varying size and orientation. A thorough, photon-energy-dependent analysis of the surface states confined to such nanostructures is performed comparing different reference planes for photoemitted electrons. Assuming the premise that k || must be a good quantum number for 2D states, we conclude that the (final state) photoelectron reference direction is not the average optical direction but the local facet that confines the (initial state) surface electrons. Moreover, in the general case of nanostructured systems with uneven surfaces, we show how the photoelectron reference plane can be empirically determined through such a photon-energy-dependent ARPES analysis. (paper)

  3. 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.

  4. Interpretation of intensities in electron-momentum and photoelectron spectroscopies

    International Nuclear Information System (INIS)

    McCarthy, I.E.

    1984-06-01

    Relative intensities for the photoelectron reaction on atoms and molecules are not related to structure calculations in the same way as those for the noncoplanar symmetric (e,2e) reaction. The photoelectron dipole matrix element is dependent on recoil momentum only through its unique relationship to the photon energy and is much harder to calculate for chemically-interesting momenta. Relative intensities for binary (e,2e) reactions are independent of total energy at high enough energies and strongly dependent on symmetry and recoil momentum, for which an intensity profile can be measured for values starting at zero. In comparing with structure calculations, binary (e,2e) intensities for low recoil momentum may be compared directly with pole strengths in calculations of the one-electron Green's function or corresponding configuration-interaction calculations. In the case of states within a single symmetry manifold the relative intensities will be independent of recoil momentum up to some maximum, usually at least a few atomic units

  5. 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)

  6. 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.

  7. Using photoelectron diffraction to determine complex molecular adsorption structures

    International Nuclear Information System (INIS)

    Woodruff, D P

    2010-01-01

    Backscattering photoelectron diffraction, particularly in the energy-scan mode, is now an established technique for determining in a quantitative fashion the local structure of adsorbates on surfaces, and has been used successfully for ∼100 adsorbate phases. The elemental and chemical-state specificity afforded by the characteristic core level photoelectron binding energies means that it has particular advantages for molecular adsorbates, as the local geometry of inequivalent atoms in the molecule can be determined in a largely independent fashion. On the other hand, polyatomic molecules present a general problem for all methods of surface structure determination in that a mismatch of intramolecular distances with interatomic distances on the substrate surface means that the atoms in the adsorbed molecule are generally in low-symmetry sites. The quantities measured experimentally then represent an incoherent sum of the properties of each structural domain that is inequivalent with respect to the substrate point group symmetry. This typically leads to greater ambiguity or precision in the structural solutions. The basic principles of the method are described and illustrated with a simple example involving molecule/substrate bonding through only one constituent atom (TiO 2 -(110)/H 2 O). This example demonstrates the importance of obtaining quantitative local structural information. Further examples illustrate both the successes and the problems of this approach when applied to somewhat more complex molecular adsorbates.

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

    International Nuclear Information System (INIS)

    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 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

  9. Effects of spin-orbit activated interchannel coupling on dipole photoelectron angular distribution asymmetry parameters

    Energy Technology Data Exchange (ETDEWEB)

    Amusia, M Ya [Racah Institute of Physics, Hebrew University, Jerusalem 91904 (Israel); Baltenkov, A S [Arifov Institute of Electronics, Tashkent 70125 (Uzbekistan); Chernysheva, L V [A F Ioffe Physical-Technical Institute, St. Petersburg 194021 (Russian Federation); Felfli, Z [Center for Theoretical Studies of Physics Systems, Clark Atlanta University, Atlanta, GA 30314 (United States); Manson, S T [Department of Physics and Astronomy, Georgia State University, Atlanta, GA 30303 (United States); Msezane, A Z [Center for Theoretical Studies of Physics Systems, Clark Atlanta University, Atlanta, GA 30314 (United States)

    2004-02-28

    The effects of spin-orbit induced interchannel coupling on the dipole photoelectron angular asymmetry parameter {beta}{sub 3d} for Xe, Cs and Ba are explored using a modified version of the spin-polarized random phase approximation with exchange (SPRPAE) methodology. For Xe, {beta}{sub 3d{sub 5/2}} is modified somewhat by the interchannel coupling in the vicinity of the 3d{sub 3/2} {yields} {epsilon}f shape resonance, and this effect is significantly more pronounced in Cs where the resonance is larger. In Ba, however, where f-wave orbital collapse has occurred, the shape resonance has moved below threshold and the effect of interchannel coupling on {beta}{sub 3d{sub 5/2}} above the 3d{sub 3/2} threshold is negligible. But below the 3d{sub 3/2} threshold, {beta}{sub 3d{sub 5/2}} is dominated by the huge broad 3d{sub 3/2} {yields} 4f resonance.

  10. 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

  11. 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

  12. Attosecond photoelectron spectroscopy of electron transport in solids

    International Nuclear Information System (INIS)

    Magerl, Elisabeth

    2011-01-01

    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

  13. Determination of light yield from weak scintillations

    International Nuclear Information System (INIS)

    Mandzhukov, I.G.; Mandzhukova, B.V.

    1987-01-01

    Simulation of amplitude distribution of weak scintillation pulses by Puasson distribution is suggestd, if average number of photoelectrons collected on the first dinode of the photomultiplier is of the order of 1. The method permits to determine scintillation yield even in those cases, when the photomultiplier does not have a maximum in monoelectron pulse distribution. Scintillation yields of some aqueous solutions of sodium salicylate and aromatic solvents (benzene, toluene, xylol) at inner α-particle irradiation are determined. It is observed from the given results that efficiency of 239 Pu α-particle detection for aqueous solutions of sodium salicylate with 10% concentration is rather high; it makes up 0.94. They may appear useful for applied problems, paticularly, for measuring α-radiation

  14. Photoelectron studies of autoionizing Rydberg states in HCl

    International Nuclear Information System (INIS)

    White, M.G.; Grover, J.R.

    1985-01-01

    The results of a systematic investigation of electronically autoionizing Rydberg states in HCl are discussed. Vibrationally resolved photoelectron spectroscopy was used to map out the non-radiative decay of vibronic levels of 3psigma → n(/sub d//sup s/)sigma Rydberg states converging to the A 2 Σ + (3psigma) -1 excited ionic state. The observed vibrational distributions of the resulting X 2 PI(1π) -1 ionic state are compared with the results of model calculations of Terwilliger and Smith based on spectral analysis of the absorption spectrum. Overall, the X 2 PI vibrational branching ratios are found to be in only rough qualitative agreement with the calculations and these results are discussed in relation to the approximations involved. 18 refs., 4 figs., 1 tab

  15. Measurement of the Photoelectron Detection Efficiency of the HPD Anode

    CERN Document Server

    Carson, L; Soler, P

    2009-01-01

    This paper reports on measurements carried out on the Hybrid Photon Detectors (HPDs) of the LHCb RICH detectors. The purpose of these tests is to determine the photoelectron detection efficiency $\\eta$ of the HPD anode. Knowledge of $\\eta$ is required for an accurate simulation of the RICH detectors. It is found that this efficiency is $(93.3\\pm0.7)\\%$ for a 50 ns digital readout window, and $(87.9\\pm1.4)\\%$ for a 25 ns digital readout window. The 25 ns result exceeds the LHCb-RICH requirement of 85\\%, and is in agreement both with direct $\\eta$ measurements using preseries HPDs, and with indirect measurements from testbeams using preseries and production HPDs.

  16. X-ray photoelectron spectra of γ-irradiated perfluorobenzene

    International Nuclear Information System (INIS)

    Sunder, S.; Sagert, N.H.; Wood, D.D.; Miller, N.H.

    1990-01-01

    The effect of γ-radiolysis on perfluorobenzene (PFB) was investigated using low-temperature X-ray photoelectron spectroscopy (XPS). PFB was irradiated in fluorine-passivated nickel cells using Co 60 γ-rays in an Atomic Energy of Canada Limited Gammacell at a dose rate of about 2.6 Gy·s -1 and for a total dose of about 50 kGy. The γ-radiolysis of PFB not only results in cross-linkage but also in the formation of saturated carbon centers in the PFB, as indicated by the presence of CF 2 and CF 3 groups. The relative abundance of CF, CF 2 and CF 3 groups, in the irradiated PFB, was estimated to be about 86, 9 and 5%, respectively

  17. Negative ion photoelectron spectroscopy of SeO-

    International Nuclear Information System (INIS)

    Coe, J.V.; Snodgrass, J.T.; Freidhoff, C.B.; McHugh, K.M.; Bowen, K.H.

    1985-01-01

    Negative ion photoelectron spectroscopy (NIPES) involves a kinetic energy analysis of electrons which are photodetached when a mass selected beam of negative ions is crossed with a fixed frequency laser beam. The photodetachment spectra of SeO - displays transitions from the X 2 PI state of SeO - to both the X 3 Σ - and a 1 Δ states of SeO. The singlet-triplet splitting of SeO is readily observable since selection rules regarding spin do not apply in the bound to free state process of photodetachment. The electron affinity of SeO and the negative ion potential parameters of SeO - have been determined

  18. High temperature and high resolution uv photoelectron spectroscopy using supersonic molecular beams

    International Nuclear Information System (INIS)

    Wang, Lai-Sheng; Reutt-Robey, J.E.; Niu, B.; Lee, Y.T.; Shirley, D.A.

    1989-07-01

    A high temperature molecular beam source with electron bombardment heating has been built for high resolution photoelectron spectroscopic studies of high temperature species and clusters. This source has the advantages of: producing an intense, continuous, seeded molecular beam, eliminating the interference of the heating mechanism from the photoelectron measurement. Coupling the source with our hemispherical electron energy analyzer, we can obtain very high resolution HeIα (584 angstrom) photoelectron spectra of high temperature species. Vibrationally-resolved photoelectron spectra of PbSe, As 2 , As 4 , and ZnCl 2 are shown to demonstrate the performance of the new source. 25 refs., 8 figs., 1 tab

  19. Effective lactation yield

    NARCIS (Netherlands)

    Kok, Akke; Middelaar, van C.E.; Engel, B.; Knegsel, van A.T.M.; Hogeveen, H.; Kemp, B.; Boer, de I.J.M.

    2016-01-01

    To compare milk yields between cows or management strategies, lactations are traditionally standardized to 305-d yields. The 305-d yield, however, gives no insight into the combined effect of additional milk yield before calving, decreased milk yield after calving, and a possible shorter calving

  20. 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.

  1. Photoelectron angular distributions from the ionization of xenon Rydberg states by midinfrared radiation

    NARCIS (Netherlands)

    Huismans, Y.; Rouzee, A.; Gijsbertsen, A.; Logman, Pswm; Lepine, F.; Cauchy, C.; Zamith, S.; Stodolna, A. S.; Jungmann, J. H.; Bakker, J. M.; G. Berden,; Redlich, B.; van der Meer, A. F. G.; Schafer, K. J.; Vrakking, M. J. J.

    2013-01-01

    Angle-resolved photoelectron spectra, resulting from the strong-field ionization of atoms or molecules, carry a rich amount of information on ionization pathways, electron dynamics, and the target structure. We have investigated angle-resolved photoelectron spectra arising from the nonresonant

  2. 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...

  3. 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.

  4. Depth-profiling using X-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Pijolat, M.; Hollinger, G.

    1980-12-01

    The possibilities of X-ray photoelectron spectroscopy (or ESCA) for depth-profiling into shallow depths (approximately 10-100 A) have been studied. The method of ion-sputtering removal has first been investigated in order to improve its depth-resolution (approximately 50-150 A). A procedure which eliminates the effects due to the resolution function of the instrumental probe (analysed depth approximately 50 A) has been settled; but it is not yet sufficient, and the sputter - broadening due to the ion-induced damages must be taken into account (broadening function approximately 50 A for approximately 150 A removal). Because of serious difficulties in estimating the broadening function an alternative is to develop non destructive methods, so a new method based on the dependence of the analysed depth with the electron emission angle is presented. The extraction of the concentration profile from angular distribution experiments is achieved, in the framework of a flat-layer model, by minimizing the difference between theoretical and experimental relative intensities. The applicability and limitations of the method are discussed on the basis of computer simulation results. The depth probed is of the order of 3 lambda (lambda being the value of the inelastic mean free path, typically 10-20 A) and the depth-resolution is of the order of lambda/3 [fr

  5. 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.

  6. 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.

  7. Binding energies and isomerization in metallocene ions from threshold photoelectron photoion coincidence spectroscopy.

    Science.gov (United States)

    Révész, Agnes; Szepes, László; Baer, Tomas; Sztáray, Bálint

    2010-12-22

    Metallocene ions (Cp(2)M(+), M = Cr, Co, Ni) were studied by threshold photoelectron photoion coincidence spectroscopy (TPEPICO) to investigate the mechanism, energetics, and kinetics of the ionic dissociation processes. The examined energy-selected Cp(2)M(+) ions fragment by losing the neutral cyclopentadienyl ligand. In addition, CH and C(2)H(2) losses appear as minor channels, while the cobaltocene ion also loses an H atom. A possible isomerization pathway has also been observed for Cp(2)Ni(+), yielding a complex with pentafulvalene (C(10)H(8)) with a loss of H(2). In order to determine the 0 K appearance energies for the CpM(+) fragment ions, the asymmetric time-of-flight peak shapes and the breakdown diagrams of the energy-selected metallocene ions were modeled by both the rigid activated complex (RAC) Rice-Ramsperger-Kassel-Marcus (RRKM) theory and the simplified statistical adiabatic channel model (SSACM). The following appearance energies were obtained with SSACM, which is more reliable for loose transition states: 10.57 ± 0.14, 11.01 ± 0.13, and 10.18 ± 0.13 eV for M = Cr, Co, and Ni, respectively. These values combined with the corresponding adiabatic ionization energies yield M-Cp bond dissociation energies in Cp(2)M(+) ions of 5.04 ± 0.16, 5.77 ± 0.15, and 3.96 ± 0.15 eV. Density functional calculations at the B3LYP/6-311G(d,p) level of theory were used to determine the structures of these complexes and to provide parameters necessary for the analysis of the experimental data. The trends in the M-Cp bond energies can be related to the electronic structures of the metallocene ions based on a simple molecular orbital picture.

  8. 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.

  9. Development of a superconducting radio frequency photoelectron injector

    Science.gov (United States)

    Arnold, A.; Büttig, H.; Janssen, D.; Kamps, T.; Klemz, G.; Lehmann, W. D.; Lehnert, U.; Lipka, D.; Marhauser, F.; Michel, P.; Möller, K.; Murcek, P.; Schneider, Ch.; Schurig, R.; Staufenbiel, F.; Stephan, J.; Teichert, J.; Volkov, V.; Will, I.; Xiang, R.

    2007-07-01

    A superconducting radio frequency (RF) photoelectron injector (SRF gun) is under development at the Research Center Dresden-Rossendorf. This project aims mainly at replacing the present thermionic gun of the superconducting electron linac ELBE. Thereby the beam quality is greatly improved. Especially, the normalized transverse emittance can be reduced by up to one order of magnitude depending on the operating conditions. The length of the electron bunches will be shortened by about two orders of magnitude making the present bunchers in the injection beam line dispensable. The maximum obtainable bunch charge of the present thermionic gun amounts to 80 pC. The SRF gun is designed to deliver also higher bunch charge values up to 2.5 nC. Therefore, this gun can be used also for advanced facilities such as energy recovery linacs (ERLs) and soft X-ray FELs. The SRF gun is designed as a 3{1}/{2} cell cavity structure with three cells basically TESLA cells supplemented by a newly developed gun cell and a choke filter. The exit energy is projected to be 9.5 MeV. In this paper, we present a description of the design of the SRF gun with special emphasis on the physical and technical problems arising from the necessity of integrating a photocathode into the superconducting cavity structure. Preparation, transfer, cooling and alignment of the photocathode are discussed. In designing the SRF gun cryostat for most components wherever possible the technical solutions were adapted from the ELBE cryostat in some cases with major modifications. As concerns the status of the project the design is finished, most parts are manufactured and the gun is being assembled. Some of the key components are tested in special test arrangements such as cavity warm tuning, cathode cooling, the mechanical behavior of the tuners and the effectiveness of the magnetic screening of the cavity.

  10. Threshold Photoelectron Photoion Coincidence (TPEPICO) Studies. The Road to ± 0.1 kJ/mol Thermochemistry

    Energy Technology Data Exchange (ETDEWEB)

    Baer, Tomas [Univ. of North Carolina, Chapel Hill, NC (United States)

    2013-10-14

    The threshold photoelectron photoion coincidence (TPEPICO) technique is utilized to investigate the dissociation dynamics and thermochemistry of energy selected medium to large organic molecular ions. The reactions include parallel and consecutive steps that are modeled with the statistical theory in order to extract dissociation onsets for multiple dissociation paths. These studies are carried out with the aid of molecular orbital calculations of both ions and the transition states connecting the ion structure to their products. The results of these investigations yield accurate heats of formation of ions, free radicals, and stable molecules. In addition, they provide information about the potential energy surface that governs the dissociation process. Isomerization reactions prior to dissociation are readily inferred from the TPEPICO data.

  11. Complex reflection coefficients of p- and s-polarized light at the pseudo-Brewster angle of a dielectric-conductor interface.

    Science.gov (United States)

    Azzam, R M A

    2013-10-01

    The complex Fresnel reflection coefficients r(p) and r(s) of p- and s-polarized light and their ratio ρ=r(p)/r(s) at the pseudo-Brewster angle (PBA) φ(pB) of a dielectric-conductor interface are evaluated for all possible values of the complex relative dielectric function ε=|ε|exp(-jθ)=ε(r)-jε(i), ε(i)>0 that share the same φ(pB). Complex-plane trajectories of r(p), r(s), and ρ at the PBA are presented at discrete values of φ(pB) from 5° to 85° in equal steps of 5° as θ is increased from 0° to 180°. It is shown that for φ(pB)>70° (high-reflectance metals in the IR) r(p) at the PBA is essentially pure negative imaginary and the reflection phase shift δ(p)=arg(r(p))≈-90°. In the domain of fractional optical constants (vacuum UV or light incidence from a high-refractive-index immersion medium) 0reflection phase shifts δ(p), δ(s), Δ=δ(p)-δ(s)=arg(ρ) are also determined as functions of φ(pB).

  12. Measurement of the prompt J/$\\psi$ and $\\psi$(2S) polarizations in pp collisions at $\\sqrt{s}$ = 7 TeV

    CERN Document Server

    Chatrchyan, Serguei; Sirunyan, Albert M; Tumasyan, Armen; Adam, Wolfgang; Bergauer, Thomas; Dragicevic, Marko; Erö, Janos; Fabjan, Christian; Friedl, Markus; Fruehwirth, Rudolf; Ghete, Vasile Mihai; Hörmann, Natascha; Hrubec, Josef; Jeitler, Manfred; Kiesenhofer, Wolfgang; Knünz, Valentin; Krammer, Manfred; Krätschmer, Ilse; Liko, Dietrich; Mikulec, Ivan; Rabady, Dinyar; Rahbaran, Babak; Rohringer, Christine; Rohringer, Herbert; Schöfbeck, Robert; Strauss, Josef; Taurok, Anton; Treberer-Treberspurg, Wolfgang; Waltenberger, Wolfgang; Wulz, Claudia-Elisabeth; Mossolov, Vladimir; Shumeiko, Nikolai; Suarez Gonzalez, Juan; Alderweireldt, Sara; Bansal, Monika; Bansal, Sunil; Cornelis, Tom; De Wolf, Eddi A; Janssen, Xavier; Knutsson, Albert; Luyckx, Sten; Mucibello, Luca; Ochesanu, Silvia; Roland, Benoit; Rougny, Romain; Staykova, Zlatka; Van Haevermaet, Hans; Van Mechelen, Pierre; Van Remortel, Nick; Van Spilbeeck, Alex; Blekman, Freya; Blyweert, Stijn; D'Hondt, Jorgen; Kalogeropoulos, Alexis; Keaveney, James; Maes, Michael; Olbrechts, Annik; Tavernier, Stefaan; Van Doninck, Walter; Van Mulders, Petra; Van Onsem, Gerrit Patrick; Villella, Ilaria; Caillol, Cécile; Clerbaux, Barbara; De Lentdecker, Gilles; Favart, Laurent; Gay, Arnaud; Hreus, Tomas; Léonard, Alexandre; Marage, Pierre Edouard; Mohammadi, Abdollah; Perniè, Luca; Reis, Thomas; Seva, Tomislav; Thomas, Laurent; Vander Velde, Catherine; Vanlaer, Pascal; Wang, Jian; Adler, Volker; Beernaert, Kelly; Benucci, Leonardo; Cimmino, Anna; Costantini, Silvia; Dildick, Sven; Garcia, Guillaume; Klein, Benjamin; Lellouch, Jérémie; Marinov, Andrey; Mccartin, Joseph; Ocampo Rios, Alberto Andres; Ryckbosch, Dirk; Sigamani, Michael; Strobbe, Nadja; Thyssen, Filip; Tytgat, Michael; Walsh, Sinead; Yazgan, Efe; Zaganidis, Nicolas; Basegmez, Suzan; Beluffi, Camille; Bruno, Giacomo; Castello, Roberto; Caudron, Adrien; Ceard, Ludivine; Da Silveira, Gustavo Gil; Delaere, Christophe; Du Pree, Tristan; Favart, Denis; Forthomme, Laurent; Giammanco, Andrea; Hollar, Jonathan; Jez, Pavel; Lemaitre, Vincent; Liao, Junhui; Militaru, Otilia; Nuttens, Claude; Pagano, Davide; Pin, Arnaud; Piotrzkowski, Krzysztof; Popov, Andrey; Selvaggi, Michele; Vizan Garcia, Jesus Manuel; Beliy, Nikita; Caebergs, Thierry; Daubie, Evelyne; Hammad, Gregory Habib; Alves, Gilvan; Correa Martins Junior, Marcos; Martins, Thiago; Pol, Maria Elena; Henrique Gomes E Souza, Moacyr; Aldá Júnior, Walter Luiz; Carvalho, Wagner; Chinellato, Jose; Custódio, Analu; Melo Da Costa, Eliza; De Jesus Damiao, Dilson; De Oliveira Martins, Carley; Fonseca De Souza, Sandro; Malbouisson, Helena; Malek, Magdalena; Matos Figueiredo, Diego; Mundim, Luiz; Nogima, Helio; Prado Da Silva, Wanda Lucia; Santoro, Alberto; Sznajder, Andre; Tonelli Manganote, Edmilson José; Vilela Pereira, Antonio; Bernardes, Cesar Augusto; De Almeida Dias, Flavia; Tomei, Thiago; De Moraes Gregores, Eduardo; Lagana, Caio; Mercadante, Pedro G; Novaes, Sergio F; Padula, Sandra; Genchev, Vladimir; Iaydjiev, Plamen; Piperov, Stefan; Rodozov, Mircho; Sultanov, Georgi; Vutova, Mariana; Dimitrov, Anton; Hadjiiska, Roumyana; Kozhuharov, Venelin; Litov, Leander; Pavlov, Borislav; Petkov, Peicho; Bian, Jian-Guo; Chen, Guo-Ming; Chen, He-Sheng; Jiang, Chun-Hua; Liang, Dong; Liang, Song; Meng, Xiangwei; Tao, Junquan; Wang, Xianyou; Wang, Zheng; Xiao, Hong; Asawatangtrakuldee, Chayanit; Ban, Yong; Guo, Yifei; Li, Wenbo; Liu, Shuai; Mao, Yajun; Qian, Si-Jin; Teng, Haiyun; Wang, Dayong; Zhang, Linlin; Zou, Wei; Avila, Carlos; Carrillo Montoya, Camilo Andres; Chaparro Sierra, Luisa Fernanda; Gomez, Juan Pablo; Gomez Moreno, Bernardo; Sanabria, Juan Carlos; Godinovic, Nikola; Lelas, Damir; Plestina, Roko; Polic, Dunja; Puljak, Ivica; Antunovic, Zeljko; Kovac, Marko; Brigljevic, Vuko; Kadija, Kreso; Luetic, Jelena; Mekterovic, Darko; Morovic, Srecko; Tikvica, Lucija; Attikis, Alexandros; Mavromanolakis, Georgios; Mousa, Jehad; Nicolaou, Charalambos; Ptochos, Fotios; Razis, Panos A; Finger, Miroslav; Finger Jr, Michael; Assran, Yasser; Elgammal, Sherif; Ellithi Kamel, Ali; Kuotb Awad, Alaa Metwaly; Mahmoud, Mohammed; Radi, Amr; Kadastik, Mario; Müntel, Mait; Murumaa, Marion; Raidal, Martti; Rebane, Liis; Tiko, Andres; Eerola, Paula; Fedi, Giacomo; Voutilainen, Mikko; Härkönen, Jaakko; Karimäki, Veikko; Kinnunen, Ritva; Kortelainen, Matti J; Lampén, Tapio; Lassila-Perini, Kati; Lehti, Sami; Lindén, Tomas; Luukka, Panja-Riina; Mäenpää, Teppo; Peltola, Timo; Tuominen, Eija; Tuominiemi, Jorma; Tuovinen, Esa; Wendland, Lauri; Tuuva, Tuure; Besancon, Marc; Couderc, Fabrice; Dejardin, Marc; Denegri, Daniel; Fabbro, Bernard; Faure, Jean-Louis; Ferri, Federico; Ganjour, Serguei; Givernaud, Alain; Gras, Philippe; Hamel de Monchenault, Gautier; Jarry, Patrick; Locci, Elizabeth; Malcles, Julie; Millischer, Laurent; Nayak, Aruna; Rander, John; Rosowsky, André; Titov, Maksym; Baffioni, Stephanie; Beaudette, Florian; Benhabib, Lamia; Bluj, Michal; Busson, Philippe; Charlot, Claude; Daci, Nadir; Dahms, Torsten; Dalchenko, Mykhailo; Dobrzynski, Ludwik; Florent, Alice; Granier de Cassagnac, Raphael; Haguenauer, Maurice; Miné, Philippe; Mironov, Camelia; Naranjo, Ivo Nicolas; Nguyen, Matthew; Ochando, Christophe; Paganini, Pascal; Sabes, David; Salerno, Roberto; Sirois, Yves; Veelken, Christian; Zabi, Alexandre; Agram, Jean-Laurent; Andrea, Jeremy; Bloch, Daniel; Brom, Jean-Marie; Chabert, Eric Christian; Collard, Caroline; Conte, Eric; Drouhin, Frédéric; Fontaine, Jean-Charles; Gelé, Denis; Goerlach, Ulrich; Goetzmann, Christophe; Juillot, Pierre; Le Bihan, Anne-Catherine; Van Hove, Pierre; Gadrat, Sébastien; Beauceron, Stephanie; Beaupere, Nicolas; Boudoul, Gaelle; Brochet, Sébastien; Chasserat, Julien; Chierici, Roberto; Contardo, Didier; Depasse, Pierre; El Mamouni, Houmani; Fay, Jean; Gascon, Susan; Gouzevitch, Maxime; Ille, Bernard; Kurca, Tibor; Lethuillier, Morgan; Mirabito, Laurent; Perries, Stephane; Sgandurra, Louis; Sordini, Viola; Vander Donckt, Muriel; Verdier, Patrice; Viret, Sébastien; Tsamalaidze, Zviad; Autermann, Christian; Beranek, Sarah; Calpas, Betty; Edelhoff, Matthias; Feld, Lutz; Heracleous, Natalie; Hindrichs, Otto; Klein, Katja; Ostapchuk, Andrey; Perieanu, Adrian; Raupach, Frank; Sammet, Jan; Schael, Stefan; Sprenger, Daniel; Weber, Hendrik; Wittmer, Bruno; Zhukov, Valery; Ata, Metin; Caudron, Julien; Dietz-Laursonn, Erik; Duchardt, Deborah; Erdmann, Martin; Fischer, Robert; Güth, Andreas; Hebbeker, Thomas; Heidemann, Carsten; Hoepfner, Kerstin; Klingebiel, Dennis; Knutzen, Simon; Kreuzer, Peter; Merschmeyer, Markus; Meyer, Arnd; Olschewski, Mark; Padeken, Klaas; Papacz, Paul; Pieta, Holger; Reithler, Hans; Schmitz, Stefan Antonius; Sonnenschein, Lars; Steggemann, Jan; Teyssier, Daniel; Thüer, Sebastian; Weber, Martin; Cherepanov, Vladimir; Erdogan, Yusuf; Flügge, Günter; Geenen, Heiko; Geisler, Matthias; Haj Ahmad, Wael; Hoehle, Felix; Kargoll, Bastian; Kress, Thomas; Kuessel, Yvonne; Lingemann, Joschka; Nowack, Andreas; Nugent, Ian Michael; Perchalla, Lars; Pooth, Oliver; Stahl, Achim; Asin, Ivan; Bartosik, Nazar; Behr, Joerg; Behrenhoff, Wolf; Behrens, Ulf; Bell, Alan James; Bergholz, Matthias; Bethani, Agni; Borras, Kerstin; Burgmeier, Armin; Cakir, Altan; Calligaris, Luigi; Campbell, Alan; Choudhury, Somnath; Costanza, Francesco; Diez Pardos, Carmen; Dooling, Samantha; Dorland, Tyler; Eckerlin, Guenter; Eckstein, Doris; Flucke, Gero; Geiser, Achim; Glushkov, Ivan; Grebenyuk, Anastasia; Gunnellini, Paolo; Habib, Shiraz; Hauk, Johannes; Hellwig, Gregor; Horton, Dean; Jung, Hannes; Kasemann, Matthias; Katsas, Panagiotis; Kleinwort, Claus; Kluge, Hannelies; Krämer, Mira; Krücker, Dirk; Kuznetsova, Ekaterina; Lange, Wolfgang; Leonard, Jessica; Lipka, Katerina; Lohmann, Wolfgang; Lutz, Benjamin; Mankel, Rainer; Marfin, Ihar; Melzer-Pellmann, Isabell-Alissandra; Meyer, Andreas Bernhard; Mnich, Joachim; Mussgiller, Andreas; Naumann-Emme, Sebastian; Novgorodova, Olga; Nowak, Friederike; Olzem, Jan; Perrey, Hanno; Petrukhin, Alexey; Pitzl, Daniel; Placakyte, Ringaile; Raspereza, Alexei; Ribeiro Cipriano, Pedro M; Riedl, Caroline; Ron, Elias; Sahin, Mehmet Özgür; Salfeld-Nebgen, Jakob; Schmidt, Ringo; Schoerner-Sadenius, Thomas; Sen, Niladri; Stein, Matthias; Walsh, Roberval; Wissing, Christoph; Aldaya Martin, Maria; Blobel, Volker; Enderle, Holger; Erfle, Joachim; Garutti, Erika; Gebbert, Ulla; Görner, Martin; Gosselink, Martijn; Haller, Johannes; Heine, Kristin; Höing, Rebekka Sophie; Kaussen, Gordon; Kirschenmann, Henning; Klanner, Robert; Kogler, Roman; Lange, Jörn; Marchesini, Ivan; Peiffer, Thomas; Pietsch, Niklas; Rathjens, Denis; Sander, Christian; Schettler, Hannes; Schleper, Peter; Schlieckau, Eike; Schmidt, Alexander; Schröder, Matthias; Schum, Torben; Seidel, Markus; Sibille, Jennifer; Sola, Valentina; Stadie, Hartmut; Steinbrück, Georg; Thomsen, Jan; Troendle, Daniel; Usai, Emanuele; Vanelderen, Lukas; Barth, Christian; Baus, Colin; Berger, Joram; Böser, Christian; Butz, Erik; Chwalek, Thorsten; De Boer, Wim; Descroix, Alexis; Dierlamm, Alexander; Feindt, Michael; Guthoff, Moritz; Hartmann, Frank; Hauth, Thomas; Held, Hauke; Hoffmann, Karl-Heinz; Husemann, Ulrich; Katkov, Igor; Komaragiri, Jyothsna Rani; Kornmayer, Andreas; Lobelle Pardo, Patricia; Martschei, Daniel; Müller, Thomas; Niegel, Martin; Nürnberg, Andreas; Oberst, Oliver; Ott, Jochen; Quast, Gunter; Rabbertz, Klaus; Ratnikov, Fedor; Röcker, Steffen; Schilling, Frank-Peter; Schott, Gregory; Simonis, Hans-Jürgen; Stober, Fred-Markus Helmut; Ulrich, Ralf; Wagner-Kuhr, Jeannine; Wayand, Stefan; Weiler, Thomas; Zeise, Manuel; Anagnostou, Georgios; Daskalakis, Georgios; Geralis, Theodoros; Kesisoglou, Stilianos; Kyriakis, Aristotelis; Loukas, Demetrios; Markou, Athanasios; Markou, Christos; Ntomari, Eleni; Topsis-giotis, Iasonas; Gouskos, Loukas; Panagiotou, Apostolos; Saoulidou, Niki; Stiliaris, Efstathios; Aslanoglou, Xenofon; Evangelou, Ioannis; Flouris, Giannis; Foudas, Costas; Kokkas, Panagiotis; Manthos, Nikolaos; Papadopoulos, Ioannis; Paradas, Evangelos; Bencze, Gyorgy; Hajdu, Csaba; Hidas, Pàl; Horvath, Dezso; Sikler, Ferenc; Veszpremi, Viktor; Vesztergombi, Gyorgy; Zsigmond, Anna Julia; Beni, Noemi; Czellar, Sandor; Molnar, Jozsef; Palinkas, Jozsef; Szillasi, Zoltan; Karancsi, János; Raics, Peter; Trocsanyi, Zoltan Laszlo; Ujvari, Balazs; Swain, Sanjay Kumar; Beri, Suman Bala; Bhatnagar, Vipin; Dhingra, Nitish; Gupta, Ruchi; Kaur, Manjit; Mehta, Manuk Zubin; Mittal, Monika; Nishu, Nishu; Sharma, Archana; Singh, Jasbir; Kumar, Ashok; Kumar, Arun; Ahuja, Sudha; Bhardwaj, Ashutosh; Choudhary, Brajesh C; Malhotra, Shivali; Naimuddin, Md; Ranjan, Kirti; Saxena, Pooja; Sharma, Varun; Shivpuri, Ram Krishen; Banerjee, Sunanda; Bhattacharya, Satyaki; Chatterjee, Kalyanmoy; Dutta, Suchandra; Gomber, Bhawna; Jain, Sandhya; Jain, Shilpi; Khurana, Raman; Modak, Atanu; Mukherjee, Swagata; Roy, Debarati; Sarkar, Subir; Sharan, Manoj; Singh, Anil; Abdulsalam, Abdulla; Dutta, Dipanwita; Kailas, Swaminathan; Kumar, Vineet; Mohanty, Ajit Kumar; Pant, Lalit Mohan; Shukla, Prashant; Topkar, Anita; Aziz, Tariq; Chatterjee, Rajdeep Mohan; Ganguly, Sanmay; Ghosh, Saranya; Guchait, Monoranjan; Gurtu, Atul; Kole, Gouranga; Kumar, Sanjeev; Maity, Manas; Majumder, Gobinda; Mazumdar, Kajari; Mohanty, Gagan Bihari; Parida, Bibhuti; Sudhakar, Katta; Wickramage, Nadeesha; Banerjee, Sudeshna; Dugad, Shashikant; Arfaei, Hessamaddin; Bakhshiansohi, Hamed; Etesami, Seyed Mohsen; Fahim, Ali; Jafari, Abideh; Khakzad, Mohsen; Mohammadi Najafabadi, Mojtaba; Paktinat Mehdiabadi, Saeid; Safarzadeh, Batool; Zeinali, Maryam; Grunewald, Martin; Abbrescia, Marcello; Barbone, Lucia; Calabria, Cesare; Chhibra, Simranjit Singh; Colaleo, Anna; Creanza, Donato; De Filippis, Nicola; De Palma, Mauro; Fiore, Luigi; Iaselli, Giuseppe; Maggi, Giorgio; Maggi, Marcello; Marangelli, Bartolomeo; My, Salvatore; Nuzzo, Salvatore; Pacifico, Nicola; Pompili, Alexis; Pugliese, Gabriella; Selvaggi, Giovanna; Silvestris, Lucia; Singh, Gurpreet; Venditti, Rosamaria; Verwilligen, Piet; Zito, Giuseppe; Abbiendi, Giovanni; Benvenuti, Alberto; Bonacorsi, Daniele; Braibant-Giacomelli, Sylvie; Brigliadori, Luca; Campanini, Renato; Capiluppi, Paolo; Castro, Andrea; Cavallo, Francesca Romana; Codispoti, Giuseppe; Cuffiani, Marco; Dallavalle, Gaetano-Marco; Fabbri, Fabrizio; Fanfani, Alessandra; Fasanella, Daniele; Giacomelli, Paolo; Grandi, Claudio; Guiducci, Luigi; Marcellini, Stefano; Masetti, Gianni; Meneghelli, Marco; Montanari, Alessandro; Navarria, Francesco; Odorici, Fabrizio; Perrotta, Andrea; Primavera, Federica; Rossi, Antonio; Rovelli, Tiziano; Siroli, Gian Piero; Tosi, Nicolò; Travaglini, Riccardo; Albergo, Sebastiano; Chiorboli, Massimiliano; Costa, Salvatore; Giordano, Ferdinando; Potenza, Renato; Tricomi, Alessia; Tuve, Cristina; Barbagli, Giuseppe; Ciulli, Vitaliano; Civinini, Carlo; D'Alessandro, Raffaello; Focardi, Ettore; Frosali, Simone; Gallo, Elisabetta; Gonzi, Sandro; Gori, Valentina; Lenzi, Piergiulio; Meschini, Marco; Paoletti, Simone; Sguazzoni, Giacomo; Tropiano, Antonio; Benussi, Luigi; Bianco, Stefano; Fabbri, Franco; Piccolo, Davide; Fabbricatore, Pasquale; Ferretti, Roberta; Ferro, Fabrizio; Lo Vetere, Maurizio; Musenich, Riccardo; Robutti, Enrico; Tosi, Silvano; Benaglia, Andrea; Dinardo, Mauro Emanuele; Fiorendi, Sara; Gennai, Simone; Ghezzi, Alessio; Govoni, Pietro; Lucchini, Marco Toliman; Malvezzi, Sandra; Manzoni, Riccardo Andrea; Martelli, Arabella; Menasce, Dario; Moroni, Luigi; Paganoni, Marco; Pedrini, Daniele; Ragazzi, Stefano; Redaelli, Nicola; Tabarelli de Fatis, Tommaso; Buontempo, Salvatore; Cavallo, Nicola; De Cosa, Annapaola; Fabozzi, Francesco; Iorio, Alberto Orso Maria; Lista, Luca; Meola, Sabino; Merola, Mario; Paolucci, Pierluigi; Azzi, Patrizia; Bacchetta, Nicola; Biasotto, Massimo; Bisello, Dario; Branca, Antonio; Carlin, Roberto; Checchia, Paolo; Dorigo, Tommaso; Galanti, Mario; Gasparini, Fabrizio; Gasparini, Ugo; Giubilato, Piero; Gozzelino, Andrea; Kanishchev, Konstantin; Lacaprara, Stefano; Lazzizzera, Ignazio; Margoni, Martino; Meneguzzo, Anna Teresa; Passaseo, Marina; Pazzini, Jacopo; Pozzobon, Nicola; Ronchese, Paolo; Simonetto, Franco; Torassa, Ezio; Tosi, Mia; Triossi, Andrea; Vanini, Sara; Ventura, Sandro; Zotto, Pierluigi; Zucchetta, Alberto; Zumerle, Gianni; Gabusi, Michele; Ratti, Sergio P; Riccardi, Cristina; Vitulo, Paolo; Biasini, Maurizio; Bilei, Gian Mario; Fanò, Livio; Lariccia, Paolo; Mantovani, Giancarlo; Menichelli, Mauro; Nappi, Aniello; Romeo, Francesco; Saha, Anirban; Santocchia, Attilio; Spiezia, Aniello; Androsov, Konstantin; Azzurri, Paolo; Bagliesi, Giuseppe; Boccali, Tommaso; Broccolo, Giuseppe; Castaldi, Rino; Ciocci, Maria Agnese; D'Agnolo, Raffaele Tito; Dell'Orso, Roberto; Fiori, Francesco; Foà, Lorenzo; Giassi, Alessandro; Grippo, Maria Teresa; Kraan, Aafke; Ligabue, Franco; Lomtadze, Teimuraz; Martini, Luca; Messineo, Alberto; Moon, Chang-Seong; Palla, Fabrizio; Rizzi, Andrea; Savoy-Navarro, Aurore; Serban, Alin Titus; Spagnolo, Paolo; Squillacioti, Paola; Tenchini, Roberto; Tonelli, Guido; Venturi, Andrea; Verdini, Piero Giorgio; Vernieri, Caterina; Barone, Luciano; Cavallari, Francesca; Del Re, Daniele; Diemoz, Marcella; Grassi, Marco; Longo, Egidio; Margaroli, Fabrizio; Meridiani, Paolo; Micheli, Francesco; Nourbakhsh, Shervin; Organtini, Giovanni; Paramatti, Riccardo; Rahatlou, Shahram; Rovelli, Chiara; Soffi, Livia; Amapane, Nicola; Arcidiacono, Roberta; Argiro, Stefano; Arneodo, Michele; Bellan, Riccardo; Biino, Cristina; Cartiglia, Nicolo; Casasso, Stefano; Costa, Marco; Degano, Alessandro; Demaria, Natale; Mariotti, Chiara; Maselli, Silvia; Migliore, Ernesto; Monaco, Vincenzo; Musich, Marco; Obertino, Maria Margherita; Pastrone, Nadia; Pelliccioni, Mario; Potenza, Alberto; Romero, Alessandra; Ruspa, Marta; Sacchi, Roberto; Solano, Ada; Staiano, Amedeo; Tamponi, Umberto; Belforte, Stefano; Candelise, Vieri; Casarsa, Massimo; Cossutti, Fabio; Della Ricca, Giuseppe; Gobbo, Benigno; La Licata, Chiara; Marone, Matteo; Montanino, Damiana; Penzo, Aldo; Schizzi, Andrea; Zanetti, Anna; Chang, Sunghyun; Kim, Tae Yeon; Nam, Soon-Kwon; Kim, Dong Hee; Kim, Gui Nyun; Kim, Ji Eun; Kong, Dae Jung; Lee, Sangeun; Oh, Young Do; Park, Hyangkyu; Son, Dong-Chul; Kim, Jae Yool; Kim, Zero Jaeho; Song, Sanghyeon; Choi, Suyong; Gyun, Dooyeon; Hong, Byung-Sik; Jo, Mihee; Kim, Hyunchul; Kim, Tae Jeong; Lee, Kyong Sei; Park, Sung Keun; Roh, Youn; Choi, Minkyoo; Kim, Ji Hyun; Park, Chawon; Park, Inkyu; Park, Sangnam; Ryu, Geonmo; Choi, Young-Il; Choi, Young Kyu; Goh, Junghwan; Kim, Min Suk; Kwon, Eunhyang; Lee, Byounghoon; Lee, Jongseok; Lee, Sungeun; Seo, Hyunkwan; Yu, Intae; Grigelionis, Ignas; Juodagalvis, Andrius; Castilla-Valdez, Heriberto; De La Cruz-Burelo, Eduard; Heredia-de La Cruz, Ivan; Lopez-Fernandez, Ricardo; Martínez-Ortega, Jorge; Sánchez Hernández, Alberto; Villasenor-Cendejas, Luis Manuel; Carrillo Moreno, Salvador; Vazquez Valencia, Fabiola; Salazar Ibarguen, Humberto Antonio; Casimiro Linares, Edgar; Morelos Pineda, Antonio; Reyes-Santos, Marco A; Krofcheck, David; Butler, Philip H; Doesburg, Robert; Reucroft, Steve; Silverwood, Hamish; Ahmad, Muhammad; Asghar, Muhammad Irfan; Butt, Jamila; Hoorani, Hafeez R; Khalid, Shoaib; Khan, Wajid Ali; Khurshid, Taimoor; Qazi, Shamona; Shah, Mehar Ali; Shoaib, Muhammad; Bialkowska, Helena; Boimska, Bożena; Frueboes, Tomasz; Górski, Maciej; Kazana, Malgorzata; Nawrocki, Krzysztof; Romanowska-Rybinska, Katarzyna; Szleper, Michal; Wrochna, Grzegorz; Zalewski, Piotr; Brona, Grzegorz; Bunkowski, Karol; Cwiok, Mikolaj; Dominik, Wojciech; Doroba, Krzysztof; Kalinowski, Artur; Konecki, Marcin; Krolikowski, Jan; Misiura, Maciej; Almeida, Nuno; Bargassa, Pedrame; Beirão Da Cruz E Silva, Cristóvão; Faccioli, Pietro; Ferreira Parracho, Pedro Guilherme; Gallinaro, Michele; Nguyen, Federico; Rodrigues Antunes, Joao; Seixas, Joao; Varela, Joao; Vischia, Pietro; Afanasiev, Serguei; Bunin, Pavel; Gavrilenko, Mikhail; Golutvin, Igor; Gorbunov, Ilya; Kamenev, Alexey; Karjavin, Vladimir; Konoplyanikov, Viktor; Lanev, Alexander; Malakhov, Alexander; Matveev, Viktor; Moisenz, Petr; Palichik, Vladimir; Perelygin, Victor; Shmatov, Sergey; Skatchkov, Nikolai; Smirnov, Vitaly; Zarubin, Anatoli; Evstyukhin, Sergey; Golovtsov, Victor; Ivanov, Yury; Kim, Victor; Levchenko, Petr; Murzin, Victor; Oreshkin, Vadim; Smirnov, Igor; Sulimov, Valentin; Uvarov, Lev; Vavilov, Sergey; Vorobyev, Alexey; Vorobyev, Andrey; Andreev, Yuri; Dermenev, Alexander; Gninenko, Sergei; Golubev, Nikolai; Kirsanov, Mikhail; Krasnikov, Nikolai; Pashenkov, Anatoli; Tlisov, Danila; Toropin, Alexander; Epshteyn, Vladimir; Erofeeva, Maria; Gavrilov, Vladimir; Lychkovskaya, Natalia; Popov, Vladimir; Safronov, Grigory; Semenov, Sergey; Spiridonov, Alexander; Stolin, Viatcheslav; Vlasov, Evgueni; Zhokin, Alexander; Andreev, Vladimir; Azarkin, Maksim; Dremin, Igor; Kirakosyan, Martin; Leonidov, Andrey; Mesyats, Gennady; Rusakov, Sergey V; Vinogradov, Alexey; Belyaev, Andrey; Boos, Edouard; Dubinin, Mikhail; Dudko, Lev; Ershov, Alexander; Gribushin, Andrey; Klyukhin, Vyacheslav; Kodolova, Olga; Lokhtin, Igor; Markina, Anastasia; Obraztsov, Stepan; Petrushanko, Sergey; Savrin, Viktor; Snigirev, Alexander; Azhgirey, Igor; Bayshev, Igor; Bitioukov, Sergei; Kachanov, Vassili; Kalinin, Alexey; Konstantinov, Dmitri; Krychkine, Victor; Petrov, Vladimir; Ryutin, Roman; Sobol, Andrei; Tourtchanovitch, Leonid; Troshin, Sergey; Tyurin, Nikolay; Uzunian, Andrey; Volkov, Alexey; Adzic, Petar; Djordjevic, Milos; Ekmedzic, Marko; Krpic, Dragomir; Milosevic, Jovan; Aguilar-Benitez, Manuel; Alcaraz Maestre, Juan; Battilana, Carlo; Calvo, Enrique; Cerrada, Marcos; Chamizo Llatas, Maria; Colino, Nicanor; De La Cruz, Begona; Delgado Peris, Antonio; Domínguez Vázquez, Daniel; Fernandez Bedoya, Cristina; Fernández Ramos, Juan Pablo; Ferrando, Antonio; Flix, Jose; Fouz, Maria Cruz; Garcia-Abia, Pablo; Gonzalez Lopez, Oscar; Goy Lopez, Silvia; Hernandez, Jose M; Josa, Maria Isabel; Merino, Gonzalo; Navarro De Martino, Eduardo; Puerta Pelayo, Jesus; Quintario Olmeda, Adrián; Redondo, Ignacio; Romero, Luciano; Santaolalla, Javier; Senghi Soares, Mara; Willmott, Carlos; Albajar, Carmen; de Trocóniz, Jorge F; Brun, Hugues; Cuevas, Javier; Fernandez Menendez, Javier; Folgueras, Santiago; Gonzalez Caballero, Isidro; Lloret Iglesias, Lara; Piedra Gomez, Jonatan; Brochero Cifuentes, Javier Andres; Cabrillo, Iban Jose; Calderon, Alicia; Chuang, Shan-Huei; Duarte Campderros, Jordi; Fernandez, Marcos; Gomez, Gervasio; Gonzalez Sanchez, Javier; Graziano, Alberto; Jorda, Clara; Lopez Virto, Amparo; Marco, Jesus; Marco, Rafael; Martinez Rivero, Celso; Matorras, Francisco; Munoz Sanchez, Francisca Javiela; Rodrigo, Teresa; Rodríguez-Marrero, Ana Yaiza; Ruiz-Jimeno, Alberto; Scodellaro, Luca; Vila, Ivan; Vilar Cortabitarte, Rocio; Abbaneo, Duccio; Auffray, Etiennette; Auzinger, Georg; Bachtis, Michail; Baillon, Paul; Ball, Austin; Barney, David; Bendavid, Joshua; Benitez, Jose F; Bernet, Colin; Bianchi, Giovanni; Bloch, Philippe; Bocci, Andrea; Bonato, Alessio; Bondu, Olivier; Botta, Cristina; Breuker, Horst; Camporesi, Tiziano; Cerminara, Gianluca; Christiansen, Tim; Coarasa Perez, Jose Antonio; Colafranceschi, Stefano; D'Alfonso, Mariarosaria; D'Enterria, David; Dabrowski, Anne; David Tinoco Mendes, Andre; De Guio, Federico; De Roeck, Albert; De Visscher, Simon; Di Guida, Salvatore; Dobson, Marc; Dupont-Sagorin, Niels; Elliott-Peisert, Anna; Eugster, Jürg; Funk, Wolfgang; Georgiou, Georgios; Giffels, Manuel; Gigi, Dominique; Gill, Karl; Giordano, Domenico; Girone, Maria; Giunta, Marina; Glege, Frank; Gomez-Reino Garrido, Robert; Gowdy, Stephen; Guida, Roberto; Hammer, Josef; Hansen, Magnus; Harris, Philip; Hartl, Christian; Hinzmann, Andreas; Innocente, Vincenzo; Janot, Patrick; Karavakis, Edward; Kousouris, Konstantinos; Krajczar, Krisztian; Lecoq, Paul; Lee, Yen-Jie; Lourenco, Carlos; Magini, Nicolo; Malgeri, Luca; Mannelli, Marcello; Masetti, Lorenzo; Meijers, Frans; Mersi, Stefano; Meschi, Emilio; Moser, Roland; Mulders, Martijn; Musella, Pasquale; Nesvold, Erik; Orsini, Luciano; Palencia Cortezon, Enrique; Perez, Emmanuelle; Perrozzi, Luca; Petrilli, Achille; Pfeiffer, Andreas; Pierini, Maurizio; Pimiä, Martti; Piparo, Danilo; Plagge, Michael; Quertenmont, Loic; Racz, Attila; Reece, William; Rolandi, Gigi; Rovere, Marco; Sakulin, Hannes; Santanastasio, Francesco; Schäfer, Christoph; Schwick, Christoph; Segoni, Ilaria; Sekmen, Sezen; Sharma, Archana; Siegrist, Patrice; Silva, Pedro; Simon, Michal; Sphicas, Paraskevas; Spiga, Daniele; Stoye, Markus; Tsirou, Andromachi; Veres, Gabor Istvan; Vlimant, Jean-Roch; Wöhri, Hermine Katharina; Worm, Steven; Zeuner, Wolfram Dietrich; Bertl, Willi; Deiters, Konrad; Erdmann, Wolfram; Gabathuler, Kurt; Horisberger, Roland; Ingram, Quentin; Kaestli, Hans-Christian; König, Stefan; Kotlinski, Danek; Langenegger, Urs; Renker, Dieter; Rohe, Tilman; Bachmair, Felix; Bäni, Lukas; Bianchini, Lorenzo; Bortignon, Pierluigi; Buchmann, Marco-Andrea; Casal, Bruno; Chanon, Nicolas; Deisher, Amanda; Dissertori, Günther; Dittmar, Michael; Donegà, Mauro; Dünser, Marc; Eller, Philipp; Freudenreich, Klaus; Grab, Christoph; Hits, Dmitry; Lecomte, Pierre; Lustermann, Werner; Mangano, Boris; Marini, Andrea Carlo; Martinez Ruiz del Arbol, Pablo; Meister, Daniel; Mohr, Niklas; Moortgat, Filip; Nägeli, Christoph; Nef, Pascal; Nessi-Tedaldi, Francesca; Pandolfi, Francesco; Pape, Luc; Pauss, Felicitas; Peruzzi, Marco; Ronga, Frederic Jean; Rossini, Marco; Sala, Leonardo; Sanchez, Ann - Karin; Starodumov, Andrei; Stieger, Benjamin; Takahashi, Maiko; Tauscher, Ludwig; Thea, Alessandro; Theofilatos, Konstantinos; Treille, Daniel; Urscheler, Christina; Wallny, Rainer; Weber, Hannsjoerg Artur; Amsler, Claude; Chiochia, Vincenzo; Favaro, Carlotta; Ivova Rikova, Mirena; Kilminster, Benjamin; Millan Mejias, Barbara; Robmann, Peter; Snoek, Hella; Taroni, Silvia; Verzetti, Mauro; Yang, Yong; Cardaci, Marco; Chen, Kuan-Hsin; Ferro, Cristina; Kuo, Chia-Ming; Li, Syue-Wei; Lin, Willis; Lu, Yun-Ju; Volpe, Roberta; Yu, Shin-Shan; Bartalini, Paolo; Chang, Paoti; Chang, You-Hao; Chang, Yu-Wei; Chao, Yuan; Chen, Kai-Feng; Dietz, Charles; Grundler, Ulysses; Hou, George Wei-Shu; Hsiung, Yee; Kao, Kai-Yi; Lei, Yeong-Jyi; Lu, Rong-Shyang; Majumder, Devdatta; Petrakou, Eleni; Shi, Xin; Shiu, Jing-Ge; Tzeng, Yeng-Ming; Wang, Minzu; Asavapibhop, Burin; Suwonjandee, Narumon; Adiguzel, Aytul; Bakirci, Mustafa Numan; Cerci, Salim; Dozen, Candan; Dumanoglu, Isa; Eskut, Eda; Girgis, Semiray; Gokbulut, Gul; Gurpinar, Emine; Hos, Ilknur; Kangal, Evrim Ersin; Kayis Topaksu, Aysel; Onengut, Gulsen; Ozdemir, Kadri; Ozturk, Sertac; Polatoz, Ayse; Sogut, Kenan; Sunar Cerci, Deniz; Tali, Bayram; Topakli, Huseyin; Vergili, Mehmet; Akin, Ilina Vasileva; Aliev, Takhmasib; Bilin, Bugra; Bilmis, Selcuk; Deniz, Muhammed; Gamsizkan, Halil; Guler, Ali Murat; Karapinar, Guler; Ocalan, Kadir; Ozpineci, Altug; Serin, Meltem; Sever, Ramazan; Surat, Ugur Emrah; Yalvac, Metin; Zeyrek, Mehmet; Gülmez, Erhan; Isildak, Bora; Kaya, Mithat; Kaya, Ozlem; Ozkorucuklu, Suat; Sonmez, Nasuf; Bahtiyar, Hüseyin; Barlas, Esra; Cankocak, Kerem; Günaydin, Yusuf Oguzhan; Vardarlı, Fuat Ilkehan; Yücel, Mete; Levchuk, Leonid; Sorokin, Pavel; Brooke, James John; Clement, Emyr; Cussans, David; Flacher, Henning; Frazier, Robert; Goldstein, Joel; Grimes, Mark; Heath, Greg P; Heath, Helen F; Kreczko, Lukasz; Lucas, Chris; Meng, Zhaoxia; Metson, Simon; Newbold, Dave M; Nirunpong, Kachanon; Paramesvaran, Sudarshan; Poll, Anthony; Senkin, Sergey; Smith, Vincent J; Williams, Thomas; Bell, Ken W; Belyaev, Alexander; Brew, Christopher; Brown, Robert M; Cockerill, David JA; Coughlan, John A; Harder, Kristian; Harper, Sam; Olaiya, Emmanuel; Petyt, David; Radburn-Smith, Benjamin Charles; Shepherd-Themistocleous, Claire; Tomalin, Ian R; Womersley, William John; Bainbridge, Robert; Buchmuller, Oliver; Burton, Darren; Colling, David; Cripps, Nicholas; Cutajar, Michael; Dauncey, Paul; Davies, Gavin; Della Negra, Michel; Ferguson, William; Fulcher, Jonathan; Futyan, David; Gilbert, Andrew; Guneratne Bryer, Arlo; Hall, Geoffrey; Hatherell, Zoe; Hays, Jonathan; Iles, Gregory; Jarvis, Martyn; Karapostoli, Georgia; Kenzie, Matthew; Lane, Rebecca; Lucas, Robyn; Lyons, Louis; Magnan, Anne-Marie; Marrouche, Jad; Mathias, Bryn; Nandi, Robin; Nash, Jordan; Nikitenko, Alexander; Pela, Joao; Pesaresi, Mark; Petridis, Konstantinos; Pioppi, Michele; Raymond, David Mark; Rogerson, Samuel; Rose, Andrew; Seez, Christopher; Sharp, Peter; Sparrow, Alex; Tapper, Alexander; Vazquez Acosta, Monica; Virdee, Tejinder; Wakefield, Stuart; Wardle, Nicholas; Chadwick, Matthew; Cole, Joanne; Hobson, Peter R; Khan, Akram; Kyberd, Paul; Leggat, Duncan; Leslie, Dawn; Martin, William; Reid, Ivan; Symonds, Philip; Teodorescu, Liliana; Turner, Mark; Dittmann, Jay; Hatakeyama, Kenichi; Kasmi, Azeddine; Liu, Hongxuan; Scarborough, Tara; Charaf, Otman; Cooper, Seth; Henderson, Conor; Rumerio, Paolo; Avetisyan, Aram; Bose, Tulika; Fantasia, Cory; Heister, Arno; Lawson, Philip; Lazic, Dragoslav; Rohlf, James; Sperka, David; St John, Jason; Sulak, Lawrence; Alimena, Juliette; Bhattacharya, Saptaparna; Christopher, Grant; Cutts, David; Demiragli, Zeynep; Ferapontov, Alexey; Garabedian, Alex; Heintz, Ulrich; Jabeen, Shabnam; Kukartsev, Gennadiy; Laird, Edward; Landsberg, Greg; Luk, Michael; Narain, Meenakshi; Segala, Michael; Sinthuprasith, Tutanon; Speer, Thomas; Breedon, Richard; Breto, Guillermo; Calderon De La Barca Sanchez, Manuel; Chauhan, Sushil; Chertok, Maxwell; Conway, John; Conway, Rylan; Cox, Peter Timothy; Erbacher, Robin; Gardner, Michael; Houtz, Rachel; Ko, Winston; Kopecky, Alexandra; Lander, Richard; Miceli, Tia; Pellett, Dave; Pilot, Justin; Ricci-Tam, Francesca; Rutherford, Britney; Searle, Matthew; Smith, John; Squires, Michael; Tripathi, Mani; Wilbur, Scott; Yohay, Rachel; Andreev, Valeri; Cline, David; Cousins, Robert; Erhan, Samim; Everaerts, Pieter; Farrell, Chris; Felcini, Marta; Hauser, Jay; Ignatenko, Mikhail; Jarvis, Chad; Rakness, Gregory; Schlein, Peter; Takasugi, Eric; Traczyk, Piotr; Valuev, Vyacheslav; Weber, Matthias; Babb, John; Clare, Robert; Ellison, John Anthony; Gary, J William; Hanson, Gail; Heilman, Jesse; Jandir, Pawandeep; Liu, Hongliang; Long, Owen Rosser; Luthra, Arun; Malberti, Martina; Nguyen, Harold; Shrinivas, Amithabh; Sturdy, Jared; Sumowidagdo, Suharyo; Wilken, Rachel; Wimpenny, Stephen; Andrews, Warren; Branson, James G; Cerati, Giuseppe Benedetto; Cittolin, Sergio; Evans, David; Holzner, André; Kelley, Ryan; Lebourgeois, Matthew; Letts, James; Macneill, Ian; Padhi, Sanjay; Palmer, Christopher; Petrucciani, Giovanni; Pieri, Marco; Sani, Matteo; Sharma, Vivek; Simon, Sean; Sudano, Elizabeth; Tadel, Matevz; Tu, Yanjun; Vartak, Adish; Wasserbaech, Steven; Würthwein, Frank; Yagil, Avraham; Yoo, Jaehyeok; Barge, Derek; Campagnari, Claudio; Danielson, Thomas; Flowers, Kristen; Geffert, Paul; George, Christopher; Golf, Frank; Incandela, Joe; Justus, Christopher; Kovalskyi, Dmytro; Krutelyov, Vyacheslav; Lowette, Steven; Magaña Villalba, Ricardo; Mccoll, Nickolas; Pavlunin, Viktor; Richman, Jeffrey; Rossin, Roberto; Stuart, David; To, Wing; West, Christopher; Apresyan, Artur; Bornheim, Adolf; Bunn, Julian; Chen, Yi; Di Marco, Emanuele; Duarte, Javier; Kcira, Dorian; Ma, Yousi; Mott, Alexander; Newman, Harvey B; Pena, Cristian; Rogan, Christopher; Spiropulu, Maria; Timciuc, Vladlen; Veverka, Jan; Wilkinson, Richard; Xie, Si; Zhu, Ren-Yuan; Azzolini, Virginia; Calamba, Aristotle; Carroll, Ryan; Ferguson, Thomas; Iiyama, Yutaro; Jang, Dong Wook; Liu, Yueh-Feng; Paulini, Manfred; Russ, James; Vogel, Helmut; Vorobiev, Igor; Cumalat, John Perry; Drell, Brian Robert; Ford, William T; Gaz, Alessandro; Luiggi Lopez, Eduardo; Nauenberg, Uriel; Smith, James; Stenson, Kevin; Ulmer, Keith; Wagner, Stephen Robert; Alexander, James; Chatterjee, Avishek; Eggert, Nicholas; Gibbons, Lawrence Kent; Hopkins, Walter; Khukhunaishvili, Aleko; Kreis, Benjamin; Mirman, Nathan; Nicolas Kaufman, Gala; Patterson, Juliet Ritchie; Ryd, Anders; Salvati, Emmanuele; Sun, Werner; Teo, Wee Don; Thom, Julia; Thompson, Joshua; Tucker, Jordan; Weng, Yao; Winstrom, Lucas; Wittich, Peter; Winn, Dave; Abdullin, Salavat; Albrow, Michael; Anderson, Jacob; Apollinari, Giorgio; Bauerdick, Lothar AT; Beretvas, Andrew; Berryhill, Jeffrey; Bhat, Pushpalatha C; Burkett, Kevin; Butler, Joel Nathan; Chetluru, Vasundhara; Cheung, Harry; Chlebana, Frank; Cihangir, Selcuk; Elvira, Victor Daniel; Fisk, Ian; Freeman, Jim; Gao, Yanyan; Gottschalk, Erik; Gray, Lindsey; Green, Dan; Gutsche, Oliver; Hare, Daryl; Harris, Robert M; Hirschauer, James; Hooberman, Benjamin; Jindariani, Sergo; Johnson, Marvin; Joshi, Umesh; Kaadze, Ketino; Klima, Boaz; Kunori, Shuichi; Kwan, Simon; Linacre, Jacob; Lincoln, Don; Lipton, Ron; Lykken, Joseph; Maeshima, Kaori; Marraffino, John Michael; Martinez Outschoorn, Verena Ingrid; Maruyama, Sho; Mason, David; McBride, Patricia; Mishra, Kalanand; Mrenna, Stephen; Musienko, Yuri; Newman-Holmes, Catherine; O'Dell, Vivian; Prokofyev, Oleg; Ratnikova, Natalia; Sexton-Kennedy, Elizabeth; Sharma, Seema; Spalding, William J; Spiegel, Leonard; Taylor, Lucas; Tkaczyk, Slawek; Tran, Nhan Viet; Uplegger, Lorenzo; Vaandering, Eric Wayne; Vidal, Richard; Whitmore, Juliana; Wu, Weimin; Yang, Fan; Yun, Jae Chul; Acosta, Darin; Avery, Paul; Bourilkov, Dimitri; Chen, Mingshui; Cheng, Tongguang; Das, Souvik; De Gruttola, Michele; Di Giovanni, Gian Piero; Dobur, Didar; Drozdetskiy, Alexey; Field, Richard D; Fisher, Matthew; Fu, Yu; Furic, Ivan-Kresimir; Hugon, Justin; Kim, Bockjoo; Konigsberg, Jacobo; Korytov, Andrey; Kropivnitskaya, Anna; Kypreos, Theodore; Low, Jia Fu; Matchev, Konstantin; Milenovic, Predrag; Mitselmakher, Guenakh; Muniz, Lana; Remington, Ronald; Rinkevicius, Aurelijus; Skhirtladze, Nikoloz; Snowball, Matthew; Yelton, John; Zakaria, Mohammed; Gaultney, Vanessa; Hewamanage, Samantha; Linn, Stephan; Markowitz, Pete; Martinez, German; Rodriguez, Jorge Luis; Adams, Todd; Askew, Andrew; Bochenek, Joseph; Chen, Jie; Diamond, Brendan; Gleyzer, Sergei V; Haas, Jeff; Hagopian, Sharon; Hagopian, Vasken; Johnson, Kurtis F; Prosper, Harrison; Veeraraghavan, Venkatesh; Weinberg, Marc; Baarmand, Marc M; Dorney, Brian; Hohlmann, Marcus; Kalakhety, Himali; Yumiceva, Francisco; Adams, Mark Raymond; Apanasevich, Leonard; Bazterra, Victor Eduardo; Betts, Russell Richard; Bucinskaite, Inga; Callner, Jeremy; Cavanaugh, Richard; Evdokimov, Olga; Gauthier, Lucie; Gerber, Cecilia Elena; Hofman, David Jonathan; Khalatyan, Samvel; Kurt, Pelin; Lacroix, Florent; Moon, Dong Ho; O'Brien, Christine; Silkworth, Christopher; Strom, Derek; Turner, Paul; Varelas, Nikos; Akgun, Ugur; Albayrak, Elif Asli; Bilki, Burak; Clarida, Warren; Dilsiz, Kamuran; Duru, Firdevs; Griffiths, Scott; Merlo, Jean-Pierre; Mermerkaya, Hamit; Mestvirishvili, Alexi; Moeller, Anthony; Nachtman, Jane; Newsom, Charles Ray; Ogul, Hasan; Onel, Yasar; Ozok, Ferhat; Sen, Sercan; Tan, Ping; Tiras, Emrah; Wetzel, James; Yetkin, Taylan; Yi, Kai; Barnett, Bruce Arnold; Blumenfeld, Barry; Bolognesi, Sara; Giurgiu, Gavril; Gritsan, Andrei; Hu, Guofan; Maksimovic, Petar; Martin, Christopher; Swartz, Morris; Whitbeck, Andrew; Baringer, Philip; Bean, Alice; Benelli, Gabriele; Kenny III, Raymond Patrick; Murray, Michael; Noonan, Daniel; Sanders, Stephen; Stringer, Robert; Wood, Jeffrey Scott; Barfuss, Anne-Fleur; Chakaberia, Irakli; Ivanov, Andrew; Khalil, Sadia; Makouski, Mikhail; Maravin, Yurii; Saini, Lovedeep Kaur; Shrestha, Shruti; Svintradze, Irakli; Gronberg, Jeffrey; Lange, David; Rebassoo, Finn; Wright, Douglas; Baden, Drew; Calvert, Brian; Eno, Sarah Catherine; Gomez, Jaime; Hadley, Nicholas John; Kellogg, Richard G; Kolberg, Ted; Lu, Ying; Marionneau, Matthieu; Mignerey, Alice; Pedro, Kevin; Peterman, Alison; Skuja, Andris; Temple, Jeffrey; Tonjes, Marguerite; Tonwar, Suresh C; Apyan, Aram; Bauer, Gerry; Busza, Wit; Cali, Ivan Amos; Chan, Matthew; Di Matteo, Leonardo; Dutta, Valentina; Gomez Ceballos, Guillelmo; Goncharov, Maxim; Gulhan, Doga; Kim, Yongsun; Klute, Markus; Lai, Yue Shi; Levin, Andrew; Luckey, Paul David; Ma, Teng; Nahn, Steve; Paus, Christoph; Ralph, Duncan; Roland, Christof; Roland, Gunther; Stephans, George; Stöckli, Fabian; Sumorok, Konstanty; Velicanu, Dragos; Wolf, Roger; Wyslouch, Bolek; Yang, Mingming; Yilmaz, Yetkin; Yoon, Sungho; Zanetti, Marco; Zhukova, Victoria; Dahmes, Bryan; De Benedetti, Abraham; Franzoni, Giovanni; Gude, Alexander; Haupt, Jason; Kao, Shih-Chuan; Klapoetke, Kevin; Kubota, Yuichi; Mans, Jeremy; Pastika, Nathaniel; Rusack, Roger; Sasseville, Michael; Singovsky, Alexander; Tambe, Norbert; Turkewitz, Jared; Acosta, John Gabriel; Cremaldi, Lucien Marcus; Kroeger, Rob; Oliveros, Sandra; Perera, Lalith; Rahmat, Rahmat; Sanders, David A; Summers, Don; Avdeeva, Ekaterina; Bloom, Kenneth; Bose, Suvadeep; Claes, Daniel R; Dominguez, Aaron; Eads, Michael; Gonzalez Suarez, Rebeca; Keller, Jason; Kravchenko, Ilya; Lazo-Flores, Jose; Malik, Sudhir; Meier, Frank; Snow, Gregory R; Dolen, James; Godshalk, Andrew; Iashvili, Ia; Jain, Supriya; Kharchilava, Avto; Kumar, Ashish; Rappoccio, Salvatore; Wan, Zongru; Alverson, George; Barberis, Emanuela; Baumgartel, Darin; Chasco, Matthew; Haley, Joseph; Massironi, Andrea; Nash, David; Orimoto, Toyoko; Trocino, Daniele; Wood, Darien; Zhang, Jinzhong; Anastassov, Anton; Hahn, Kristan Allan; Kubik, Andrew; Lusito, Letizia; Mucia, Nicholas; Odell, Nathaniel; Pollack, Brian; Pozdnyakov, Andrey; Schmitt, Michael Henry; Stoynev, Stoyan; Sung, Kevin; Velasco, Mayda; Won, Steven; Berry, Douglas; Brinkerhoff, Andrew; Chan, Kwok Ming; Hildreth, Michael; Jessop, Colin; Karmgard, Daniel John; Kolb, Jeff; Lannon, Kevin; Luo, Wuming; Lynch, Sean; Marinelli, Nancy; Morse, David Michael; Pearson, Tessa; Planer, Michael; Ruchti, Randy; Slaunwhite, Jason; Valls, Nil; Wayne, Mitchell; Wolf, Matthias; Antonelli, Louis; Bylsma, Ben; Durkin, Lloyd Stanley; Hill, Christopher; Hughes, Richard; Kotov, Khristian; Ling, Ta-Yung; Puigh, Darren; Rodenburg, Marissa; Smith, Geoffrey; Vuosalo, Carl; Winer, Brian L; Wolfe, Homer; Berry, Edmund; Elmer, Peter; Halyo, Valerie; Hebda, Philip; Hegeman, Jeroen; Hunt, Adam; Jindal, Pratima; Koay, Sue Ann; Lujan, Paul; Marlow, Daniel; Medvedeva, Tatiana; Mooney, Michael; Olsen, James; Piroué, Pierre; Quan, Xiaohang; Raval, Amita; Saka, Halil; Stickland, David; Tully, Christopher; Werner, Jeremy Scott; Zenz, Seth Conrad; Zuranski, Andrzej; Brownson, Eric; Lopez, Angel; Mendez, Hector; Ramirez Vargas, Juan Eduardo; Alagoz, Enver; Benedetti, Daniele; Bolla, Gino; Bortoletto, Daniela; De Mattia, Marco; Everett, Adam; Hu, Zhen; Jones, Matthew; Jung, Kurt; Koybasi, Ozhan; Kress, Matthew; Leonardo, Nuno; Lopes Pegna, David; Maroussov, Vassili; Merkel, Petra; Miller, David Harry; Neumeister, Norbert; Shipsey, Ian; Silvers, David; Svyatkovskiy, Alexey; Vidal Marono, Miguel; Wang, Fuqiang; Xie, Wei; Xu, Lingshan; Yoo, Hwi Dong; Zablocki, Jakub; Zheng, Yu; Parashar, Neeti; Adair, Antony; Akgun, Bora; Ecklund, Karl Matthew; Geurts, Frank JM; Li, Wei; Michlin, Benjamin; Padley, Brian Paul; Redjimi, Radia; Roberts, Jay; Zabel, James; Betchart, Burton; Bodek, Arie; Covarelli, Roberto; de Barbaro, Pawel; Demina, Regina; Eshaq, Yossof; Ferbel, Thomas; Garcia-Bellido, Aran; Goldenzweig, Pablo; Han, Jiyeon; Harel, Amnon; Miner, Daniel Carl; Petrillo, Gianluca; Vishnevskiy, Dmitry; Zielinski, Marek; Bhatti, Anwar; Ciesielski, Robert; Demortier, Luc; Goulianos, Konstantin; Lungu, Gheorghe; Malik, Sarah; Mesropian, Christina; Arora, Sanjay; Barker, Anthony; Chou, John Paul; Contreras-Campana, Christian; Contreras-Campana, Emmanuel; Duggan, Daniel; Ferencek, Dinko; Gershtein, Yuri; Gray, Richard; Halkiadakis, Eva; Hidas, Dean; Lath, Amitabh; Panwalkar, Shruti; Park, Michael; Patel, Rishi; Rekovic, Vladimir; Robles, Jorge; Salur, Sevil; Schnetzer, Steve; Seitz, Claudia; Somalwar, Sunil; Stone, Robert; Thomas, Scott; Thomassen, Peter; Walker, Matthew; Cerizza, Giordano; Hollingsworth, Matthew; Rose, Keith; Spanier, Stefan; Yang, Zong-Chang; York, Andrew; Bouhali, Othmane; Eusebi, Ricardo; Flanagan, Will; Gilmore, Jason; Kamon, Teruki; Khotilovich, Vadim; Montalvo, Roy; Osipenkov, Ilya; Pakhotin, Yuriy; Perloff, Alexx; Roe, Jeffrey; Safonov, Alexei; Sakuma, Tai; Suarez, Indara; Tatarinov, Aysen; Toback, David; Akchurin, Nural; Cowden, Christopher; Damgov, Jordan; Dragoiu, Cosmin; Dudero, Phillip Russell; Kovitanggoon, Kittikul; Lee, Sung Won; Libeiro, Terence; Volobouev, Igor; Appelt, Eric; Delannoy, Andrés G; Greene, Senta; Gurrola, Alfredo; Johns, Willard; Maguire, Charles; Mao, Yaxian; Melo, Andrew; Sharma, Monika; Sheldon, Paul; Snook, Benjamin; Tuo, Shengquan; Velkovska, Julia; Arenton, Michael Wayne; Boutle, Sarah; Cox, Bradley; Francis, Brian; Goodell, Joseph; Hirosky, Robert; Ledovskoy, Alexander; Lin, Chuanzhe; Neu, Christopher; Wood, John; Gollapinni, Sowjanya; Harr, Robert; Karchin, Paul Edmund; Kottachchi Kankanamge Don, Chamath; Lamichhane, Pramod; Sakharov, Alexandre; Belknap, Donald; Borrello, Laura; Carlsmith, Duncan; Cepeda, Maria; Dasu, Sridhara; Duric, Senka; Friis, Evan; Grothe, Monika; Hall-Wilton, Richard; Herndon, Matthew; Hervé, Alain; Klabbers, Pamela; Klukas, Jeffrey; Lanaro, Armando; Loveless, Richard; Mohapatra, Ajit; Mozer, Matthias Ulrich; Ojalvo, Isabel; Perry, Thomas; Pierro, Giuseppe Antonio; Polese, Giovanni; Ross, Ian; Sarangi, Tapas; Savin, Alexander; Smith, Wesley H; Swanson, Joshua

    2013-10-29

    The polarizations of prompt J/$\\psi$ and $\\psi$(2S) mesons are measured in proton-proton collisions at $\\sqrt{s}$ = 7 TeV, using a dimuon data sample collected by the CMS experiment at the LHC, corresponding to an integrated luminosity of 4.9 inverse femtobarns. The prompt J/$\\psi$ and $\\psi$(2S) polarization parameters $\\lambda_{\\theta}, \\lambda_{\\phi}$, and $\\lambda_{\\theta,\\phi}$, as well as the frame-invariant quantity $\\tilde\\lambda$, are measured from the dimuon decay angular distributions in three different polarization frames. The J/$\\psi$ results are obtained in the transverse momentum range 14 $\\lt p_T \\lt$ 70 GeV, in the rapidity intervals abs(y) $\\lt 0.6$ and $0.6 \\lt abs(y) \\lt 1.2$. The corresponding $\\psi$(2S) results cover 14 $\\lt p_T \\lt$ 50 GeV and include a third rapidity bin, 1.2 $\\lt abs(y) \\lt$ 1.5. No evidence of large transverse or longitudinal polarizations is seen in these kinematic regions, which extend much beyond those previously explored.

  13. A THEORETICAL STUDY OF THE BUILD-UP OF THE SUN’S POLAR MAGNETIC FIELD BY USING A 3D KINEMATIC DYNAMO MODEL

    Energy Technology Data Exchange (ETDEWEB)

    Hazra, Gopal; Choudhuri, Arnab Rai [Department of Physics, Indian Institute of Science, Bangalore, 560012 (India); Miesch, Mark S., E-mail: ghazra@physics.iisc.ernet.in, E-mail: arnab@physics.iisc.ernet.in, E-mail: miesch@ucar.edu [High Altitude Observatory, National Center for Atmospheric Research, Boulder, CO 80301 (United States)

    2017-01-20

    We develop a three-dimensional kinematic self-sustaining model of the solar dynamo in which the poloidal field generation is from tilted bipolar sunspot pairs placed on the solar surface above regions of strong toroidal field by using the SpotMaker algorithm, and then the transport of this poloidal field to the tachocline is primarily caused by turbulent diffusion. We obtain a dipolar solution within a certain range of parameters. We use this model to study the build-up of the polar magnetic field and show that some insights obtained from surface flux transport models have to be revised. We present results obtained by putting a single bipolar sunspot pair in a hemisphere and two symmetrical sunspot pairs in two hemispheres. We find that the polar fields produced by them disappear due to the upward advection of poloidal flux at low latitudes, which emerges as oppositely signed radial flux and which is then advected poleward by the meridional flow. We also study the effect that a large sunspot pair, violating Hale’s polarity law, would have on the polar field. We find that there would be some effect—especially if the anti-Hale pair appears at high latitudes in the mid-phase of the cycle—though the effect is not very dramatic.

  14. Subcycle interference dynamics of time-resolved photoelectron holography with midinfrared laser pulses

    International Nuclear Information System (INIS)

    Bian Xuebin; Yuan, Kai-Jun; Bandrauk, Andre D.; Huismans, Y.; Smirnova, O.; Vrakking, M. J. J.

    2011-01-01

    Time-resolved photoelectron holography from atoms using midinfrared laser pulses is investigated by solving the corresponding time-dependent Schroedinger equation (TDSE) and a classical model, respectively. The numerical simulation of the photoelectron angular distribution of Xe irradiated with a low-frequency free-electron laser source agrees well with the experimental results. Different types of subcycle interferometric structures are predicted by the classical model. Furthermore with the TDSE model it is demonstrated that the holographic pattern is sensitive to the shape of the atomic orbitals. This is a step toward imaging by means of photoelectron holography.

  15. Temperature-Dependent Photoelectron Spectroscopy of Methyl-Benzoate Anions: Observation of Steric Effect in Ortho-Methyl-Benzoate

    Energy Technology Data Exchange (ETDEWEB)

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

    2005-12-22

    Temperature-dependent photoelectron spectra of benzoate anion (C6H5CO2-) and its three methyl-substituted isomers (o-, m-, p-CH3C6H4CO2-) have been obtained using a newly developed low-temperature photoelectron spectroscopy apparatus that features an electrospray source and a cryogenically controlled ion trap. Detachment channels due to removing electrons from the carboxylate group and benzene ring electrons were distinctly observed. Well-resolved vibrational structures were obtained in the lower binding energy region due to the OCO bending modes, except for o-CH3C6H4CO2-, which yielded broad spectra even at the lowest ion trap temperature (18 K). Theoretical calculations revealed a large geometry change in the OCO angles between the anion and neutral ground states, consistent with the broad ground state bands observed for all species. A strong steric effect was observed between the carboxylate and the methyl group in o-CH3C6H4CO2-, such that the -CO2- group is pushed out of the plane of the benzene ring by {approx}25 degrees and its internal rotational barrier is significantly reduced. The low rotational barrier in o-CH3C6H4CO2-, which makes it very difficult to be cooled vibrationally, and the strong coupling between the OCO bending and CO2 torsional modes yielded the broad PES spectra for this isomer. It is shown that there is no C-H?O hydrogen bond in o-CH3C6H4CO2- and the interaction between the carboxylate and methyl groups in this anion is found to be repulsive in nature.

  16. Dissociative Ionization Mechanism and Appearance Energies in Adipic Acid Revealed by Imaging Photoelectron Photoion Coincidence, Selective Deuteration, and Calculations.

    Science.gov (United States)

    Heringa, Maarten F; Slowik, Jay G; Prévôt, André S H; Baltensperger, Urs; Hemberger, Patrick; Bodi, Andras

    2016-05-26

    Adipic acid, a model compound for oxygenated organic aerosol, has been studied at the VUV beamline of the Swiss Light Source. Internal energy selected cations were prepared by threshold photoionization using vacuum ultraviolet synchrotron radiation and imaging photoelectron photoion coincidence spectroscopy (iPEPICO). The threshold photoelectron spectrum yields a vertical ionization energy (IE) of 10.5 eV, significantly above the calculated adiabatic IE of 8.6 eV. The cationic minimum is accessible after vertical ionization by H-transfer from one of the γ-carbons to a carbonyl oxygen and is sufficiently energetic to decay by water loss at the ionization onset. The slope of the breakdown curves, quantum chemical calculations, and selective deuteration of the carboxylic hydrogens establish the dissociative photoionization mechanism. After ionization, one γ-methylene hydrogen and the two carboxylic hydrogens are randomized prior to H2O loss. On the basis of the deuteration degree in the H2O + CO-loss product at higher energies, a direct water-loss channel without complete randomization also exists. The breakdown diagram and center of gravity of the H2O + CO-loss peak were modeled to obtain 0 K appearance energies of 10.77, 10.32, and 11.53 eV for H2O + CO loss, CH2COOH loss, and H2O + CH2COOH loss from adipic acid. These agree well with the CBS-QB3 calculated values of 10.68, 10.45, and 11.57 eV, respectively, which shows that threshold photoionization can yield energetics data as long as the dissociation is statistical, even when the parent ion cannot be observed. The results can be used as a starting point for a deeper understanding of the ionization and low-energy fragmentation of organic aerosol components.

  17. Photoelectron diffraction studies of small adsorbates on single crystal surfaces

    International Nuclear Information System (INIS)

    Pascal, Mathieu

    2002-01-01

    The structural determination of small molecules adsorbed on single crystal surfaces has been investigated using scanned energy mode photoelectron diffraction (PhD). The experimental PhD data were compared to theoretical models using a simulation program based on multiple scattering calculations. Three adsorption systems have been examined on Ag(110), Cu(110) and Cu(111) crystals. The structure of the (2x1)-O adsorption phase on Ag(110) revealed that the O atoms occupied the long bridge site and are almost co-planar with the top layer of Ag atoms. The best agreement between multiple scattering theory and experiment has been obtained for a missing-row (or equivalently an 'added- row') reconstruction. Alternative buckled-row and unreconstructed surface models can be excluded. The adsorption of the benzoate species on Cu(110) has been found to occur via the carboxylate group. The molecules occupy short bridge sites with the O atoms being slightly displaced from atop sites and are aligned along the close-packed azimuth. The tilt of the molecule with respect to the surface and the degree to which the surface is relaxed have also been investigated. The adsorption of methyl on Cu(111) was studied using either azomethane or methyl iodide to prepare the surface layers. At saturation coverage the preferred adsorption site is the fcc threefold hollow site, whereas at half saturation coverage ∼ 30 % of the methyl species occupy the hop threefold hollow sites. Best agreement between theory and experiment corresponded to a methyl group adsorbed with C 3v symmetry. The height of the C above the surface in a pure methyl layer was 1.66 ± 0.02 A, but was reduced to 1.62 ± 0.02 A in the presence of co-adsorbed iodine, suggesting that iodine increases the strength of adsorption. Iodine was also found to occupy the fee threefold hollow sites with a Cu-l bondlength of 2.61 ± 0.02 A. (author)

  18. 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

  19. Corrosion and degradation studies utilizing X-ray photoelectron spectroscopy

    Science.gov (United States)

    Hixson, Holly Gwyndolen

    1997-08-01

    This dissertation involves studies of corrosion behavior at the surface of various metal samples, as well as the degradation of wool fibers obtained from the Star-Spangled Banner. Molybdenum metal and iron-zinc alloys were examined under corrosive conditions, and the degradation of the wool fibers was studied. The behavior of a polished molybdenum metal surface upon exposure to both aerated and deaerated water and 1.0 M NaCl solution was studied by X-ray Photoelectron Spectroscopy (XPS). Exposure to deaerated water and NaCl failed to produce oxidation of the metal surfaces, but exposing the polished metal surface to aerated water produced significant oxidation. Metal surfaces cleaned by argon-ion etching were found to be inert to oxidation by aerated water. The etching process also appears to passivate the metal surface. The behavior of molybdenum metal in 0.5 M Hsb2SOsb4 treated at various potentials has been studied using core and valence band XPS. The study indicates that Mosp{IV} and Mosp{VI} (including possibly Mosp{V} in some cases) were formed as the potential of the system was increased within the active range of molybdenum. The corrosive behavior of iron-zinc alloys that have been electroplated on plain steel in both aerated and deaerated quadruply-distilled water has been studied using XPS. Several different iron-zinc alloys were electroplated for comparative purposes: an iron-rich alloy, a zinc-rich alloy, and an alloy of similar iron and zinc composition. Treatment in aerated water produces oxidation for the iron-rich and similar composition alloys, but the oxide is reduced for the zinc-rich alloy. Degradation of the fibers in the original Star-Spangled Banner has been monitored using XPS and Scanning Electron Microscopy (SEM). Comparison of white and red wool fibers and linen fibers from the flag with new, mechanically-abraded, and chemically-treated white, red, and linen fibers, respectively, was performed in an attempt to determine the fibers' levels

  20. 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

  1. Determination of the Electron Affinity of the Acetyloxyl Radical (CH3COO) by Low-Temperature Anion Photoelectron Spectroscopy and ab Initio Calculations

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Xue B.; Woo, Hin-koon; Wang, Lai S.; Minofar, Babak; Jungwirth, Pavel

    2006-04-20

    The electronic structure and electron affinity of the acetyloxyl radical (CH3COO) were investigated by low-temperature anion photoelectron spectroscopy and ab initio calculations. Photoelectron spectra of the acetate anion (CH3COO-) were obtained at two photon energies (355 and 266 nm) and under three different temperatures (300, 70, and 20 K) using a new low temperature ion-trap photoelectron spectroscopy apparatus. In contrast to a featureless spectrum at 300 K, a well-resolved vibrational progression corresponding to the OCO bending mode was observed at low temperatures in the 355 nm spectrum, yielding an accurate electron affinity for the acetyloxyl radical as 3.250 + 0.010 eV. This experimental result is supported by ab initio calculations, which also indicate three low-lying electronic states observed in the 266 nm spectrum. The calculations suggest a 19° decrease of the OCO angle upon detaching an electron from acetate, consistent with the vibrational progression observed experimentally.

  2. Renner-Teller effects in the photoelectron spectra of CNC, CCN, and HCCN.

    Science.gov (United States)

    Coudert, Laurent H; Gans, Bérenger; Garcia, Gustavo A; Loison, Jean-Christophe

    2018-02-07

    The line intensity of photoelectron spectra when either the neutral or cationic species display a Renner-Teller coupling is derived and applied to the modeling of the photoelectron spectra of CNC, CCN, and HCCN. The rovibronic energy levels of these three radicals and of their cations are investigated starting from ab initio results. A model treating simultaneously the bending mode and the overall rotation is developed to deal with the quasilinearity problem in CNC + , CCN + , and HCCN and accounts for the large amplitude nature of their bending mode. This model is extended to treat the Renner-Teller coupling in CNC, CCN, and HCCN + . Based on the derived photoelectron line intensity, the photoelectron spectra of all three molecules are calculated and compared to the experimental ones.

  3. A study of the valence shell photoelectron and photoabsorption spectra of CF3SF5

    International Nuclear Information System (INIS)

    Holland, D M P; Shaw, D A; Walker, I C; McEwen, I J; Apra, E; Guest, M F

    2005-01-01

    The outer valence shell photoelectron spectrum of CF 3 SF 5 has been studied experimentally and theoretically. Synchrotron radiation has been used to record angle-resolved outer valence shell photoelectron spectra of CF 3 SF 5 in the photon energy range 18-60 eV. These spectra have allowed photoelectron asymmetry parameters and branching ratios to be derived. The Outer Valence Green's Function approach has been employed to calculate the molecular orbital configuration and associated binding energies. A charge distribution analysis has also been obtained. Assignments have been proposed for the peaks observed in the photoelectron spectrum. The absolute photoabsorption cross section of CF 3 SF 5 has been measured from threshold to 40 eV, and strongly resembles that of SF 6 . Assignments, involving intravalence transitions, have been proposed for some of the principal features appearing in the photoabsorption spectrum of CF 3 SF 5

  4. Atomic and molecular photoelectron and Auger-electron-spectroscopy studies using synchrotron radiation

    International Nuclear Information System (INIS)

    Southworth, S.H.

    1982-01-01

    Electron spectroscopy, combined with synchrotron radiation, was used to measure the angular distributions of photoelectrons and Auger electrons from atoms and molecules as functions of photon energy. The branching ratios and partial cross sections were also measured in certain cases. By comparison with theoretical calculations, the experimental results are interpreted in terms of the characteristic electronic structure and ionization dynamics of the atomic or molecular sample. The time structure of the synchrotron radiation source was used to record time-of-flight (TOF) spectra of the ejected electrons. The double-angle-TOF method for the measurement of photoelectron angular distributions is discussed. This technique offers the advantages of increased electron collection efficiency and the elimination of certain systematic errors. An electron spectroscopy study of inner-shell photoexcitation and ionization of Xe, photoelectron angular distributions from H 2 and D 2 , and photoionization cross sections and photoelectron asymmetries of the valence orbitals of NO are reported

  5. Multiple scattering theory of photoelectron angular distributions from oriented diatomic molecules

    Energy Technology Data Exchange (ETDEWEB)

    Diez Muino, R.; Rolles, D.; Garcia de Abajo, F.J.; Fadley, C.S.; Van Hove, M.A.

    2001-09-17

    We use multiple scattering photoelectron diffraction (MSPD) theory to calculate the angular patterns of electrons photoemitted from the K shell of CO and N2 gas-phase oriented molecules, as recently measured by several groups.

  6. Femtosecond x-ray photoelectron diffraction on gas-phase dibromobenzene molecules

    International Nuclear Information System (INIS)

    Rolles, D; Boll, R; Epp, S W; Erk, B; Foucar, L; Hömke, A; Adolph, M; Gorkhover, T; Aquila, A; Chapman, H N; Coppola, N; Delmas, T; Gumprecht, L; Holmegaard, L; Bostedt, C; Bozek, J D; Coffee, R; Decleva, P; Filsinger, F; Johnsson, P

    2014-01-01

    We present time-resolved femtosecond photoelectron momentum images and angular distributions of dissociating, laser-aligned 1,4-dibromobenzene (C 6 H 4 Br 2 ) molecules measured in a near-infrared pump, soft-x-ray probe experiment performed at an x-ray free-electron laser. The observed alignment dependence of the bromine 2p photoelectron angular distributions is compared to density functional theory calculations and interpreted in terms of photoelectron diffraction. While no clear time-dependent effects are observed in the angular distribution of the Br(2p) photoelectrons, other, low-energy electrons show a pronounced dependence on the time delay between the near-infrared laser and the x-ray pulse. (paper)

  7. 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.

  8. Yield stress fluids slowly yield to analysis

    NARCIS (Netherlands)

    Bonn, D.; Denn, M.M.

    2009-01-01

    We are surrounded in everyday life by yield stress fluids: materials that behave as solids under small stresses but flow like liquids beyond a critical stress. For example, paint must flow under the brush, but remain fixed in a vertical film despite the force of gravity. Food products (such as

  9. Bond yield curve construction

    Directory of Open Access Journals (Sweden)

    Kožul Nataša

    2014-01-01

    Full Text Available In the broadest sense, yield curve indicates the market's view of the evolution of interest rates over time. However, given that cost of borrowing it closely linked to creditworthiness (ability to repay, different yield curves will apply to different currencies, market sectors, or even individual issuers. As government borrowing is indicative of interest rate levels available to other market players in a particular country, and considering that bond issuance still remains the dominant form of sovereign debt, this paper describes yield curve construction using bonds. The relationship between zero-coupon yield, par yield and yield to maturity is given and their usage in determining curve discount factors is described. Their usage in deriving forward rates and pricing related derivative instruments is also discussed.

  10. Structure determination by photoelectron diffraction of small molecules on surfaces

    International Nuclear Information System (INIS)

    Booth, N.A.

    1998-05-01

    The synchrotron radiation based technique of Photoelectron Diffraction (PhD) has been applied to three adsorption systems. Structure determinations, are presented for each system which involve the adsorption of small molecules on the low index {110} plane of single crystal Cu and Ni substrates. For the NH 3 -Cu(110) system PhD was successful in determining a N-Cu bondlength of 2.05 ± 0.03 A as well as values for the anisotropic vibrational amplitudes of the N and an expansion of the 1st to 2nd Cu substrate layer spacing from the bulk value of 0.08 ± 0.08 A. The most significant and surprising structural parameter determined for this system was that the N atom occupies an asymmetric adsorption site. Rather than being situated in the expected high symmetry atop site the N atom was found to be offset parallel to the surface by 0.37 ± 0.12 A in the [001] azimuth. In studying the glycine-Cu(110) system the adsorption structure of an amino-acid has been quantified. The local adsorption geometries of all the atoms involved in the molecule to surface bond have been determined. The glycine molecule is found to be bonded to the surface via both its amino and carboxylate functional groups. The molecule straddles two [11-bar0] rows of the Cu substrate. The two O atoms are found to be in identical sites both approximately atop Cu atoms on the [11-bar0] rows offset parallel to the surface by 0.80 ± 0.05 A in the [001] azimuth, the O-Cu bondlength was found to be 2.03 ± 0.05 A. The N atom was also found to adsorb in an approximately atop geometry but offset parallel to the surface by 0.24 ± 0.10A in the [11-bar0] direction, the N-Cu bondlength was found to be 2.05± 0.05 A. PhD was unsuccessful in determining the positions of the two C atoms that form a bridge between the two functional groups bonded to the surface due to difficulties in separating the two inequivalent contributions to the final intensity modulation function. For the CN-Ni(110) system both PhD and Near Edge

  11. 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, CH x CN (x = 0-2) and CNC, formed in a microwave discharge flow-tube reactor by consecutive H abstractions from CH 3 CN (CH x CN + F → CH x-1 CN + 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 H 2 CCN complement existing ones while for the other radicals the data represent the first observation of their (single-photon) ionizing transitions. In the case of H 2 CCN, Franck-Condon calculations have been performed in order to assign the vibrational structure of the X + 1 A 1 ←X 2 B 1 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 (Δ f H 298 0 (HCCN + (X 2 A ' ))=1517±12kJmol -1 ,Δ f H 298 0 (CCN(X 2 Π))=682±13kJmol -1 , and Δ f H 298 0 (CNC(X 2 Πg))=676±12kJmol -1 ), which are of fundamental importance for astrochemistry.

  12. 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.

  13. DEVELOPMENT OF NEXT-GENERATION DETECTORS AND INSTRUMENTATION FOR PHOTOELECTRON SPECTROSCOPY, DIFFRACTION AND HOLOGRAPHY

    International Nuclear Information System (INIS)

    Charles S. Fadley, Principal Investigator

    2005-01-01

    We have developed a new multichannel detector for use in photoelectron spectroscopy (as well as other types of high-count-rate spectroscopy) that will operate at rates of up to 1 GHz. Such detectors are crucial to the full utilization of the high-brightness radiation generated by third-generation synchrotron radiation sources. In addition, new software and hardware has been developed to permit rapidly and accurately scanning photoelectron spectra that will be accumulated in as little as a 200 micros. A versatile next-generation sample goniometer permitting equally rapid scanning of specimen angles or photon energies for angle-resolved photoemission studies, photoelectron diffraction, and photoelectron holography measurements, and cooling to below 10K has also been designed and constructed. These capabilities have been incorporated into a unique photoelectron spectrometer/diffractometer at the Advanced Light Source of the Lawrence Berkeley National Laboratory; this experimental system includes ultrahigh energy resolution, in situ rotation, variable polarization, and optional spin detection. This overall system is now being used in studies of a variety of problems including magnetic metals and oxides; metal/metal, metal/metal oxide, and metal-oxide/metal-oxide multilayers; and systems exhibiting giant and colossal magnetoresistance

  14. 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.

  15. Probing the Low-Barrier Hydrogen Bond in Hydrogen Maleate in the Gas Phase: A Photoelectron Spectroscopy and ab Initio Study

    Energy Technology Data Exchange (ETDEWEB)

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

    2005-12-01

    The strength of the low-barrier hydrogen bond in hydrogen maleate in the gas phase was investigated by low-temperature photoelectron spectroscopy and ab initio calculations. Photoelectron spectra of maleic and fumaric acid monoanions (cis-/trans-HO2CCHdCHCO2 -) were obtained at low temperatures and at 193 nm photon energy. Vibrational structure was observed for trans-HO2CCHdCHCO2 - due to the OCO bending modes; however, cis-HO2CCHdCHCO2 - yielded a broad and featureless spectrum. The electron binding energy of cis-HO2CCHdCHCO2 - is about 1 eV blue-shifted relative to trans-HO2CCHdCHCO2 - due to the formation of intramolecular hydrogen bond in the cis-isomer. Theoretical calculations (CCSD(T)/ aug-cc-pVTZ and B3LYP/aug-cc-pVTZ) were carried out to estimate the strength of the intramolecular hydrogen bond in cis-HO2CCHdCHCO2 -. Combining experimental and theoretical calculations yields an estimate of 21.5 ( 2.0 kcal/mol for the intramolecular hydrogen bond strength in hydrogen maleate.

  16. Yield and yield component analysis of twelve upland rice genotypes ...

    African Journals Online (AJOL)

    Multiple correlation and path coefficient analysis were used to study yield and yield components. Genotypic stability analysis was performed on the yield and the two traits most related to yield using mean yield-coefficient of variation (CV). The genotype, ITA 324 had the highest grain yield and percentage fertile spikelets in ...

  17. Stereo photograph of atomic arrangement by circularly-polarized-light two-dimensional photoelectron spectroscopy

    CERN Document Server

    Daimon, H

    2003-01-01

    A stereo photograph of atomic arrangement was obtained for the first time. The stereo photograph was displayed directly on the screen of display-type spherical-mirror analyzer without any computer-aided conversion process. This stereo photography was realized taking advantage of the phenomenon of circular dichroism in photoelectron angular distribution due to the reversal of orbital angular momentum of photoelectrons. The azimuthal shifts of forward focusing peaks in a photoelectron angular distribution pattern taken with left and right helicity light in a special arrangement are the same as the parallaxes in a stereo view of atoms. Hence a stereoscopic recognition of three-dimensional atomic arrangement is possible, when the left eye and the right eye respectively view the two images obtained by left and right helicity light simultaneously.

  18. 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...

  19. Transient photoelectron spectroscopy of the dissociative Br2(1Piu) state.

    Science.gov (United States)

    Strasser, Daniel; Goulay, Fabien; Leone, Stephen R

    2007-11-14

    Photodissociation of bromine on the Br2(1Piu) state is probed with ultrafast extreme ultraviolet (53.7 nm) single-photon ionization. Time-resolved photoelectron spectra show simultaneously the depletion of ground state bromine molecules as well as the rise of Br(2P3/2) products due to 402.5 nm photolysis. A partial photoionization cross-section ratio of atomic versus molecular bromine is obtained. Transient photoelectron spectra of a dissociative wave packet on the excited state are presented in the limit of low-power-density, single-photon excitation to the dissociative state. Transient binding energy shifts of "atomic-like" photoelectron peaks are observed and interpreted as photoionization of nearly separated Br atom pairs on the Br2(1Piu) state to repulsive dissociative ionization states.

  20. Photoelectron spectra as a probe of double-core resonsance in two-electron atoms

    International Nuclear Information System (INIS)

    Grobe, R.; Haan, S.L.; Eberly, J.H.

    1996-01-01

    The authors calculate photoelectron spectra for a two-electron atom under the influence of two external driving fields, using an essential states formalism. They focus on the regime of so-called coherence transfer, in which electron-electron correlation transfers field-induced photo-coherence from one electron to the other. In the case studied here, two laser fields are resonant with coupled atomic transitions, in the manner familiar from three-level dark-state spectroscopy. Dynamical two electron effects are monitored via the photoelectron energy spectrum. The authors show that the distribution of the photoelectron energies can be singly, doubly or triply peaked depending on the relative laser intensities. The electron spectra are independent of the turn-on sequence of the fields

  1. Ar 3p photoelectron sideband spectra in two-color XUV + NIR laser fields

    Science.gov (United States)

    Minemoto, Shinichirou; Shimada, Hiroyuki; Komatsu, Kazma; Komatsubara, Wataru; Majima, Takuya; Mizuno, Tomoya; Owada, Shigeki; Sakai, Hirofumi; Togashi, Tadashi; Yoshida, Shintaro; Yabashi, Makina; Yagishita, Akira

    2018-04-01

    We performed photoelectron spectroscopy using femtosecond XUV pulses from a free-electron laser and femtosecond near-infrared pulses from a synchronized laser, and succeeded in measuring Ar 3p photoelectron sideband spectra due to the two-color above-threshold ionization. In our calculations of the first-order time-dependent perturbation theoretical model based on the strong field approximation, the photoelectron sideband spectra and their angular distributions are well reproduced by considering the timing jitter between the XUV and the NIR pulses, showing that the timing jitter in our experiments was distributed over the width of {1.0}+0.4-0.2 ps. The present approach can be used as a method to evaluate the timing jitter inevitable in FEL experiments.

  2. 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.

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

    International Nuclear Information System (INIS)

    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 2 and CO were studied with vibrational resolution. Vibrationally resolved synchrotron radiation was used to study the dissociation of N 2 , C 2 H 4 , and CH 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

  4. 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.

  5. Observations of OI 7774 emission excited by conjugate photoelectrons. [ionosonde data analhysis

    Science.gov (United States)

    Christensen, A. B.

    1975-01-01

    Observations and computer calculations of O I 7774 A airglow emissions excited by conjugate photoelectrons have been carried out. The observations were made at McDonald Observatory, Texas using a 2 m grille spectrometer from December 1972 to June 1973. The zenithal emission intensity during conjugate photoelectron precipitation was fairly constant at 2-4 R until conjugate sunset, after which it diminished steadily and ceased near a conjugate solar zenith angle of 105 (plus or minus 3) deg. A predawn enhancement in both O I 7774 A and forbidden O I 6300 A was observed to commence near 102 deg. The computations utilize the two-stream technique of Nagy and Banks (1970) to obtain the escaping photoelectron flux and the local excitation rates of the oxygen emissions. Good agreement with the observations is obtained for the dependence of the emission rate on conjugate solar zenith angle.

  6. Characterization of EUV irradiation effects on polystyrene derivatives studied by x-ray photoelectron spectroscopy (XPS) and ultraviolet photoelectron spectroscopy (UPS)

    Science.gov (United States)

    Yamamoto, Hiroki; Kozawa, Takahiro; Tagawa, Seiichi

    2011-04-01

    The trade-off among resolution, sensitivity, and line edge roughness (LER) is the most serious problem in actualization of extreme ultraviolet (EUV). As feature sizes are reduced, it becomes very strict to simultaneously meet these requirements. Also, reaction in resist materials induced by EUV photon is more complicate. In chemically amplified EUV resists, not acid generator but polymers mainly adsorbed EUV photons. The secondary electrons are generated from polymer upon exposure to ionizing radiation such as EUV radiation and electron beam. Therefore, the increase in secondary electrons generated by EUV photons adsorbed in resist film is very important factor in the resist design. Therefore, it is essential to know the ionization mechanisms of backbone polymers and understand the reaction mechanism in details in order to accomplish high sensitivity and ultra-fine pattern in EUV lithography. We investigated the photoelectron spectra of typical backbone polymers for chemically amplified EUV resists using ultraviolet photoelectron spectroscopy (UPS). Also, the structure degradations in polystyrene (PS) derivatives thin films induced by EUV radiation were analyzed by X-ray photoelectron spectroscopy (XPS) and UPS.

  7. The adsorption of mercury on tungsten (100) studied by ultra-violet photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Egelhoff, W.F. Jr.; Perry, D.L.; Linnett, J.W.

    1976-01-01

    In recent years, photoelectron spectroscopy has been applied to the study of adsorption on several metal surfaces. A popular choice of substrate has been the 100 face of single crystal tungsten, since adsorption on this surface has been well-characterised by a wide variety of experimental techniques. In this letter a study of the adsorption of mercury on W(100) by ultra-violet photoelectron spectroscopy (UPS) is reported. These results, seen in the context of previous UPS studies of chemisorption, show a number of interesting features. (Auth.)

  8. Angular distribution of photoelectrons from atomic oxygen, nitrogen and carbon. [in upper atmosphere

    Science.gov (United States)

    Manson, S. J.; Kennedy, D. J.; Starace, A. F.; Dill, D.

    1974-01-01

    The angular distributions of photoelectrons from atomic oxygen, nitrogen, and carbon are calculated. Both Hartree-Fock and Hartree-Slater (Herman-Skillman) wave functions are used for oxygen, and the agreement is excellent; thus only Hartree-Slater functions are used for carbon and nitrogen. The pitch-angle distribution of photoelectrons is discussed, and it is shown that previous approximations of energy-independent isotropic or sin squared theta distributions are at odds with the authors' results, which vary with energy. This variation with energy is discussed, as is the reliability of these calculations.

  9. The potentialities of ion beam diagnostics by photoelectrons with an angular asymmetry parameter β0 =-1

    International Nuclear Information System (INIS)

    Artemov, A.S.; Avidzba, A.A.

    1993-01-01

    For the photoelectrons, produced with an angular asymmetry parameter β 0 = -1, by numerical simulation the corresponding 'own' distributions in the space of transverse momenta and energy of the laboratory frame, are obtained. The potentialities of beam diagnostics are considered for the case when information about its parameters is passed to a flux of these electrons as the result of single-photon ionization of ions in a beam or intermediate particles, taking out beam information outside. Alongside to this, relatively small polarization influence of probing photon target on the repetition accuracy of phase space portrait of the beam by photoelectrons, is taking place. (author.). 13 refs.; 9 figs

  10. Photoelectron interference fringes by super intense x-ray laser pulses

    International Nuclear Information System (INIS)

    Toyota, Koudai; Morishita, Toru; Watanabe, Shinichi; Tolstikhin, Oleg I

    2009-01-01

    The photoelectron spectra of H - produced by circularly polarized strong high-frequency laser pulses are theoretically studied. An oscillating substructure in the above-threshold ionization (ATI) peaks is observed, which extends the validity of the earlier findings in the 1D calculations [K. Toyota et al., Phys. Rev. A 76, 043418 (2007)] and 3D calculations for linear polarization [O. I. Tolstikhin, Phys. Rev. A 77, 032712 (2008)]. Its origin is due to an interference between a pair of photoelectron wave packets created in the rising and falling part of the pulse, which appears clearly in the stabilization regime.

  11. Molecular frame photoelectron angular distribution for oxygen 1s photoemission from CO2 molecules

    International Nuclear Information System (INIS)

    Saito, N; Ueda, K; De Fanis, A

    2005-01-01

    We have measured photoelectron angular distributions in the molecular frame (MF-PADs) for O 1s photoemission from CO 2 , using photoelectron-O + -CO + coincidence momentum imaging. Results for the molecular axis at 0, 45 and 90 0 to the electric vector of the light are reported. The major features of the MF-PADs are fairly well reproduced by calculations employing a relaxed-core Hartree-Fock approach. Weak asymmetric features are seen through a plane perpendicular to the molecular axis and attributed to symmetry lowering by anti-symmetric stretching motion. (letter to the editor)

  12. Non-dipole angular anisotropy parameters of photoelectrons from semi-filled shell atoms

    Energy Technology Data Exchange (ETDEWEB)

    Amusia, M Ya [Racah Institute of Physics, Hebrew University, Jerusalem 91904 (Israel); Chernysheva, L V [Ioffe Physical-Technical Institute, St-Petersburg 194021 (Russian Federation)

    2006-11-28

    We present the results of calculations of outer and next to outer shell non-dipole angular anisotropy parameters of photoelectrons for semi-filled shell atoms in the Hartree-Fock (HF) one-electron approximation and in the frame of the spin polarized random phase approximation with exchange (SP RPAE) which takes into account inter-electron correlations. We demonstrate for the first time that this characteristic of the photoionization process is essentially sensitive to whether the photoelectron has the same or opposite spin orientation to that of the semi-filled shell.

  13. Non-dipole angular anisotropy parameters of photoelectrons from semi-filled shell atoms

    International Nuclear Information System (INIS)

    Amusia, M Ya; Chernysheva, L V

    2006-01-01

    We present the results of calculations of outer and next to outer shell non-dipole angular anisotropy parameters of photoelectrons for semi-filled shell atoms in the Hartree-Fock (HF) one-electron approximation and in the frame of the spin polarized random phase approximation with exchange (SP RPAE) which takes into account inter-electron correlations. We demonstrate for the first time that this characteristic of the photoionization process is essentially sensitive to whether the photoelectron has the same or opposite spin orientation to that of the semi-filled shell

  14. Secondary Electron Yield on Cryogenic Surfaces as a Function of Physisorbed Gases

    CERN Document Server

    Kuzucan, Asena; Taborelli, Mauro

    2011-01-01

    In LHC the electron cloud induced by photoelectrons, gas ionization and secondary electrons emitted from the beam pipe walls could be a limitation of the performance. The electron cloud induce heat load on the cryogenic system, cause pressure rise, emittance growth and beam instabilities, which in the end will limit the beam’s lifetime. Beam- induced multipacting, which can arise through oscillatory motion of photoelectrons and low-energy secondary electrons bouncing back and forth between opposite walls of the vacuum chamber during successive passage of proton bunches, represent therefore a potential problem for the machine. The secondary electron yield (SEY) is one of the key parameters for the electron cloud build up and multipacting phenomenon. An electron cloud occurs if the metal surface secondary electron yield is high enough for electron multiplication. This parameter has been extensively studied on room temperature samples but uncertainties remain for samples at cryogenic temperature. Indeed, at l...

  15. Enhancement of HHG yield

    International Nuclear Information System (INIS)

    Serrat, C.; Biegert, J.

    2011-01-01

    A static electric field periodically distributed in space controls and enhances the yield in high harmonic generation. The method is relatively simple to implement and allows tuning from the extreme-ultraviolet to soft X-ray. The radiation yield is selectively enhanced due to symmetry breaking induced by a static electric field on the interaction between the driving laser and the medium. The enhanced spectral region is tuned by varying the periodicity of the static electric field. Simulations predict an increase of more than two orders of magnitude for harmonics in the water window spectral range.

  16. Layer-resolved photoelectron diffraction: electron attenuation anisotropy in GaAs

    Czech Academy of Sciences Publication Activity Database

    Bartoš, Igor; Cukr, Miroslav; Jiříček, Petr

    2012-01-01

    Roč. 185, 5-7 (2012), 184-187 ISSN 0368-2048 Grant - others:AVČR(CZ) Praemium Academiae Institutional research plan: CEZ:AV0Z10100521 Keywords : low-energy electron attenuation in GaAs * layer-resolved photoelectron diffraction * synchrotron radiation Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.706, year: 2012

  17. Ion clearing and photoelectron production in the 200 MeV SXLS ring

    International Nuclear Information System (INIS)

    Halama, H.; Bozoki, E.

    1991-01-01

    The design of the SXLS clearing system and its behavior are presented. In normal 200 MeV operation, clearing electrode current is dominated by photoelectrons. Clearing electrodes appear essential only in several locations but not in the dipoles. The effect of clearing voltage on the tune and the beam profile is also discussed. 4 refs., 5 figs

  18. An analytical investigation: Effect of solar wind on lunar photoelectron sheath

    Science.gov (United States)

    Mishra, S. K.; Misra, Shikha

    2018-02-01

    The formation of a photoelectron sheath over the lunar surface and subsequent dust levitation, under the influence of solar wind plasma and continuous solar radiation, has been analytically investigated. The photoelectron sheath characteristics have been evaluated using the Poisson equation configured with population density contributions from half Fermi-Dirac distribution of the photoemitted electrons and simplified Maxwellian statistics of solar wind plasma; as a consequence, altitude profiles for electric potential, electric field, and population density within the photoelectron sheath have been derived. The expression for the accretion rate of sheath electrons over the levitated spherical particles using anisotropic photoelectron flux has been derived, which has been further utilized to characterize the charging of levitating fine particles in the lunar sheath along with other constituent photoemission and solar wind fluxes. This estimate of particle charge has been further manifested with lunar sheath characteristics to evaluate the altitude profile of the particle size exhibiting levitation. The inclusion of solar wind flux into analysis is noticed to reduce the sheath span and altitude of the particle levitation; the dependence of the sheath structure and particle levitation on the solar wind plasma parameters has been discussed and graphically presented.

  19. 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.)

  20. 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 ...

  1. 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 ...

  2. Determination of strain localization in aluminum alloys using laser-induced photoelectron emission

    Science.gov (United States)

    Cai, M.; Langford, S. C.; Levine, L. E.; Dickinson, J. T.

    2004-12-01

    Uniaxial tensile deformation of oxidized aluminum produces low work-function patches of fresh metal which can be probed by measurements of photoelectron emission during exposure to ultraviolet light. We report measurements of photoelectron emission during uniaxial testing of polycrystalline Al(1200), Al-Mn(3003), Al-Mg(5052), and Al-Mg-Si(6061) alloys where the broad face of the gauge section is exposed to pulsed excimer laser radiation (248nm). We show that strain localization alters the distribution of fresh surface metal produced by subsequent deformation. The transition from more homogenous deformation to the principally localized deformation associated with shear bands is associated with a discontinuity in the growth rate of photoelectron intensities versus time. At this transition, the rate of fresh metal production along the illuminated portion of gauge section decreases. In all four materials, the strain at the discontinuity is somewhat below the strain given by the Considère criterion, consistent with the role of microstructural effects in strain localization. We suggest that these photoelectron measurements constrain quantitative models of strain localization.

  3. Photoelectron spectroscopy investigations of pyrrolo[1,2-a][1,10]phenanthroline derivatives

    Energy Technology Data Exchange (ETDEWEB)

    Prelipceanu, M.; Prelipceanu, O.S. [University of Applied Sciences Wildau, Department of Engineering, Institute of Photonics and Physics Technologies, Friedrich-Engels Street 63, 15745 Wildau (Germany); Leontie, L. [Faculty of Physics, ' Al.I. Cuza' University, 11 Carol I Boulevard, 700506 Iasi (Romania)], E-mail: lleontie@uaic.ro; Danac, R. [Faculty of Chemistry, ' Al.I. Cuza' University, 11 Carol I Boulevard, 700506 Iasi (Romania)

    2007-08-20

    Thin films of new pyrrolo[1,2-a][1,10]phenanthroline derivatives have been investigated by ultraviolet photoelectron spectroscopy, with a view of future applications in optoelectronic devices. The electronic band structure of investigated compounds (for electron energies {<=}25 eV) is to a great extent determined by substituent (R = NO{sub 2}, Cl) induced transformations of molecular orbitals.

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

    Energy Technology Data Exchange (ETDEWEB)

    Lehmann, C. Stefan; Ram, N. Bhargava; Janssen, Maurice H. M., E-mail: m.h.m.janssen@vu.nl [LaserLaB Amsterdam, VU University Amsterdam, De Boelelaan 1081, 1081 HV Amsterdam (Netherlands); Powis, Ivan [School of Chemistry, University of Nottingham, Nottingham NG7 2RD (United Kingdom)

    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

  5. Comparative timber-yields

    Science.gov (United States)

    I. T. Haig

    1932-01-01

    During the last decade the U. S. Forest Service and several of the forest schools have completed rather comprehensive studies of the growth and yield of a number of commercially important native conifers. As the majority of these studies show the volumes obtainable in fully-stocked stands to very similar standards of utilization, they furnish an excellent opportunity...

  6. Crop yields in intercropping

    NARCIS (Netherlands)

    Yu, Y.

    2016-01-01

    Abstract

    Intercropping, the cultivation of two or more crop species simultaneously in the same field, has been widely practiced by smallholder farmers in developing countries and is gaining increasing interest in developed countries. Intercropping can increase the yield per unit

  7. 6 Grain Yield

    African Journals Online (AJOL)

    have stable, not too short crop duration with ... Ndiaye is located in the. Costal Delta region of Senegal. The climate of the Delta is characterized by a wet season from July to October with approximately. 200 mm of ..... Analysis of variance of the effect of site and season on maturity, grain yield and plant height of 16 rice.

  8. Electronic structure of single crystal UPd{sub 3}, UGe{sub 2}, and USb{sub 2} from hard X-ray and angle-resolved photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Beaux, M.F., E-mail: mbeaux@lanl.gov [MPA Division, Los Alamos National Laboratory, Los Alamos, NM 87545 (United States); Durakiewicz, T. [MPA Division, Los Alamos National Laboratory, Los Alamos, NM 87545 (United States); Moreschini, L.; Grioni, M. [IPN, Ecole Polytechnique Federale (EPFL), CH-1015 Lausanne (Switzerland); Offi, F. [CNISM and Dipartimento de Fisica, Universita Roma Tre, Via della Vasca Navale 84, 1-00146 Rome (Italy); Monaco, G. [European Synchrotron Radiation Facility, B.P. 220, F-38042 Grenoble (France); Panaccione, G. [Istituto Officina dei Materiali CNR, Laboratorio TASC, Area Science Park, Basovizza S.S. 14 Km 163.5, I-34012 Trieste, 9 (Italy); Joyce, J.J.; Bauer, E.D.; Sarrao, J.L. [MPA Division, Los Alamos National Laboratory, Los Alamos, NM 87545 (United States); Butterfield, M.T. [KLA-Tencor, 1 Technology Drive, Milpitas, CA (United States); Guziewicz, E. [Institute of Physics, Polish Academy of Sciences, Warsaw (Poland)

    2011-11-15

    Highlights: {yields} Electronic structure of single crystal UPd{sub 3}, UGe{sub 2}, and USb{sub 2} was measured by hard X-ray and angle-resolved photoemission spectroscopy. {yields} Angle resolved photoemission results demonstrate hybridization between U 5f and Pd 4d electrons within UPd{sub 3}. {yields} HAXPES probing of bulk features within of UPd{sub 3}, UGe{sub 2}, and USb{sub 2} samples with native oxide contamination demonstrated. {yields} Two distinct spectral features identified for Sb I and Sb II sites within USb{sub 2} HAXPES spectrum. {yields} Line shape analysis reveals correlations between Doniach-Sunjic asymmetry coefficients and 5f localization. - Abstract: Electronic structure of single crystal UPd{sub 3}, UGe{sub 2}, and USb{sub 2} has been measured from hard X-ray photoelectron spectroscopy (HAXPES) with 7.6 keV photons at the European Synchrotron Radiation Facility (ESRF). Lower photon energy angle-resolved photoelectron spectroscopy (ARPES) was also performed at the Synchrotron Radiation Center (SRC). Herein the following results are presented: (i) ARPES results demonstrate hybridization between the U 5f and Pd 4d electrons within UPd{sub 3}. (ii) The greatly reduced surface sensitivity of HAXPES enabled observation of the bulk core levels in spite of surface oxidation. Photoelectron mean-free-path versus oxide layer thickness considerations were used to model the effectiveness of HAXPES for probing bulk features of in-air cleaved samples. (iii) Two distinct features separated by 800 meV were observed for the Sb 3d core level. These two features are attributed to manifestations of two distinct Sb sites within the USb{sub 2} single crystal as supported by consideration of interatomic distances and enthalpy-of-formation. (iv) Doniach-Sunjic line shape analysis of core level spectral features revealed correlations between asymmetry coefficients and 5f localization.

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

    International Nuclear Information System (INIS)

    Knut, Ronny; Lindblad, Rebecka; Gorgoi, Mihaela; Rensmo, Håkan; Karis, Olof

    2013-01-01

    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

  10. Two-color visible/vacuum ultraviolet photoelectron imaging dynamics of Br2.

    Science.gov (United States)

    Plenge, Jürgen; Nicolas, Christophe; Caster, Allison G; Ahmed, Musahid; Leone, Stephen R

    2006-10-07

    An experimental two-color photoionization dynamics study of laser-excited Br2 molecules is presented, combining pulsed visible laser excitation and tunable vacuum ultraviolet (VUV) synchrotron radiation with photoelectron imaging. The X 1Sigmag + -B 3Pi0+u transition in Br2 is excited at 527 nm corresponding predominantly to excitation of the v' = 28 vibrational level in the B 3Pi0+u state. Tunable VUV undulator radiation in the energy range of 8.40-10.15 eV is subsequently used to ionize the excited molecules to the X 2Pi32,12 state of the ion, and the ionic ground state is probed by photoelectron imaging. Similar experiments are performed using single-photon synchrotron ionization in the photon energy range of 10.75-12.50 eV without any laser excitation. Photoelectron kinetic energy distributions are extracted from the photoelectron images. In the case of two-color photoionization using resonant excitation of the intermediate B 3Pi0+u state, a broad distribution of photoelectron kinetic energies is observed, and in some cases even a bimodal distribution, which depends on the VUV photon energy. In contrast, for single-photon ionization, a single nearly Gaussian-shaped distribution is observed, which shifts to higher energy with photon energy. Simulated spectra based on Franck-Condon factors for the transitions Br2(X 1Sigmag+, v" = 0)-Br2 +(X 2Pi12,32, v+) and Br2(B 3Pi0+u, v' = 28)-Br2 +(X 2Pi12,32, v+) are generated. Comparison of these calculated spectra with the measured images suggests that the differences in the kinetic energy distributions for the two ionization processes reflect the different extensions of the vibrational wave functions in the v" = 0 electronic ground state (X 1Sigmag+) versus the electronically and vibrationally excited state (B 3Pi0+u, v' = 28).

  11. Polarization and dipole effects in hard X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Novak, M. [Universite Libre de Bruxelles, Service de Metrologie Nucleaire (CP 165/84), 50 av. F. D. Roosevelt, B-1050 Brussels (Belgium); Pauly, N., E-mail: nipauly@ulb.ac.be [Universite Libre de Bruxelles, Service de Metrologie Nucleaire (CP 165/84), 50 av. F. D. Roosevelt, B-1050 Brussels (Belgium); Dubus, A. [Universite Libre de Bruxelles, Service de Metrologie Nucleaire (CP 165/84), 50 av. F. D. Roosevelt, B-1050 Brussels (Belgium)

    2012-03-15

    Highlights: Black-Right-Pointing-Pointer X-rays are unpolarized or linearly polarized. Black-Right-Pointing-Pointer A difference of polarization implies a variation in path travelled by the photoelectrons. Black-Right-Pointing-Pointer We show the influence of the polarization on the partial intensity distributions. Black-Right-Pointing-Pointer We also point out the influence of the dipole approximation. Black-Right-Pointing-Pointer We use Monte Carlo simulations. - Abstract: Hard X-ray photoelectron spectroscopy (HXPS) using X-rays in the 1.5-15 keV energy range generated by synchrotron sources becomes an increasingly important analysis technique due to its potential for bulk sensitive measurements. However, besides their high energy, another characteristic of photons generated by synchrotron sources is their linear polarization while X-rays from Al K{alpha} or Mg K{alpha} for instance are unpolarized. This difference implies a possible variation in total path travelled by the photoelectrons generated by the X-rays inside the medium and consequently a modification of the resulting spectrum shape. We show the influence of the polarization on the partial intensity distributions, namely the number of electrons escaping after n inelastic scattering events, for photoelectron with energies of 0.5, 1, 2, 3, 4 and 5 keV and originating from Si 1s{sub 1/2}, Cu 1s{sub 1/2}, Cu 2p{sub 3/2}, Au 4d{sub 3/2} and Au 4f{sub 7/2} subshells. Moreover, we point out the influence of the dipole approximation leading to an underestimation of the partial intensity distributions due to the neglect of the forward-backward asymmetry of the angular photoelectron distribution.

  12. Ultrafast Internal Conversion of Aromatic Molecules Studied by Photoelectron Spectroscopy using Sub-20 fs Laser Pulses

    Directory of Open Access Journals (Sweden)

    Toshinori Suzuki

    2014-02-01

    Full Text Available This article describes our recent experimental studies on internal conversion via a conical intersection using photoelectron spectroscopy. Ultrafast S2(ππ*–S1(nπ* internal conversion in pyrazine is observed in real time using sub-20 fs deep ultraviolet pulses (264 and 198 nm. While the photoelectron kinetic energy distribution does not exhibit a clear signature of internal conversion, the photoelectron angular anisotropy unambiguously reveals the sudden change of electron configuration upon internal conversion. An explanation is presented as to why these two observables have different sensitivities to internal conversion. The 198 nm probe photon energy is insufficient for covering the entire Franck-Condon envelopes upon photoionization from S2/S1 to D1/D0. A vacuum ultraviolet free electron laser (SCSS producing 161 nm radiation is employed to solve this problem, while its pulse-to-pulse timing jitter limits the time resolution to about 1 ps. The S2–S1 internal conversion is revisited using the sub-20 fs 159 nm pulse created by filamentation four-wave mixing. Conical intersections between D1(π−1 and D0(n−1 and also between the Rydberg state with a D1 ion core and that with a D0 ion core of pyrazine are studied by He(I photoelectron spectroscopy, pulsed field ionization photoelectron spectroscopy and one-color resonance-enhanced multiphoton ionization spectroscopy. Finally, ultrafast S2(ππ*–S1(ππ* internal conversion in benzene and toluene are compared with pyrazine.

  13. 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.

  14. Coulomb effect on the left–right asymmetry in photoelectron emission with few-cycle laser pulses

    Energy Technology Data Exchange (ETDEWEB)

    Chen, YongJu; Yu, ShaoGang [State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics, Wuhan Institute of Physics and Mathematics, Chinese Academy of Sciences, Wuhan 430071 (China); University of Chinese Academy of Sciences, Beijing 100080 (China); Lai, XuanYang, E-mail: xylai@wipm.ac.cn [State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics, Wuhan Institute of Physics and Mathematics, Chinese Academy of Sciences, Wuhan 430071 (China); Quan, Wei [State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics, Wuhan Institute of Physics and Mathematics, Chinese Academy of Sciences, Wuhan 430071 (China); Liu, XiaoJun, E-mail: xjliu@wipm.ac.cn [State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics, Wuhan Institute of Physics and Mathematics, Chinese Academy of Sciences, Wuhan 430071 (China)

    2016-05-27

    We theoretically study the strong-field ionization of hydrogen atom in few-cycle laser pulses with the Coulomb–Volkov distorted-wave approximation (CVA) theory and focus on the role of the Coulomb potential in the left–right asymmetry of the photoelectron yields along the laser polarization direction, by comparing the CVA results with strong-field approximation (SFA) simulations. Our simulations show that the carrier-envelope phase (CEP) dependent asymmetry in CVA deviates from the SFA simulation and more interestingly, there is a phase shift of the asymmetry curve as a function of CEP when the laser intensity increases, contrary to what is expected in the SFA simulations. In terms of the simple man's model, the deviation of the asymmetry curves in CVA from the SFA simulations is attributed to the significant influence of the Coulomb potential on the forward rescattering electron which will get close to the core again after tunneling ionization. Furthermore, the laser-intensity dependence of the phase shift of the asymmetry curves in CVA is elucidated. - Highlights: • The asymmetry in electron emission by few-cycle pulse is studied with CVA theory. • The asymmetry in CVA deviates from the SFA simulation. • The asymmetry curve in CVA has a phase shift as the laser intensity increases. • The Coulomb effect on the asymmetry in electron emission is revealed.

  15. Electronic Structure of the d1 Bent-metallocene Cp2VCl2: A Photoelectron and Density Functional Study

    Science.gov (United States)

    Cranswick, Matthew A.; Gruhn, Nadine E.; Enemark, John H.; Lichtenberger, Dennis L.

    2009-01-01

    The Cp2VCl2 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 Cp2VCl. With improved instrumentation, the amount of decomposition is reduced and subtraction of ionization intensity due to Cp2VCl from the Cp2VCl2/Cp2VCl mixed spectrum yields the Cp2VCl2 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 d1 electron and the energies of the higher positive ion states of Cp2VCl2. The calculations also account well for the trends to the other Group V bent metallocene dichlorides Cp2NbCl2 and Cp2TaCl2. The first ionization energy of Cp2VCl2 is considerably greater than the first ionization energies of the second- and third-row transition metal analogues. PMID:19593395

  16. Brazilian Soybean Yields and Yield Gaps Vary with Farm Size

    Science.gov (United States)

    Jeffries, G. R.; Cohn, A.; Griffin, T. S.; Bragança, A.

    2017-12-01

    Understanding the farm size-specific characteristics of crop yields and yield gaps may help to improve yields by enabling better targeting of technical assistance and agricultural development programs. Linking remote sensing-based yield estimates with property boundaries provides a novel view of the relationship between farm size and yield structure (yield magnitude, gaps, and stability over time). A growing literature documents variations in yield gaps, but largely ignores the role of farm size as a factor shaping yield structure. Research on the inverse farm size-productivity relationship (IR) theory - that small farms are more productive than large ones all else equal - has documented that yield magnitude may vary by farm size, but has not considered other yield structure characteristics. We examined farm size - yield structure relationships for soybeans in Brazil for years 2001-2015. Using out-of-sample soybean yield predictions from a statistical model, we documented 1) gaps between the 95th percentile of attained yields and mean yields within counties and individual fields, and 2) yield stability defined as the standard deviation of time-detrended yields at given locations. We found a direct relationship between soy yields and farm size at the national level, while the strength and the sign of the relationship varied by region. Soybean yield gaps were found to be inversely related to farm size metrics, even when yields were only compared to farms of similar size. The relationship between farm size and yield stability was nonlinear, with mid-sized farms having the most stable yields. The work suggests that farm size is an important factor in understanding yield structure and that opportunities for improving soy yields in Brazil are greatest among smaller farms.

  17. Luminescence and light yield of (Gd2Y)(Ga3Al2)O12:Pr3+ single crystal scintillators

    Science.gov (United States)

    Lertloypanyachai, Prapon; Pathumrangsan, Nichakorn; Sreebunpeng, Krittiya; Pattanaboonmee, Nakarin; Chewpraditkul, Weerapong; Yoshikawa, Akira; Kamada, Kei; Nikl, Martin

    2017-06-01

    Praseodymium-doped (Gd2Y)(Ga3Al2)O12 (GYGAG: Pr) single crystals are grown by the micro-pulling down method with different Pr concentrations. The energy transfer process between Pr3+ and Gd3+ is investigated by photoluminescence excitation (PLE) and emission (PL) spectra measurements. Photoelectron yield measurements are carried out using photomultiplier. At 662 keV γ-rays, photoelectron yield of 2520 phe/MeV obtained for the GYGAG: Pr (0.01%) sample is larger than that of 1810 phe/MeV obtained for BGO crystal. Light yield degradation for the GYGAG: Pr scintillators is presumably due to the energy transfer from 5d state of Pr3+ to 4f state of Gd3+ together with the concentration quenching in the Gd3+-sublattice.

  18. Nitrogen rate and plant population effects on yield and yield ...

    African Journals Online (AJOL)

    STORAGESEVER

    2008-12-17

    Dec 17, 2008 ... and yield components in soybean under Bursa, Mustafakemalpaşa ecological conditions. Trials were conducted ... that increase in plant density and nitrogen rate increased plant height, lowest pod height, harvest index and seed yield. .... nitrogen doses, plant density and their interaction on yield and yield ...

  19. Origin of apparent viscosity in yield stress fluids below yielding

    NARCIS (Netherlands)

    Møller, P.C.F.; Fall, A.; Bonn, D.

    2009-01-01

    For more than 20 years it has been debated if yield stress fluids are solid below the yield stress or actually flow; whether true yield stress fluids exist or not. Advocates of the true yield stress picture have demonstrated that the effective viscosity increases very rapidly as the stress is

  20. 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.

  1. A microcomputer-controlled modulation technique for the detection of transient species in UV photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Lonkhuyzen, H. van; Muller, H.G.; Lange, C.A. de

    1980-01-01

    A microcomputer-controlled modulation method is described to measure UV photoelectron spectra of transient species generated in a microwave discharge. Spectra at low and high microwave power levels are simultaneously recorded and afterwards linearly combined in order to remove parent compound signals. The method is applied to discharged oxygen where the transition O 2 + ( 2 PHIsub(u)) 2 ( 1 Δsub(g)) becomes visible without interference from the parent molecule O 2 ( 3 Σsub(g) - ), and to discharged sulphur dioxide where SO( 3 Σ - ) and S( 3 P) photoelectron spectra are obtained free from SO 2 bands. Finally the build-up of transient bands as a function of time is recorded. (orig.)

  2. Investigation of hafnium silicide nanostructures on a Si(100) surface by means of photoelectron diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Fluechter, C.R.; Weier, D. [Experimentelle Physik 1 - Universitaet Dortmund, (Germany); DELTA - Universitaet Dortmund, Maria-Goeppert-Mayer-Str. 2, D 44227 (Germany); Siervo, A. de; Landers, R. [Laboratorio Nacional de Luz Sincrotron, C.P. 6192, (Brazil); Schuermann, M.; Beimborn, A.; Schoenbohm, F.; Dreiner, S.; Westphal, C. [Experimentelle Physik 1 - Universitaet Dortmund, (Germany); Carazzolle, M.F.; Kleiman, G.G. [Inst. de Fisica - Universidade Estadual de Campinas, (Brazil)

    2007-07-01

    Ultrathin films of hafnium were deposited on a silicon sample and annealed at 750 C forming rectangular shaped hafnium silicide islands on the surface. This silicidation process causes the thermal instability of HfO{sub 2} films on silicon substrates. The latter system is under investigation in the field of high-k dielectrics to replace the system SiO{sub 2}/Si(100) in MOSFET devices. We investigated the structure of the HfSi{sub 2} island for different initial film thicknesses of hafnium by means of atomic force microscopy, photoelectron spectroscopy and photoelectron diffraction. Synchrotron light in the soft X-ray regime (h{nu}=180 eV) was used for excitation. The resulting diffraction patterns were compared to calculated patterns of model structures by an R-factor analysis. As a result, we propose a modified zirconium silicide model to describe the structure of the system.

  3. Probing molecular orientations in thin films by x-ray photoelectron spectroscopy

    Science.gov (United States)

    Li, Y.; Li, P.; Lu, Z.-H.

    2018-03-01

    A great number of functional organic molecules in active thin-film layers of optoelectronic devices have highly asymmetric structures, such as plate-like, rod-like, etc. This makes molecular orientation an important aspect in thin-films as it can significantly affect both the optical and electrical performance of optoelectronic devices. With a combination of in-situ ultra violet photoelectron spectroscopy (UPS) and x-ray photoelectron spectroscopy (XPS) investigations for organic molecules having a broad range of structural properties, we discovered a rigid connection of core levels and frontier highest occupied molecular orbital levels at organic interfaces. This finding opens up opportunities of using X-ray photoemission spectroscopy as an alternative tool to UPS for providing an easy and unambiguous data interpretation in probing molecular orientations.

  4. Probing molecular orientations in thin films by x-ray photoelectron spectroscopy

    Directory of Open Access Journals (Sweden)

    Y. Li

    2018-03-01

    Full Text Available A great number of functional organic molecules in active thin-film layers of optoelectronic devices have highly asymmetric structures, such as plate-like, rod-like, etc. This makes molecular orientation an important aspect in thin-films as it can significantly affect both the optical and electrical performance of optoelectronic devices. With a combination of in-situ ultra violet photoelectron spectroscopy (UPS and x-ray photoelectron spectroscopy (XPS investigations for organic molecules having a broad range of structural properties, we discovered a rigid connection of core levels and frontier highest occupied molecular orbital levels at organic interfaces. This finding opens up opportunities of using X-ray photoemission spectroscopy as an alternative tool to UPS for providing an easy and unambiguous data interpretation in probing molecular orientations.

  5. Photoelectron and electron momentum spectroscopy of tetrahydrofuran from a molecular dynamical perspective.

    Science.gov (United States)

    Shojaei, S H Reza; Morini, Filippo; Deleuze, Michael S

    2013-03-07

    The results of experimental studies of the valence electronic structure of tetrahydrofuran employing He I photoelectron spectroscopy as well as Electron Momentum Spectroscopy (EMS) have been reinterpreted on the basis of Molecular Dynamical simulations employing the classical MM3 force field and large-scale quantum mechanical simulations employing Born-Oppenheimer Molecular Dynamics in conjunction with the dispersion corrected ωB97XD exchange-correlation functional. Analysis of the produced atomic trajectories demonstrates the importance of thermal deviations from the lowest energy path for pseudorotation, in the form of considerable variations of the ring-puckering amplitude. These deviations are found to have a significant influence on several outer-valence electron momentum distributions, as well as on the He I photoelectron spectrum.

  6. Strong-field photoelectron holography of atoms by bicircular two-color laser pulses

    Science.gov (United States)

    Li, Min; Jiang, Wei-Chao; Xie, Hui; Luo, Siqiang; Zhou, Yueming; Lu, Peixiang

    2018-02-01

    We study photoelectron holography in strong bicircular two-color laser fields by solving the time-dependent Schrödinger equation (TDSE) and a semiclassical rescattering model with implementing interference effect. The holographic patterns observed in the TDSE are well recaptured by the semiclassical rescattering model. Four types of photoelectron holographic interferences between the forward scattered and nonscattered trajectories are predicted by the semiclassical rescattering model in the bicircular two-color laser field. We find that those holographic patterns are spatially separated from each other in the electron momentum distribution. We further show that the dependence of the initial transverse momentum at the tunnel exit on the ionization time for the rescattering electron is recorded by the holographic patterns.

  7. Photo-electronic current transport in back-gated graphene transistor

    Science.gov (United States)

    Srivastava, Ashok; Chen, Xinlu; Pradhan, Aswini K.

    2017-04-01

    In this work, we have studied photo-electronic current transport in a back-gated graphene field-effect transistor. Under the light illumination, band bending at the metal/graphene interface develops a built-in potential which generates photonic current at varying back-gate biases. A typical MOSFET type back-gated transistor structure uses a monolayer graphene as the channel layer formed over the silicon dioxide/silicon substrate. It is shown that the photo-electronic current consists of current contributions from photovoltaic, photo-thermoelectric and photo-bolometric effects. A maximum external responsivity close to 0.0009A/W is achieved at 30μW laser power source and 633nm wavelength.

  8. X-ray photoelectron spectroscopy of the uranium/oxygen system

    International Nuclear Information System (INIS)

    Allen, G.C.; Holmes, N.R.

    1986-10-01

    Other authors have presented evidence to show that the oxidised surface layer which forms on UO 2 at 25 0 C is amorphous UO 3 . In the present study X-ray photoelectron spectroscopy, infra-red spectroscopy and X-ray diffraction have been used to characterise the higher oxides α-UO 3 , β-UO 3 , γ-UO 3 and δ-UO 3 . While the infra-red and X-ray diffraction results may be used to characterise each oxide the X-ray photoelectron spectra for each phase are very similar. During reduction of the oxide surface in the spectrometer changes in the spectra were observed which were shown to be associated with particular oxidation states of the metal rather than different uranium atom coordination sites within the oxide. A close structural relationship is demonstrated between these oxides and the product at the surface of air-oxidised UO 2 fuel. (author)

  9. Photoelectron and UV absorption spectroscopy for determination of electronic configurations of negative molecular ions: Chlorophenols

    International Nuclear Information System (INIS)

    Tseplin, E.E.; Tseplina, S.N.; Tuimedov, G.M.; Khvostenko, O.G.

    2009-01-01

    The photoelectron and UV absorption spectra of p-, m-, and o-chlorophenols in the gas phase have been obtained. On the basis of DFT B3LYP/6-311++G(d, p) calculations, the photoelectron bands have been assigned to occupied molecular orbitals. From the TDDFT B3LYP/6-311++G(d, p) calculation results, the UV absorption bands have been assigned to excited singlet states of the molecules under investigation. For each excited state a dominant transition was found. It has been shown that the energies of these singlet transitions correlate with the energy differences between the ground-state molecular orbitals participating in them. Using the UV spectra interpretation, the electronic states of molecular anions detected earlier for the same compounds by means of the resonant electron capture mass-spectrometry have been determined.

  10. Calculation of photodetachment cross sections and photoelectron angular distributions of negative ions using density functional theory.

    Science.gov (United States)

    Liu, Yuan; Ning, Chuangang

    2015-10-14

    Recently, the development of photoelectron velocity map imaging makes it much easier to obtain the photoelectron angular distributions (PADs) experimentally. However, explanations of PADs are only qualitative in most cases, and very limited works have been reported on how to calculate PAD of anions. In the present work, we report a method using the density-functional-theory Kohn-Sham orbitals to calculate the photodetachment cross sections and the anisotropy parameter β. The spherical average over all random molecular orientation is calculated analytically. A program which can handle both the Gaussian type orbital and the Slater type orbital has been coded. The testing calculations on Li(-), C(-), O(-), F(-), CH(-), OH(-), NH2 (-), O2 (-), and S2 (-) show that our method is an efficient way to calculate the photodetachment cross section and anisotropy parameter β for anions, thus promising for large systems.

  11. Experimental investigations of the lunar photoelectron environment and related dust dynamics

    Science.gov (United States)

    Dove, Adrienne Rathert

    Airless bodies in space are exposed to a variety of charging environments in which a balance of currents due to plasma processes determines the surface charge. In the inner solar system, photoelectron emission is the dominant charging process on sunlit surfaces due to the intense solar UV radiation. This results in a positive surface potential with a photoelectron sheath above the surface. Conversely, the unlit side of the body will charge negatively due the collection of the fast-moving solar wind electrons. The interaction of charged dust grains with these positively and negatively charged surfaces, and with the photoelectron and plasma sheaths, may explain the occurrence of dust lofting, levitation and transport above the lunar surface and on other airless bodies. This dust has been recognized as a potentially great hazard to future exploration of dusty planetary surfaces, due to its abrasive and adhesive nature. An initial investigation explores the mechanisms that control adhesion of dust grains to insulating and conducting surfaces. Unfortunately, there is little known about the mechanisms of adhesion on widely varying surface types, but van der Waals and electrostatic forces are the dominant forces that are taken into consideration in this study, which measures the adhesive forces between ≤ 25 μm JSC-1 lunar simulant grains and various surfaces vacuum using a centrifugal force detachment method. UV irradiation effects on surface adhesion were also examined. In order to better understand the plasma processes at work on sunlit surfaces, we have performed laboratory experiments to study the physics of photoelectron sheaths above both conducting and insulating surfaces in vacuum. The first set of experiments determines the characteristics of photoelectron sheaths generated over a conducting Zr surface that is large in comparison to the Debye length of the sheath. These characteristics are derived from cylindrical Langmuir probe measurements, and are compared

  12. Time-Resolved Photoelectron Spectroscopy of Oxidation on the Ti(0001) Surface

    Energy Technology Data Exchange (ETDEWEB)

    Mizuno, Yoshiyuki

    2003-03-28

    High-resolution photoelectron spectroscopy using synchrotron radiation was applied for monitoring in real time the oxidation kinetics on the Ti(0001) surface at 405 C with dry O{sub 2} gas. The time evolution of O 1s photoelectron intensity showed a linear uptake curve up to {approx}90 L followed by a sudden saturation up to {approx}160 L and then a restart of the linear increase, indicating that O{sub 2} adsorption obeys a zero-order reaction scheme before and after the saturation. Corresponding to the first linear uptake and saturation, the surface core level shift (SCLS) component of Ti 2p decreased predominantly and disappeared completely, and appeared again after the saturation and remained persistently during TiO{sub 2} growth. Thus the zero-order reaction of O{sub 2} adsorption on the Ti(0001) surface at 405 C is concerned with the metallic Ti layer on the outermost surface.

  13. Direct Visualization of Valence Electron Motion Using Strong-Field Photoelectron Holography

    Science.gov (United States)

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

    2018-03-01

    Watching the valence electron move in molecules on its intrinsic timescale has been one of the central goals of attosecond science and it requires measurements with subatomic spatial and attosecond temporal resolutions. The time-resolved photoelectron holography in strong-field tunneling ionization holds the promise to access this realm. However, it remains to be a challenging task hitherto. Here we reveal how the information of valence electron motion is encoded in the hologram of the photoelectron momentum distribution (PEMD) and develop a novel approach of retrieval. As a demonstration, applying it to the PEMDs obtained by solving the time-dependent Schrödinger equation for the prototypical molecule H2+ , the attosecond charge migration is directly visualized with picometer spatial and attosecond temporal resolutions. Our method represents a general approach for monitoring attosecond charge migration in more complex polyatomic and biological molecules, which is one of the central tasks in the newly emerging attosecond chemistry.

  14. Many-body effect in the partial singles N2,3 photoelectron spectroscopy spectrum of atomic Cd

    International Nuclear Information System (INIS)

    Ohno, Masahide

    2008-01-01

    We can extract out the photoelectron kinetic energy (KE) dependent imaginary part of the core-hole self-energy by employing Auger-photoelectron coincidence spectroscopy (APECS). The variation with photoelectron KE in the Auger electron spectroscopy (AES) spectral peak intensity of a selected decay channel measured in coincidence with photoelectrons of a selected KE is the partial singles (non-coincidence) photoelectron spectroscopy (PES) spectrum, i.e., the product of the singles PES one and the branching ratio of the partial Auger decay width of a selected decay channel to the imaginary part of the core-hole self-energy. When a decay channel the partial Auger decay width of which is photoelectron KE independent is selected, we can extract out spectroscopically the imaginary part of the core-hole self-energy because the variation with photoelectron KE in the relative spectral intensity of the partial singles PES spectrum to the singles one is that in the branching ratio of the partial Auger decay width of a selected decay channel. As an example we discussed the N 2,3 -hole self-energy of atomic Cd

  15. Triaxial testing beyond yielding

    DEFF Research Database (Denmark)

    Sabaliauskas, Tomas; Ibsen, Lars Bo

    2017-01-01

    This paper is continuation of work published at ISOPE 2015, where capabilities of undrained triaxial testing were presented. Now, drained loading is emphasized, recovery of disturbed sand properties is observed. After liquefying or yielding, sand becomes disturbed: stiffness and resistance...... to liquefaction become compromised. However, sand can "heal" itself. It can recover during drained deformation cycles. The recovery mechanism can be observed using a triaxial apparatus. Such tests are relevant for offshore, seismic, and other fields of engineering, where disturbed soil states are encountered....

  16. Scintillation yield and time dependence from electronic and nuclear recoils in liquid neon

    Science.gov (United States)

    Lippincott, W. H.; Coakley, K. J.; Gastler, D.; Kearns, E.; McKinsey, D. N.; Nikkel, J. A.

    2012-07-01

    We have performed measurements of scintillation light in liquid neon, observing a signal yield in our detector as high as (3.5 ± 0.4) photoelectrons/keV. We measure pulse shape discrimination efficiency between electronic and nuclear recoils in liquid neon from 50 to 300 keV nuclear recoil energy. We also measure the Leff parameter in liquid neon between 30 and 370 keV nuclear recoil energy, observing an average Leff=0.24 above 50 keV. We observe a dependence of the scintillation time distribution and signal yield on the pressure and temperature of the liquid neon.

  17. Enhanced quantum efficiency of photoelectron emission, through surface textured metal electrodes

    Energy Technology Data Exchange (ETDEWEB)

    Alexander, Anna; Bandaru, Prabhakar R., E-mail: pbandaru@ucsd.edu [Program in Materials Science, Department of Mechanical Engineering, University of California, San Diego, La Jolla, California, 92130 (United States); Moody, Nathan A. [Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States)

    2016-03-15

    It is predicted that the quantum efficiency (QE) of photoelectron emission from metals may be enhanced, possibly by an order of magnitude, through optimized surface texture. Through extensive computational simulations, it is shown that the absorption enhancement in select surface groove geometries may be a dominant contributor to enhanced QE and corresponds to localized Fabry–Perot resonances. The inadequacy of extant analytical models in predicting the QE increase, and suggestions for further improvement, are discussed.

  18. Characterization of alkanethiol/ZnO structures by X-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Ogata, K.; Hama, T.; Hama, K.; Koike, K.; Sasa, S.; Inoue, M.; Yano, M.

    2005-01-01

    1-Propanethiol (CH 3 CH 2 CH 2 SH) was connected with O-polar zinc oxide (ZnO) surfaces toward biofunctional devices. X-ray photoelectron spectroscopy (XPS) measurement revealed that the S-O bonds were formed between 1-propanethiol and ZnO layers. Although the surface coverage of the molecule is less than a few percent, 1-propanethiol/ZnO structures were stable even at thermal treatment of 400 deg. C

  19. Effects of the Coulomb potential in interference patterns of strong-field holography with photoelectrons

    Science.gov (United States)

    Shvetsov-Shilovski, N. I.; Lein, M.

    2018-01-01

    Using the semiclassical two-step model for strong-field ionization we investigate the interference structures emerging in strong-field photoelectron holography, taking into account the Coulomb potential of the atomic core. For every kind of the interference pattern predicted by the three-step model, we calculate the corresponding structure in the presence of the Coulomb field, showing that the Coulomb potential modifies the interference patterns significantly.

  20. GaN quantum dot polarity determination by X-ray photoelectron diffraction

    Czech Academy of Sciences Publication Activity Database

    Romanyuk, Olexandr; Bartoš, Igor; Brault, J.; De Mierry, P.; Paskova, T.; Jiříček, Petr

    2016-01-01

    Roč. 389, Dec (2016), s. 1156-1160 ISSN 0169-4332 R&D Projects: GA ČR GA15-01687S; GA MŠk LM2015088 Institutional support: RVO:68378271 Keywords : GaN * semipolar GaN * quantum dots * X-ray photoelectron diffraction * surface polarity Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 3.387, year: 2016

  1. 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 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....

  2. Modeling and parameterization of photoelectrons emitted in condensed matter by linearly polarized synchrotron radiation

    Science.gov (United States)

    Jablonski, A.

    2018-01-01

    Growing availability of synchrotron facilities stimulates an interest in quantitative applications of hard X-ray photoemission spectroscopy (HAXPES) using linearly polarized radiation. An advantage of this approach is the possibility of continuous variation of radiation energy that makes it possible to control the sampling depth for a measurement. Quantitative applications are based on accurate and reliable theory relating the measured spectral features to needed characteristics of the surface region of solids. A major complication in the case of polarized radiation is an involved structure of the photoemission cross-section for hard X-rays. In the present work, details of the relevant formalism are described and algorithms implementing this formalism for different experimental configurations are proposed. The photoelectron signal intensity may be considerably affected by variation in the positioning of the polarization vector with respect to the surface plane. This information is critical for any quantitative application of HAXPES by polarized X-rays. Different quantitative applications based on photoelectrons with energies up to 10 keV are considered here: (i) determination of surface composition, (ii) estimation of sampling depth, and (iii) measurements of an overlayer thickness. Parameters facilitating these applications (mean escape depths, information depths, effective attenuation lengths) were calculated for a number of photoelectron lines in four elemental solids (Si, Cu, Ag and Au) in different experimental configurations and locations of the polarization vector. One of the considered configurations, with polarization vector located in a plane perpendicular to the surface, was recommended for quantitative applications of HAXPES. In this configurations, it was found that the considered parameters vary weakly in the range of photoelectron emission angles from normal emission to about 50° with respect to the surface normal. The averaged values of the mean

  3. The calculation of photoelectron angular distributions with jet-like structure from scattering theory

    Energy Technology Data Exchange (ETDEWEB)

    Zhang Jingtao [Laboratory for High Intensity Optics, Shanghai Institute of Optics and Fine Mechanics, Chinese Academy of Sciences, PO Box 800-211, Shanghai (China); Zhang Wenqi [Laboratory for High Intensity Optics, Shanghai Institute of Optics and Fine Mechanics, Chinese Academy of Sciences, PO Box 800-211, Shanghai (China); Xu Zhizhan [Laboratory for High Intensity Optics, Shanghai Institute of Optics and Fine Mechanics, Chinese Academy of Sciences, PO Box 800-211, Shanghai (China); Li Xiaofeng [Laboratory of Optical Physics, Institute of Physics, Chinese Academy of Sciences, Beijing (China); Fu Panming [Laboratory of Optical Physics, Institute of Physics, Chinese Academy of Sciences, Beijing (China); Guo Dongsheng [Department of Physics, Southern University and A and M College, Baton Rouge, LA (United States); Freeman, R R [Department of Applied Science, University of California-Davis, Davis, CA (United States)

    2002-12-14

    Photoelectron angular distributions produced in above-threshold ionization (ATI) are analysed using a nonperturbative scattering theory. The numerical results are in good qualitative agreement with recent measurements. Our study shows that the origin of the jet-like structure arises from the inherent properties of the ATI process and not from the angular momentum of either the initial or the excited states of the atom.

  4. 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.

  5. Photoelectron photoion coincidence imaging of ultrafast control in multichannel molecular dynamics.

    Science.gov (United States)

    Lehmann, C Stefan; Ram, N Bhargava; Irimia, Daniel; Janssen, Maurice H M

    2011-01-01

    The control of multichannel ionic fragmentation dynamics in CF3I is studied by femtosecond pulse shaping and velocity map photoelectron photoion coincidence imaging. When CF3I is photoexcited with femtosecond laser pulses around 540 nm there are two major ions observed in the time-of-flight mass spectrum, the parent CF3I+ ion and the CF3+ fragment ion. In this first study we focussed on the influence of LCD-shaped laser pulses on the molecular dynamics. The three-dimensional recoil distribution of electrons and ions were imaged in coincidence using a single time-of-flight delay line detector. By fast switching of the voltages on the various velocity map ion lenses after detection of the electron, both the electron and the coincident ion are measured with the same imaging detector. These results demonstrate that a significant simplification of a photoelectron-photoion coincidence imaging apparatus is in principle possible using switched lens voltages. It is observed that shaped laser fields like chirped pulses, double pulses, and multiple pulses can enhance the CF3+CF3I+ ratio by up to 100%. The total energetics of the dynamics is revealed by analysis of the coincident photoelectron spectra and the kinetic energy of the CF3+ and I fragments. Both the parent CF3I+ and the CF3+ fragment result from a five-photon excitation process. The fragments are formed with very low kinetic energy. The photoelectron spectra and CF3+/CF3I+ ratio vary with the center wavelength of the shaped laser pulses. An optimal enhancement of the CF3+/CF3I+ ratio by about 60% is observed for the double pulse excitation when the pulses are spaced 60 fs apart. We propose that the control mechanism is determined by dynamics on neutral excited states and we discuss the results in relation to the location of electronically excited (Rydberg) states of CF3I.

  6. Gas phase anion photoelectron spectroscopy and theoretical investigation of gold acetylide species

    Science.gov (United States)

    Wang, Peng; Zhang, Wenjing; Xu, Xi-Ling; Yuan, Jinyun; Xu, Hong-Guang; Zheng, Weijun

    2017-05-01

    We conducted gas phase anion photoelectron spectroscopy and density functional theory studies on a number of gold acetylide species, such as AuC2H, AuC2Au, and Au2C2H. Based on the photoelectron spectra, the electron affinities of AuC2H, AuC2Au, and Au2C2H are measured to be 1.54(±0.04), 1.60(±0.08), and 4.23(±0.08) eV, respectively. The highest occupied molecular orbital-lowest unoccupied molecular orbital (HOMO-LUMO) gaps of AuC2H and AuC2Au are measured to be about 2.62 and 2.48 eV, respectively. It is interesting that photoelectron spectra of AuC2H- and AuC2Au- display similar spectral features. The comparison of experimental and theoretical results confirms that the ground-state structures of AuC2H-, AuC2Au-, and their neutrals are all linear with Au—C≡C—H and Au—C≡C—Au configurations. The similar geometric structures, spectral features, HOMO-LUMO gaps, and chemical bonding between AuC2H-/0 and AuC2Au-/0 demonstrate that Au atom behaves like H atom in these species. The photoelectron spectrum of Au2C2H- shows that Au2C2H has a high electron affinity of 4.23(±0.08) eV, indicating Au2C2H is a superhalogen. Further, we found an unusual similarity between the terminal Au atom of Au2C2H- and the iodine atom of IAuC2H-.

  7. Study of selected benzyl azides by UV photoelectron spectroscopy and mass spectrometry

    Science.gov (United States)

    Pinto, R. M.; Olariu, R. I.; Lameiras, J.; Martins, F. T.; Dias, A. A.; Langley, G. J.; Rodrigues, P.; Maycock, C. D.; Santos, J. P.; Duarte, M. F.; Fernandez, M. T.; Costa, M. L.

    2010-09-01

    Benzyl azide and the three methylbenzyl azides were synthesized and characterized by mass spectrometry (MS) and ultraviolet photoelectron spectroscopy (UVPES). The electron ionization fragmentation mechanisms for benzyl azide and their methyl derivatives were studied by accurate mass measurements and linked scans at constant B/ E. For benzyl azide, in order to clarify the fragmentation mechanism, labelling experiments were performed. From the mass analysis of methylbenzyl azides isomers it was possible to differentiate the isomers ortho, meta and para. The abundance and nature of the ions resulting from the molecular ion fragmentation, for the three distinct isomers of substituted benzyl azides, were rationalized in terms of the electronic properties of the substituent. Concerning the para-isomer, IRC calculations were performed at UHF/6-31G(d) level. The photoionization study of benzyl azide, with He(I) radiation, revealed five bands in the 8-21 eV ionization energies region. From every photoelectron spectrum of methylbenzyl azides isomers it has been identified seven bands, on the same range as the benzyl azide. Interpretation of the photoelectron spectra was accomplished applying Koopmans' theorem to the SCF orbital energies obtained at HF/6-311++G(d, p) level.

  8. Analysis of Dietz's single, rectangular pulse theory for the generation of radiation via photoelectrons

    International Nuclear Information System (INIS)

    Dipp, T.M.

    1993-12-01

    The generation of radiation via photoelectrons induced off of a conducting surface has been analytically modeled and computationally simulated by several researchers. This paper analyzes and compares Dietz's theory predictions with my research to form a unified foundation of consistent, inter-supporting results that should provide confidence in the independently performed basic research and resulting scaling laws and predictions. In doing so, this paper concentrated on Dietz's small-spot, single, rectangular, ''weak'' pulse theory and equations, which involve nonrelativistic, monoenergetic photoelectrons emitted normal to a conducting surface in vacuum. In this paper I: (1) analytically compare Dietz's theory equations with my theory equations, (2) compare Dietz's theoretical scaling laws with my Particle-In-Cell (PIC) code simulation results, and (3) make Dietz's equations easier to use in predicting and optimizing photoelectron-generated radiation. As a result, it is shown that Dietz's equations match my theory's equations in their predicted scaling laws, differing only slightly in their coefficients and unique model parameters. Also, Dietz's equations generally agree with the PIC code results. Finally, optimization analysis showed that theoretical conversion efficiencies for typical real metals can meet and exceed values of 10 -5 if optimal photon energies of 15 to 20 eV are used. Even better efficiencies should be possible if the small-spot constraint is violated as well

  9. Observation of relaxation on time scale of core hole decay by coincidence photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Ohno, Masahide

    2007-01-01

    It is shown by a many-body theory that when the relaxation time of a metastable core hole state(s) to the most stable one is comparable to or shorter than core hole decay time of the former state(s), a comparison between the singles (noncoincidence) photoelectron spectroscopy (PES) spectrum and the coincidence one provides a direct evidence of the relaxation. In principle the variation with photoelectron kinetic energy of relaxation (or charge transfer (CT)) time can be determined. By singles measurement the correlation of a photoelectron generated by creation of the metastable states not only with an Auger electron generated by annihilation of the same core hole state but also with an Auger electron generated by annihilation of the stable state via relaxation of the metastable state, is completely lost, unless only the metastable state is observed by PES, whereas the correlation often manifests directly in the coincidence spectra. Thus, compared to the coincidence spectroscopy the singles one is often much less capable of elucidating the competition between relaxation and core hole decay of a metastable state. Such examples are discussed

  10. 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.

  11. Photoelectron spectra and electronic structure of nitrogen analogues of boron β-diketonates with aromatic substituents

    Energy Technology Data Exchange (ETDEWEB)

    Tikhonov, Sergey A., E-mail: allser@bk.ru [Far Eastern Federal University, 8 Sukhanova St., Vladivostok, 690950 (Russian Federation); Vovna, Vitaliy I. [Far Eastern Federal University, 8 Sukhanova St., Vladivostok, 690950 (Russian Federation); Borisenko, Aleksandr V. [Vladivostok Branch of Russian Customs Academy, 16v Strelkovaya St., Vladivostok, 690034 (Russian Federation)

    2016-11-15

    Highlights: • The electronic structures of three nitrogen analogues of boron β-diketonates have been investigated. • UV photoelectron spectra have been interpreted. • The structure of the UV photoelectron spectra is in good agreement with the energies and compositions of Kohn-Sham orbitals. - Abstract: The electronic structure of three nitrogen analogoues of boron β-diketonates containing aromatic substituents was studied by the ultraviolet photoelectron spectroscopy and within the density functional theory. In order to determine effects of heteroatom substitution in the chelate ligand, a comparative analysis was carried out for the electronic structure of three model compounds. In a range of model compounds, the HOMO's nature was revealed to be the same. The HOMO-1 orbital of nitrogen containing compounds is determined by the presence of lone electron pairs of nitrogen. In a range of the complexes under study, the influence of aromatic substituents on the electronic structure was defined. In the imidoylamidinate complex, in contrast to formazanates and β-diketonates, it was found the absence of any noticeable mixing of π-orbitals of the chelate and benzene rings. It was shown that within energy range to 11 eV, the calculated results reproduce well the energy differences between the ionized states of complexes.

  12. Time-resolved photoelectron imaging of excited state relaxation dynamics in phenol, catechol, resorcinol, and hydroquinone.

    Science.gov (United States)

    Livingstone, Ruth A; Thompson, James O F; Iljina, Marija; Donaldson, Ross J; Sussman, Benjamin J; Paterson, Martin J; Townsend, Dave

    2012-11-14

    Time-resolved photoelectron imaging was used to investigate the dynamical evolution of the initially prepared S(1) (ππ*) excited state of phenol (hydroxybenzene), catechol (1,2-dihydroxybenzene), resorcinol (1,3-dihydroxybenzene), and hydroquinone (1,4-dihydroxybenzene) following excitation at 267 nm. Our analysis was supported by ab initio calculations at the coupled-cluster and CASSCF levels of theory. In all cases, we observe rapid (<1 ps) intramolecular vibrational redistribution on the S(1) potential surface. In catechol, the overall S(1) state lifetime was observed to be 12.1 ps, which is 1-2 orders of magnitude shorter than in the other three molecules studied. This may be attributed to differences in the H atom tunnelling rate under the barrier formed by a conical intersection between the S(1) state and the close lying S(2) (πσ*) state, which is dissociative along the O-H stretching coordinate. Further evidence of this S(1)/S(2) interaction is also seen in the time-dependent anisotropy of the photoelectron angular distributions we have observed. Our data analysis was assisted by a matrix inversion method for processing photoelectron images that is significantly faster than most other previously reported approaches and is extremely quick and easy to implement.

  13. Explaining the MoVO4- photoelectron spectrum: Rationalization of geometric and electronic structure.

    Science.gov (United States)

    Thompson, Lee M; Jarrold, Caroline C; Hratchian, Hrant P

    2017-03-14

    Attempts to reconcile simulated photoelectron spectra of MoVO 4 - clusters are complicated by the presence of very low energy barriers in the potential energy surfaces (PESs) of the lowest energy spin states and isomers. Transition state structures associated with the inversion of terminal oxygen ligands are found to lie below, or close to, the zero point energy of associated modes, which themselves are found to be of low frequency and thus likely to be significantly populated in the experimental characterization. Our simulations make use of Boltzmann averaging over low-energy coordinates and full mapping of the PES to obtain simulations in good agreement with experimental spectra. Furthermore, molecular orbital analysis of accessible final spin states reveals the existence of low energy two-electron transitions in which the final state is obtained from a finite excitation of an electron along with the main photodetachment event. Two-electron transitions are then used to justify the large difference in intensity between different bands present in the photoelectron spectrum. Owing to the general presence of terminal ligands in metal oxide clusters, this study identifies and proposes a solution to issues that are generally encountered when attempting to simulate transition metal cluster photoelectron spectroscopy.

  14. 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)

  15. Relationships between yield and some yield components in Pea ...

    African Journals Online (AJOL)

    STORAGESEVER

    2008-12-03

    Dec 3, 2008 ... end of the study, positive and significant relationship were found among seed yield and pods per plant and biological yield in both years. The strongest and direct positive effects were the biological yield (p = 0.6500), numbers of ... Pea is an important plant in human and animal nutrition because of its high ...

  16. yield and yield component association of some capsicum genotypes

    African Journals Online (AJOL)

    2015-07-24

    Jul 24, 2015 ... The experiment was conducted in humid agro ecological zone of Calabar, Nigeria, to evaluate the yield performance and the association between yield and yield related components of some capsicum genotypes which include; Bird pepper(Capsicum annuumvar. aviculare), Habanero pepper(Capsicum ...

  17. Yield and yield components of six canola ( Brassica napus L ...

    African Journals Online (AJOL)

    The experiments were conducted in randomized complete block design arrangement in split factorial with four replications The results demonstrated that late planting date and interrupting of irrigation at flowering stage significantly decreased growth, yield and yield components the of canola cultivars. In addition, oil yield ...

  18. Relationships between yield and some yield components in Pea ...

    African Journals Online (AJOL)

    The experiment was designed randomized complete blocks design with four replications. At the end of the study, positive and significant relationship were found among seed yield and pods per plant and biological yield in both years. The strongest and direct positive effects were the biological yield (p = 0.6500), numbers of ...

  19. X-Ray Photoelectron Spectroscopy of Stabilized Zirconia Films with Embedded Au Nanoparticles Formed under Irradiation with Gold Ions

    Science.gov (United States)

    Zubkov, S. Yu.; Antonov, I. N.; Gorshkov, O. N.; Kasatkin, A. P.; Kryukov, R. N.; Nikolichev, D. E.; Pavlov, D. A.; Shenina, M. E.

    2018-03-01

    Nanosized films of stabilized zirconia with Au nanoparticles formed by implanting Au ions are studied by X-ray photoelectron spectroscopy and transmission electron microscopy. The effect of irradiation of films with Au ions and postimplantation annealing on the distribution of chemical elements and zirconium- containing ZrO x compounds over the depth of the films is studied. Based on the data on the dimensional shift of the Au 4 f photoelectron line, the average value of the nanoparticle size is determined.

  20. Yield enhancement with DFM

    Science.gov (United States)

    Paek, Seung Weon; Kang, Jae Hyun; Ha, Naya; Kim, Byung-Moo; Jang, Dae-Hyun; Jeon, Junsu; Kim, DaeWook; Chung, Kun Young; Yu, Sung-eun; Park, Joo Hyun; Bae, SangMin; Song, DongSup; Noh, WooYoung; Kim, YoungDuck; Song, HyunSeok; Choi, HungBok; Kim, Kee Sup; Choi, Kyu-Myung; Choi, Woonhyuk; Jeon, JoongWon; Lee, JinWoo; Kim, Ki-Su; Park, SeongHo; Chung, No-Young; Lee, KangDuck; Hong, YoungKi; Kim, BongSeok

    2012-03-01

    A set of design for manufacturing (DFM) techniques have been developed and applied to 45nm, 32nm and 28nm logic process technologies. A noble technology combined a number of potential confliction of DFM techniques into a comprehensive solution. These techniques work in three phases for design optimization and one phase for silicon diagnostics. In the DFM prevention phase, foundation IP such as standard cells, IO, and memory and P&R tech file are optimized. In the DFM solution phase, which happens during ECO step, auto fixing of process weak patterns and advanced RC extraction are performed. In the DFM polishing phase, post-layout tuning is done to improve manufacturability. DFM analysis enables prioritization of random and systematic failures. The DFM technique presented in this paper has been silicon-proven with three successful tape-outs in Samsung 32nm processes; about 5% improvement in yield was achieved without any notable side effects. Visual inspection of silicon also confirmed the positive effect of the DFM techniques.

  1. Bare and thin-film-coated substrates with null reflection for p- and s-polarized light at the same angle of incidence: reflectance and ellipsometric parameters as functions of substrate refractive index and film thickness.

    Science.gov (United States)

    Azzam, R M A

    2016-10-20

    Intensity reflectances and ellipsometric parameters of a partially clad transparent substrate that suppresses the reflection of incident p- and s-polarized light at the same angle of incidence from uncoated and single-layer-coated areas are determined as functions of normalized film thickness ς and substrate refractive index n2. The common polarizing angle is the Brewster angle of the ambient-substrate interface, and the light beam incident from the ambient (air or vacuum) is refracted in the film at a 45° angle from the normal to the parallel-plane film boundaries. For n2≤2, the differential reflection phase shift Δ=δp-δs≈±90° for all values of ς so that the Brewster angle is also approximately the principal angle of the film-substrate system independent of film thickness. Accurate techniques for monitoring the deposition of such films are also proposed.

  2. 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

  3. Yield gains in leafy vegetables

    Science.gov (United States)

    Yield of all crops have increased during the past century through improved cultural practices and plant breeding. We reviewed gains in yield of lettuce and spinach in the U.S., principally California and Arizona. We proposed several genetic models for yield of lettuce based on the market type: whole...

  4. 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.

  5. 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

  6. X-ray photoelectron spectroscopy and electrochemical analysis of passivated electrolytic tin plate surfaces

    International Nuclear Information System (INIS)

    Azzerri, N.; Splendorini, L.; Battistoni, C.; Paparazzo, E.

    1982-01-01

    The passive layer of cathodic dichromate (CDC) and dichromate dipped (DCD) passivated tin plate was investigated by means of X-ray photoelectron spectroscopy (XPS) and electrochemical analysis. Electrochemical results were compared with atomic absorption spectroscopy and glow discharge spectroscopy data and are discussed in relation to the solid state properties of the passive layer compounds. XPS depth profiles were obtained by using a ''first-principles model'' for quantitative purposes and the results are evaluated on the basis of the analytical approach employed. (Auth.)

  7. Quantum photoelectron effects in the eye retina and development of colour vision theory

    International Nuclear Information System (INIS)

    Kremkov, M.V.

    2011-01-01

    The quantum semiconductor mechanism of the colour vision of mans is created. The mechanism is based on quantum effects under influence of light waves exciting valence electrons in different microelement's atoms (Zn, Cu, Fe, Co, P, Br, Se, et al.) that are presented in the photoreceptor's cells of the eye retina (columns and retorts) with the quasi-periodical disks structure. The microelement concentrations correspond to the impurity atom amount in semiconductors, and the photoelectron's current passes out its signal to the vision nerve. The mechanism explains existence of the man colour-blindness, degradation of the vision sensitivity with the man's age and other peculiarities of the colour vision. (authors)

  8. Statistical method for resolving the photon-photoelectron-counting inversion problem

    International Nuclear Information System (INIS)

    Wu Jinlong; Li Tiejun; Peng, Xiang; Guo Hong

    2011-01-01

    A statistical inversion method is proposed for the photon-photoelectron-counting statistics in quantum key distribution experiment. With the statistical viewpoint, this problem is equivalent to the parameter estimation for an infinite binomial mixture model. The coarse-graining idea and Bayesian methods are applied to deal with this ill-posed problem, which is a good simple example to show the successful application of the statistical methods to the inverse problem. Numerical results show the applicability of the proposed strategy. The coarse-graining idea for the infinite mixture models should be general to be used in the future.

  9. 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.

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

    DEFF Research Database (Denmark)

    Maurer, Jochen; Dimitrovski, Darko; Christensen, Lauge

    2012-01-01

    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...... 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...

  11. Isotopically resolved photoelectron imaging unravels complex atomic autoionization dynamics by two-color resonant ionization.

    Science.gov (United States)

    O'Keeffe, P; Gryzlova, E V; Cubaynes, D; Garcia, G A; Nahon, L; Grum-Grzhimailo, A N; Meyer, M

    2013-12-13

    Angle-resolved electron spectroscopy in coincidence with high-resolution mass spectroscopy has been applied to study two-color resonant photoionization in atomic xenon. Separation of different isotopes enabled us to extract results for the electronic dynamics free from depolarization effects, which are generally introduced by the coupling of the electronic and nuclear angular momenta. The concerted experimental and theoretical analysis of the photoelectron angular distributions in the region of an autoionizing resonance emphasizes the strong sensitivity of the observed structures to the fine details of the treatment of the underlying dynamics.

  12. Electronic structure effects in liquid water studied by photoelectron spectroscopy and density functional theory

    Energy Technology Data Exchange (ETDEWEB)

    Nordlund, Dennis; Odelius, Michael; Bluhm, Hendrik; Ogasawara, Hirohito; Pettersson, Lars G.M.; Nilsson, Anders

    2008-04-29

    We present valence photoelectron emission spectra of liquid water in comparison with gas-phase water, ice close to the melting point, low temperature amorphous and crystalline ice. All aggregation states have major electronic structure changes relative to the free molecule, with rehybridization and development of bonding and anti-bonding states accompanying the hydrogen bond formation. Sensitivity to the local structural order, most prominent in the shape and splitting of the occupied 3a{sub 1} orbital, is understood from the electronic structure averaging over various geometrical structures, and reflects the local nature of the orbital interaction.

  13. Surface analysis of Al alloys with X-ray photoelectron and Auger electron spectroscopies

    International Nuclear Information System (INIS)

    Sakairi, Masatoshi; Suzuki, Keita; Sasaki, Ryo

    2015-01-01

    In this paper, X-ray photoelectron spectroscopy (XPS) and Auger electron spectroscopy (AES) were applied to investigate passive films formed on aluminum alloy in 0.5 kmol m -3 H 3 BO 3 /0.05 kmol m -3 Na 2 B 4 O 7 with different metal cations. The metal cation is classified by metal cation hardness, X, which are calculated based on the concept of hard and soft acids and bases (HSAB) of the acid and base in Lewis's rule. From XPS analysis, the metal cations with X > 4 were incorporated in passive films. The area-selected surface analysis of AES was also introduced. (author)

  14. Modeling of RGDC film parameters using X-ray photoelectron spectroscopy.

    Science.gov (United States)

    Popat, Ketul C; Leary Swan, Erin E; Desai, Tejal A

    2005-08-02

    Immobilization of peptides on surfaces is a common method to investigate biological response to biomaterials for the development of improved tissue engineering constructs. Peptide immobilization can be achieved by either physical adsorption or covalent attachment on the surface. In this work, the RGDC peptide was covalently immobilized to alumina substrate for investigation of bone cell response. An understanding of RGDC film formation is necessary for further biological characterization. Thus, X-ray photoelectron spectroscopy was used to chemically characterize these films. These data were further utilized to calculate RGDC film thickness, density, and coverage, which are essential for understanding bone cell interactions with the underlying films and substrate.

  15. 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)

  16. Photoelectron spectroscopy in the energy region 30 to 800 eV using synchrotron radiation

    International Nuclear Information System (INIS)

    Lindau, I.; Spicer, W.E.

    1979-01-01

    With the advent of synchrotron radiation, the photoemission techniques were extended to a continous range of excitation energies in the far ultraviolet and soft X-ray regions, adding tremendously to the usefulness of photoemission as a probe of the electronic structure of materials. In this paper, the application of photoelectron spectroscopy using synchrotron radiation to the studies of oxygen chemisorption/oxidation of Si surfaces, metal overlayers on III-V semiconductor surfaces, chemisorption on transition metal surfaces, and the surface electronic structure of CuNi alloys is discussed. (Auth.)

  17. X-ray photoelectron spectroscopy investigation on electrochemical degradation of proton exchange membrane fuel cell electrodes

    Science.gov (United States)

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

    2015-05-01

    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. The electrode structure and the corresponding interface are crucial for the catalyst performance and durability.

  18. On the effects of implanted hydrogen on photoelectronic properties of CdS thin films

    Energy Technology Data Exchange (ETDEWEB)

    Mahdjoubi, L.; Benmalek, M.

    1987-01-01

    The purpose of this work is to study the effect of ion-implantation in CdS thin films. This study was done from the point of view to improve the control of the photoelectric properties of this compound. Thus, several materials such as In, Ga, Cl, Cu and Ag which are commonly used as dopants in CdS, have been implanted and their effects were nearly similar to those of classical doping methods. However, hydrogene leads to somewhat inexpected results since, as we are going to see, drastical changes occur in the photoelectronic properties of the thus treated CdS films.

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

    Science.gov (United States)

    Fushitani, Mizuho; Hishikawa, Akiyoshi

    2016-11-01

    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 I 2 molecules in the bound and dissociating low-lying electronic states and electronic-vibrational wavepacket dynamics of highly excited Rydberg N 2 molecules.

  20. Time-Resolved Photoelectron Angular Distributions from Strong-Field Ionization of Rotating Naphthalene Molecules

    DEFF Research Database (Denmark)

    Hansen, Jonas Lerche; Stapelfeldt, Henrik; Dimitrovski, Darko

    2011-01-01

    A nanosecond laser pulse confines the spatial orientation of naphthalene in 1D or 3D while a femtosecond kick pulse initiates rotation of the molecular plane around the fixed long axis. Time-dependent photoelectron angular distributions (PADs), resulting from ionization by an intense femtosecond...... probe pulse, exhibit pronounced changes as the molecular plane rotates. Enhanced 3D alignment, occurring shortly after the kick pulse, provides strongly improved contrast in molecular-frame PADs. Calculations in the strong-field approximation show that the striking structures observed in the PADs...

  1. 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 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...... 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...

  2. Surface characterization of uranium metal and uranium dioxide using X-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Allen, G.C.; Trickle, I.R.; Tucker, P.M.

    1981-01-01

    X-ray photoelectron spectra of pure uranium metal and stoichiometric uranium dioxide have been obtained using an AEI ES300 spectrometer. Binding energy values for core and valence electrons have been determined using an internally calibrated energy scale and monochromatic Al Kα radiation. Satellite peaks observed accompanying certain principal core ionizations are discussed in relation to the mechanisms by which they arise. Confirmation is obtained that for stoichiometric UOsub(2.00) a single shake-up satellite is observed accompanying the U 4fsub(7/2,5/2) principal core lines, separated by 6.8 eV to higher binding energy. (author)

  3. 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

    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......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....... The electrode structure and the corresponding interface are crucial for the catalyst performance and durability....

  4. Communication: Remarkable electrophilicity of the oxalic acid monomer: An anion photoelectron spectroscopy and theoretical study

    International Nuclear Information System (INIS)

    Buonaugurio, Angela; Graham, Jacob; Buytendyk, Allyson; Bowen, Kit H.; Ryder, Matthew R.; Gutowski, Maciej; Keolopile, Zibo G.; Haranczyk, Maciej

    2014-01-01

    Our experimental and computational results demonstrate an unusual electrophilicity of oxalic acid, the simplest dicarboxylic acid. The monomer is characterized by an adiabatic electron affinity and electron vertical detachment energy of 0.72 and 1.08 eV (±0.05 eV), respectively. The electrophilicity results primarily from the bonding carbon-carbon interaction in the singly occupied molecular orbital of the anion, but it is further enhanced by intramolecular hydrogen bonds. The well-resolved structure in the photoelectron spectrum is reproduced theoretically, based on Franck-Condon factors for the vibronic anion → neutral transitions

  5. Layer-resolved photoelectron diffraction from Si(001) and GaAs(001)

    Czech Academy of Sciences Publication Activity Database

    Bartoš, Igor; Romanyuk, Olexandr

    2012-01-01

    Roč. 185, č. 11 (2012), s. 512-517 ISSN 0368-2048 R&D Projects: GA ČR GAP204/10/0035 Grant - others:AV ČR(CZ) M100101201; AV ČR(CZ) Praemium Academiae; Murata Science Foundation(JP) 00295 Institutional research plan: CEZ:AV0Z10100521 Keywords : photoelectron diffraction * GaAs(001) * Si(001) * semiconductor surfaces * electron attenuation length Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.706, year: 2012 http://www.sciencedirect.com/science/article/pii/S0368204812001326

  6. 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

  7. Breeding for Grass Seed Yield

    DEFF Research Database (Denmark)

    Boelt, Birte; Studer, Bruno

    2010-01-01

    Seed yield is a trait of major interest for many fodder and amenity grass species and has received increasing attention since seed multiplication is economically relevant for novel grass cultivars to compete in the commercial market. Although seed yield is a complex trait and affected...... important aspects and components affecting the seed yield potential and the agronomic and environmental aspects affecting the utilization and realization of the seed yield potential. Finally, it discusses the potential of plant breeding to sustainably improve total seed yield in fodder and amenity grasses....

  8. Interface electronic properties of co-evaporated MAPbI3 on ZnO(0001): In situ X-ray photoelectron spectroscopy and ultraviolet photoelectron spectroscopy study

    International Nuclear Information System (INIS)

    Zhou, Xianzhong; Li, Xiaoli; Huang, Feng; Zhong, Dingyong; Liu, Yuan

    2016-01-01

    In this work, the interface electronic properties of ZnO(0001)/CH 3 NH 3 PbI 3 were investigated by both X-ray and ultraviolet photoelectron spectroscopy. The CH 3 NH 3 PbI 3 thin films were grown on single crystalline ZnO(0001) substrate in situ by co-evaporation of PbI 2 and CH 3 NH 3 I at room temperature with various thickness from 1.5 nm to 190 nm. It was found that the conduction band minimum of ZnO lies 0.3 eV below that of CH 3 NH 3 PbI 3 , while the valence band maximum of ZnO lies 2.1 eV below that of CH 3 NH 3 PbI 3 , implying that the electrons can be effectively transported from CH 3 NH 3 PbI 3 to ZnO, and the holes can be blocked in the same time. A PbI 2 rich layer was initially formed at the interface of ZnO(0001)/CH 3 NH 3 PbI 3 during the growth. As a consequence, an interface barrier was built up which may prevent the electron transport at the interface.

  9. Are carboxyl groups the most acidic sites in amino acids? Gas-phase acidities, photoelectron spectra, and computations on tyrosine, p-hydroxybenzoic acid, and their conjugate bases.

    Science.gov (United States)

    Tian, Zhixin; Wang, Xue-Bin; Wang, Lai-Sheng; Kass, Steven R

    2009-01-28

    Deprotonation of tyrosine in the gas phase was found to occur preferentially at the phenolic site, and the conjugate base consists of a 70:30 mixture of phenoxide and carboxylate anions at equilibrium. This result was established by developing a chemical probe for differentiating these two isomers, and the presence of both ions was confirmed by photoelectron spectroscopy. Equilibrium acidity measurements on tyrosine indicated that deltaG(acid)(o) = 332.5 +/- 1.5 kcal mol(-1) and deltaH(acid)(o) = 340.7 +/- 1.5 kcal mol(-1). Photoelectron spectra yielded adiabatic electron detachment energies of 2.70 +/- 0.05 and 3.55 +/- 0.10 eV for the phenoxide and carboxylate anions, respectively. The H/D exchange behavior of deprotonated tyrosine was examined using three different alcohols (CF3CH2OD, C6H5CH2OD, and CH3CH2OD), and incorporation of up to three deuterium atoms was observed. Two pathways are proposed to account for these results, and all of the experimental findings are supplemented with B3LYP/aug-cc-pVDZ and G3B3 calculations. In addition, it was found that electrospray ionization of tyrosine from a 3:1 (v/v) CH3OH/H2O solution using a commercial source produces a deprotonated [M-H]- anion with the gas-phase equilibrium composition rather than the structure of the ion that exists in aqueous media. Electrospray ionization from acetonitrile, however, leads largely to the liquid-phase (carboxylate) structure. A control molecule, p-hydroxybenzoic acid, was found to behave in a similar manner. Thus, the electrospray conditions that are employed for the analysis of a compound can alter the isomeric composition of the resulting anion.

  10. Scanning photoelectron microscope for nanoscale three-dimensional spatial-resolved electron spectroscopy for chemical analysis.

    Science.gov (United States)

    Horiba, K; Nakamura, Y; Nagamura, N; Toyoda, S; Kumigashira, H; Oshima, M; Amemiya, K; Senba, Y; Ohashi, H

    2011-11-01

    In order to achieve nondestructive observation of the three-dimensional spatially resolved electronic structure of solids, we have developed a scanning photoelectron microscope system with the capability of depth profiling in electron spectroscopy for chemical analysis (ESCA). We call this system 3D nano-ESCA. For focusing the x-ray, a Fresnel zone plate with a diameter of 200 μm and an outermost zone width of 35 nm is used. In order to obtain the angular dependence of the photoelectron spectra for the depth-profile analysis without rotating the sample, we adopted a modified VG Scienta R3000 analyzer with an acceptance angle of 60° as a high-resolution angle-resolved electron spectrometer. The system has been installed at the University-of-Tokyo Materials Science Outstation beamline, BL07LSU, at SPring-8. From the results of the line-scan profiles of the poly-Si/high-k gate patterns, we achieved a total spatial resolution better than 70 nm. The capability of our system for pinpoint depth-profile analysis and high-resolution chemical state analysis is demonstrated. © 2011 American Institute of Physics

  11. An optimized photoelectron track reconstruction method for photoelectric X-ray polarimeters

    Science.gov (United States)

    Kitaguchi, Takao; Black, Kevin; Enoto, Teruaki; Fukazawa, Yasushi; Hayato, Asami; Hill, Joanne E.; Iwakiri, Wataru B.; Jahoda, Keith; Kaaret, Philip; McCurdy, Ross; Mizuno, Tsunefumi; Nakano, Toshio; Tamagawa, Toru

    2018-02-01

    We present a data processing algorithm for angular reconstruction and event selection applied to 2-D photoelectron track images from X-ray polarimeters. The method reconstructs the initial emission angle of a photoelectron from the initial portion of the track, which is obtained by continuously cutting a track until the image moments or number of pixels fall below tunable thresholds. In addition, event selection which rejects round tracks quantified with eccentricity and circularity is performed so that polarimetry sensitivity considering a trade-off between the modulation factor and signal acceptance is maximized. The modulation factors with applying track selection are 26 . 6 ± 0 . 4, 46 . 1 ± 0 . 4, 62 . 3 ± 0 . 4, and 61 . 8 ± 0 . 3% at 2.7, 4.5, 6.4, and 8.0 keV, respectively, using the same data previously analyzed by Iwakiri et al. (2016), where the corresponding numbers are 26 . 9 ± 0 . 4, 43 . 4 ± 0 . 4, 54 . 4 ± 0 . 3, and 59 . 1 ± 0 . 3%. The method improves polarimeter sensitivity by 5%-10% at the high energy end of the band previously presented (Iwakiri et al. 2016).

  12. 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.

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

    International Nuclear Information System (INIS)

    Kubota, Mari.; Kobayashi, Tsunetoshi

    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 π 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 π orbital of 5-methoxyindole and the highest occupied π and the n 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 π orbital mainly localized on the 5-methoxyindole group and is ascribed to the fourth highest occupied π orbital of 5-methoxyindole

  14. 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...

  15. Photoelectron Spectroscopy and Electronic Structures of Fullerene Oxides: C60Ox- (x=1-3)

    Energy Technology Data Exchange (ETDEWEB)

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

    2005-12-15

    We report a photoelectron spectroscopy (PES) study on a series of fullerene oxides, C600x- (x = 1-3). The PES spectra reveal one isomer for C600x-, two isomers for C6002-, and multiple isomers for C6003-. Compared to C60, the electronic structures of C600x are only slightly perturbed, resulting in similar anion photoelectron spectra. The electron affinity of C600x was observed to increase only marginally with the number of oxygen atoms, x, from 2.683 eV for C60, to 2.745 eV for C600, and 2.785 eV/2.820 eV for C6002 (two isomers). We also carried out theoretical calculations, which confirmed the observed isomers and showed that all the fullerene oxides are in the form of epoxide. The PES and theoretical calculations, as well as molecular orbital analysis, indicate that addition of oxygen atoms to the C60 cage only modifies the local carbon network and leave the rest of the fullerene cage largely intact geometrically and electronically.

  16. Infrared and photoelectron spectroscopy study of vapor phase deposited poly (3-hexylthiophene)

    International Nuclear Information System (INIS)

    Wei Haoyan; Scudiero, L.; Eilers, Hergen

    2009-01-01

    Poly (3-hexylthiophene) (P3HT) was thermally evaporated and deposited in vacuum. Infrared spectroscopy was used to confirm that the thin films were indeed P3HT, and showed that in-situ thermal evaporation provides a viable route for contaminant-free surface/interface analysis of P3HT in an ultrahigh-vacuum (UHV) environment. Ultraviolet photoelectron spectroscopy (UPS) as well as X-ray photoelectron spectroscopy (XPS) experiments were carried out to examine the frontier orbitals and core energy levels of P3HT thin films vapor deposited in UHV on clean polycrystalline silver (Ag) surfaces. UPS spectra enable the determination of the vacuum shift at the polymer/metal interface, the valence band maximum (VBM), and the energy of the π-band of the overlayer film. The P3HT vacuum level decreased in contrast to that of the underlying Ag as the film thickness increased. XPS and UPS data confirmed the chemical integrity (stoichiometry) of the polymer at high coverage, as well as the shift of the C 1s and S 2p binding energy peaks and the secondary-electron edge with increasing film thickness, indicating that band bending is present at the P3HT/Ag interface and that the measured onset of the valence band is about 0.8 ± 0.05 eV relative to the Fermi level.

  17. A scanning photoelectron microscope (SPEM) at the National Synchrotron Light Source (NSLS)

    International Nuclear Information System (INIS)

    Ade, H.; Kirz, J.; Hulbert, S.; Johnson, E.; Anderson, E.; Kern, D.; Brookhaven National Lab., Upton, NY; Lawrence Berkeley Lab., CA; International Business Machines Corp., Yorktown Heights, NY

    1989-01-01

    We are in the process of developing and commissioning a scanning photoelectron microscope (SPEM) at the X1A beamline of the National Synchrotron Light Source (NSLS). It is designed to make use of the Soft X-ray Undulator (SXU) at the NSLS. This high brightness source illuminates a Fresnel zone plate, which forms a focused probe, ≤ 0.2μm in size, on the specimen surface. A grating monochromator selects the photon energy in the 400-800 eV range with an energy resolution of better than 1 eV. The expected flux in the focus is in the 5 x 10 7 - 10 9 photons/s range. A single pass Cylindrical Mirror Analyzer (CMA) is used to record photoemission spectra, or to form an image within a fixed electron energy bandwidth as the specimen is mechanically scanned. As a first test, a 1000 mesh Au grid was successfully imaged with a resolution of about 1μm and the CMA tuned to the Au 4 f photoelectron peak. Once it is commissioned, a program is planned which will utilize the microscope to study beam sensitive systems, such as thin oxide/sub-oxide films of alumina and silica, and ultimately various adsorbates on these films. 14 refs., 4 figs

  18. 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.

  19. 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.

  20. 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.

  1. Angular distributions of photoelectrons from resonant two-photon ionization: A graphical approach

    International Nuclear Information System (INIS)

    Chien, R.

    1984-01-01

    The Liouville representation is a formalism that describes quantum mechanical problems by using the space of density operators as kets and the space of observable operators as bras. It is useful for problems with complicated angular momentum coupling because it gives directly the probabilities and expectation values rather than probability amplitudes, so that some of the extended and tedious steps of the angular momentum algebra are eliminated. The graphical representation of angular momentum coupling has proved itself as another way to simplify and clarify calculations; graphical representation helps one to visualize the physics and simplifies and organizes the computations. By combining the graphical method and Liouville representation, we introduce a simple, transparent method to deal with problems of many coupled angular momenta. We use this formalism to derive the analytic expression for the angular distributions of photoelectrons. The angular distributions are represented by diagrams of density matrix and detector operators and a diagram of the transition matrix. The analytic expressions are then obtained from the diagrams by following simple general rules for the graphical reduction. A specific example, angular distributions of photoelectrons from resonant two-photon ionization of alkali atoms with hyperfine interaction, is also given

  2. 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.

  3. Photoelectron diffraction study of Rh nanoparticles growth on Fe3O4/Pd(111) ultrathin film

    International Nuclear Information System (INIS)

    Abreu, G. J. P.; Pancotti, A; Lima, L. H. de; Landers, R.; Siervo, A. de

    2013-01-01

    Metallic nanoparticles (NPs) supported on oxides thin films are commonly used as model catalysts for studies of heterogeneous catalysis. Several 4d and 5d metal NPs (for example, Pd, Pt and Au) grown on alumina, ceria and titania have shown strong metal support interaction (SMSI), for instance the encapsulation of the NPs by the oxide. The SMSI plays an important role in catalysis and is very dependent on the support oxide used. The present work investigates the growth mechanism and atomic structure of Rh NPs supported on epitaxial magnetite Fe 3 O 4 (111) ultrathin films prepared on Pd(111) using the Molecular Beam Epitaxy (MBE) technique. The iron oxide and the Rh NPs were characterized using X-ray photoelectron spectroscopy (XPS), low-energy electron diffraction and photoelectron diffraction (PED). The combined XPS and PED results indicate that Rh NPs are metallic, cover approximately 20 % of the iron oxide surface and show height distribution ranging 3–5 ML (monolayers) with essentially a bulk fcc structure.

  4. 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 C 2 P - 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 C 2 P 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 - , C 2 P, and two electronic states of C 2 P - . 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 C 2 P (2.6328 ± 0.0006 eV) are measured accurately and found to be quite high, suggesting that the CP - and C 2 P - 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.

  5. Calculation of photodetachment cross sections and photoelectron angular distributions of negative ions using density functional theory

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Yuan [Department of Physics, State Key Laboratory of Low-Dimensional Quantum Physics, Tsinghua University, Beijing 100084 (China); Ning, Chuangang, E-mail: ningcg@tsinghua.edu.cn [Department of Physics, State Key Laboratory of Low-Dimensional Quantum Physics, Tsinghua University, Beijing 100084 (China); Collaborative Innovation Center of Quantum Matter, Beijing (China)

    2015-10-14

    Recently, the development of photoelectron velocity map imaging makes it much easier to obtain the photoelectron angular distributions (PADs) experimentally. However, explanations of PADs are only qualitative in most cases, and very limited works have been reported on how to calculate PAD of anions. In the present work, we report a method using the density-functional-theory Kohn-Sham orbitals to calculate the photodetachment cross sections and the anisotropy parameter β. The spherical average over all random molecular orientation is calculated analytically. A program which can handle both the Gaussian type orbital and the Slater type orbital has been coded. The testing calculations on Li{sup −}, C{sup −}, O{sup −}, F{sup −}, CH{sup −}, OH{sup −}, NH{sub 2}{sup −}, O{sub 2}{sup −}, and S{sub 2}{sup −} show that our method is an efficient way to calculate the photodetachment cross section and anisotropy parameter β for anions, thus promising for large systems.

  6. 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.

  7. Photoelectron-Auger electron coincidence spectroscopy of free molecules: New experiments

    International Nuclear Information System (INIS)

    Ulrich, Volker; Barth, Silko; Lischke, Toralf; Joshi, Sanjeev; Arion, Tiberiu; Mucke, Melanie; Foerstel, Marko; Bradshaw, Alex M.; Hergenhahn, Uwe

    2011-01-01

    Photoelectron-Auger electron coincidence spectroscopy probes the dicationic states produced by Auger decay following the photoionization of core or inner valence levels in atoms, molecules or clusters. Moreover, the technique provides valuable insight into the dynamics of core hole decay. This paper serves the dual purpose of demonstrating the additional information obtained by this technique compared to Auger spectroscopy alone as well as of describing the new IPP/FHI apparatus at the BESSY II synchrotron radiation source. The distinguishing feature of the latter is the capability to record both the photoelectron and Auger electron with good energy and angle resolution, for which purpose a large hemispherical electrostatic analyser is combined with several linear time-of-flight spectrometers. New results are reported for the K-shell photoionization of oxygen (O 2 ) and the subsequent KVV Auger decay. Calculations in the literature for non-coincident O 2 Auger spectra are found to be in moderately good agreement with the new data.

  8. 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.

  9. Effect of density and planting pattern on yield and yield

    Directory of Open Access Journals (Sweden)

    alireza yadavi

    2009-06-01

    Full Text Available In order to evaluate competition ability of Grain maize (Zea mays L. against redroot pigweed (Amaranthus retroflexus L. a field experiment was conducted at Esfahan on 2003. In this research the effect of corn spatial arrangement on yield and yield components of corn (647 Three Way Cross hybrids under different levels of redroot pigweed infestation was investigated. Treatments were arranged in a factorial split experiment based on RCBD with three replications. Factorial arrangement of corn densities (74000 and 111000 plant ha-1 and planting patterns (single row, rectangular twin row and zigzag twin row formed the main plots. Split-plots referred to pigweed densities (0, 4, 8 and 12 plant m-1. Results showed that both grain and biological yield of corn increased as corn density rates increased but rows number per cob, number of grains per row of cob and 1000 grains weight decreased. The effects of planting arrangement on yield and yield components despite rows grain in cob, 1000 seeds weight and harvest index were statistically significant. Corn grain yield and yield components decreased significantly by increasing pigweed density. The effect of redroot pigweed density on corn grain and biological yield loss was predicted using Cousence hyperbolic yield equation. It showed that maximum grain yield loss and biological yield loss happened in single row arrangement and low corn density. Rows number per cob and grain numbers per row in higher corn density treatment showed lower reduction slopes under pigweed competition. In addition, grain rows numbers per cob and corn harvest index in twin arrangement treatments decreased lower than single row treatment under pigweed competition. The results of this research indicated that corn competition ability against redroot pigweed could be increased using dense population (1/5 fold of general density and zigzag twin row arrangement.

  10. Systematics in delayed neutron yields

    Energy Technology Data Exchange (ETDEWEB)

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

    1998-03-01

    An attempt was made to reproduce the systematic trend observed in the delayed neutron yields for actinides on the basis of the five-Gaussian representation of the fission yield together with available data sets for delayed neutron emission probability. It was found that systematic decrease in DNY for heavier actinides is mainly due to decrease of fission yields of precursors in the lighter side of the light fragment region. (author)

  11. VARIABILITY OF YIELD AND YIELD COMPONENTS IN “EGUSI ...

    African Journals Online (AJOL)

    journal

    In a study carried out to estimate the components of variation in 'egusi' melon populations indicated high proportion of genetic variation in the yield attributes ... of the improvement made in yield of watermelon may be attributed to its genetic ..... variability and correlation studies in “egusi” melon [Citrullus lanatus (Thunb) ...

  12. 7755 EFFECT OF NPK FERTILIZER ON FRUIT YIELD AND YIELD ...

    African Journals Online (AJOL)

    Win7Ent

    2013-06-03

    Jun 3, 2013 ... who reported maximum fruit yield in watermelon with an application of maleic hydrazide at 100 ppm. The yield increased from 7.22 tons/ha in the control to 13.1 tons/ha in the treatment with 100 ppm maleic hydrazide and 100 ppm ethephon, resulting in an additional return which increased the income from ...

  13. Studies on yield and yield component responses of Mucuna ...

    African Journals Online (AJOL)

    Mucuna flagellipes was subjected to field scale culture over 1999 and 2000 growth seasons. Yield and yield component responses were evaluated using 4 x 3 factorial treatment combinations of phosphorus at 0, 20, 40, and 60kg P ha-1 and lime at 0, 1 and 2 t CaCO3 ha-1. The experiment was laid out in a randomized ...

  14. Relationship between yield and some yield components in cowpea ...

    African Journals Online (AJOL)

    Bean common mosaic virus–blackeye cowpea strain (BCMV-BlC) and cowpea aphid-borne mosaic virus (CABMV) belonging to the genus potyvirus are cosmopolitan and economically important pathogens of cowpea. This study analysed the linear relationship between yield and some yield related characters (numbers of ...

  15. Nitrogen rate and plant population effects on yield and yield ...

    African Journals Online (AJOL)

    This research was carried out to determine the effect of plant population and nitrogen rates on yield and yield components in soybean under Bursa, Mustafakemalpaa ecological conditions. Trials were conducted during 2000 and 2001 at the experimental fields of the Mustafakemalpaa Vocational High School, University of ...

  16. Response of Yield and Yield Components of Tef [Eragrostis Tef ...

    African Journals Online (AJOL)

    Tef (Eragrostis tef) is one of most important food crops grown in Benishangul Gumuz region of Ethiopia and is ... Nitrogen by P interaction effect was significant on plant height, straw and grain yield. Grain yield increased .... indicating the possibility of Al toxicity and deficiency of certain plant nutrients. The exchangeable K of ...

  17. 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.

  18. Multiphoton double ionization of Ar in intense extreme ultraviolet laser fields studied by shot-by-shot photoelectron spectroscopy.

    Science.gov (United States)

    Hikosaka, Y; Fushitani, M; Matsuda, A; Tseng, C-M; Hishikawa, A; Shigemasa, E; Nagasono, M; Tono, K; Togashi, T; Ohashi, H; Kimura, H; Senba, Y; Yabashi, M; Ishikawa, T

    2010-09-24

    Photoelectron spectroscopy has been performed to study the multiphoton double ionization of Ar in an intense extreme ultraviolet laser field (hν ∼ 21  eV, ∼ 5  TW/cm²), by using a free electron laser (FEL). Three distinct peaks identified in the observed photoelectron spectra clearly show that the double ionization proceeds sequentially via the formation of Ar(+): Ar+hν→Ar (+) + e⁻ and Ar²(+) + 2hν→Ar(+) + e⁻. Shot-by-shot recording of the photoelectron spectra allows simultaneous monitoring of FEL spectrum and the multiphoton process for each FEL pulse, revealing that the two-photon ionization from Ar(+) is significantly enhanced by intermediate resonances in Ar(+).

  19. Yield gaps in oil palm

    NARCIS (Netherlands)

    Woittiez, Lotte S.; Wijk, van Mark T.; Slingerland, Maja; Noordwijk, van Meine; Giller, Ken E.

    2017-01-01

    Oil palm, currently the world's main vegetable oil crop, is characterised by a large productivity and a long life span (≥25 years). Peak oil yields of 12 t ha−1 yr−1 have been achieved in small plantations, and maximum theoretical yields as calculated with simulation models are 18.5 t oil ha−1 yr−1,

  20. Design and development of photoelectron detection chambers for the DELPHI experiment RICH Cerenkov counters

    International Nuclear Information System (INIS)

    Amrane, N.

    1986-01-01

    The particle identifier of the Barrel-RICH detector, based on the Cerenkov effect is a crucial element of the DELPHI spectrometer. In this detector, Cerenkov light is focussed as a ring whose diameter is related to the velocity of the particle. The measure of the ring's diameter is done by conversion of photons in a gaseous environment and then by measure of the position of the photons in a wire chamber after the drift of the photoelectrons. Three types of wire chambers (chambers in U shape, circular chambers, chambers with flat cathodes) have been designed and tested. The choice of the flat cathode chambers has been determined by the reliability, the simplicity and the considerations of price [fr

  1. Photodissociation and charge transfer dynamics of negative ions studied with femtosecond photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Zanni, Martin Thomas [Univ. of California, Berkeley, CA (United States)

    1999-12-01

    This dissertation presents studies aimed at understanding the potential energy surfaces and dynamics of isolated negative ions, and the effects of solvent on each. Although negative ions play important roles in atmospheric and solution phase chemistry, to a large extent the ground and excited state potential energy surfaces of gas phase negative ions are poorly characterized, and solvent effects even less well understood. In an effort to fill this gap, the author's coworkers and the author have developed a new technique, anion femtosecond photoelectron spectroscopy, and applied it to gas phase photodissociation and charge transfer processes. Studies are presented that (1) characterize the ground and excited states of isolated and clustered anions, (2) monitor the photodissociation dynamics of isolated and clustered anions, and (3) explore the charge-transfer-to-solvent states of atomic iodide clustered with polar and non-polar solvents.

  2. Is CO Carbon KVV Auger Electron Emission Affected by the Photoelectron?

    International Nuclear Information System (INIS)

    Pruemper, G.; Fukuzawa, H.; Sakai, K.; Ueda, K.; Rolles, D.; Prince, K. C.; Harries, J. R.; Tamenori, Y.; Berrah, N.

    2008-01-01

    Angular distributions (ADs) of O + fragments from C 1s photoexcited CO detected in coincidence with carbon KVV Auger electrons emitted in the horizontal direction were measured at photon energies of 298, 305, 320, and 450 eV. At 450 eV, the ADs are polarization-independent and coincide with the molecular-frame Auger electron angular distribution. All measured ADs can be rationalized as a product of the same molecular-frame Auger electron angular distribution and the axial selectivity in the photoionization process. Thus the interaction between the photoelectron and the Auger electron for the normal Auger decay of CO can be neglected, and the two-step model is a good approximation

  3. Near gap excitation of a CDW amplitude mode by time-resolved photoelectron spectroscopy

    Science.gov (United States)

    Leuenberger, Dominik; Yang, Shuolong; Sobota, Jonathan; Giraldo, Paula; Kirchmann, Patrick; Fisher, Ian; Shen, Zhi-Xun

    2014-03-01

    We present time-, angle- and energy-resolved photoelectron spectroscopy data from the light rear-earth tritelluride compound CeTe3. An in-plane Peierls distortion in the tellurium slabs leads to the formation of an incommensurate Charge Density Wave (CDW), accompanied by a CDW gap at the Fermi level. Ultrafast optical laser excitation and subsequent relaxation by means of electron-phonon coupling can coherently excite a periodic modulation of the CDW band position and the gap size in rear-earth tritellurides. In this work, the use of tuneable near infrared laser pulses allows for optical excitation slightly above and below the measured gap value of 570 meV. The smaller excitation phase space not only leads to cleaner amplitude mode signal but also helps to pin down the optical transitions, which are the driving mechanisms for the transient CDW phase transition. Financial support by the Swiss National Science Foundation is duly acknowledged.

  4. Control of the spin polarization of photoelectrons/photoions using short laser pulses

    International Nuclear Information System (INIS)

    Nakajima, Takashi

    2004-01-01

    We present a generic pump-probe scheme to control spin polarization of photoelectrons/photoions by short laser pulses. By coherently exciting fine structure manifolds of a multi-valence-electron system by the pump laser, a superposition of fine structure states is created. Since each fine structure state can be further decomposed into a superposition of various spin states of valence electrons, each spin component evolves differently in time. This means that varying the time delay between the pump and probe lasers leads to the control of spin states. Specific theoretical results are presented for two-valence-electron atoms, in particular for Mg, which demonstrate that not only the degree of spin polarization but also its sign can be manipulated through time delay. Since the underline physics is rather general and transparent, the presented idea may be potentially applied to nanostructures such as quantum wells and quantum dots

  5. Use of X-ray photoelectron spectroscopy to study radiation and thermal effects in polytetrafluoroethylene

    International Nuclear Information System (INIS)

    Wheeler, D.R.; Pepper, S.V.

    1990-01-01

    X-ray photoelectron spectroscopy of the surface and mass spectroscopy of the gas evolved during irradiation and subsequent heating of irradiated polytetrafluoroethylene (PTFE) indicated that the effect of electron irradiation was the same as that of x-irradiation. Saturated fluorocarbon gas was evolved during irradiation and a cross-linked or branched network formed in the surface region. Heating irradiated PTFE to temperatures below 200C resulted in the evolution of additional saturated fluorocarbon gas but no change in the surface. From 200C to 300C, lightly damaged PTFE did not change further, but severely damaged PTFE emitted unsaturated fluorocarbons while the surface underwent apparent partial recovery. These observations demonstrate the thermal instability of the irradiated PTFE surface and allow elaboration of the existing model of radiation damage in PTFE

  6. Photoelectron spectroscopy of some 3d and 4f oxides exposed to Ar+ beams

    International Nuclear Information System (INIS)

    Baba, Yuji; Sasaki, T.A.; Yamamoto, Hiroyuki; Hoonnivathana, E.; Sasase, Masato; Takano, Ichiro; Isobe, Shoji.

    1992-01-01

    The effects of the ion bombardment on the surface electronic structures and electrical properties of transition-metal oxides and lanthanide oxides have been investigated by a photoelectron spectroscopy and measurement of surface electric conductivity. Many of the oxides (TiO 2 , CeO 2 , etc.) are reduced to the oxides in lower valence states by the 8-keV Ar + -ion bombardment, but there exist some oxides (Sc 2 O 3 , La 2 O 3 , etc.) which are stable against the bombardment. For TiO 2 , the bombardment-induced reduction brings about Ti3d-derived new band at the Fermi level, together with the increase of the surface electric conductivity. The mechanism leading to bombardment-induced surface electric conductivity is discussed in relation to the surface electronic structures. (author)

  7. Analysis of electron-irradiated poly-ether ether ketone by X-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Oyabu, Matashige; Kobayashi, Yoshinori; Seguchi, Tadao; Sasuga, Tsuneo; Kudoh, Hisaaki.

    1995-01-01

    Organic polymers used in atomic power plants or space are damaged by ionizing irradiation. Radicals produced by irradiation cause oxidation, chain scission and crosslinking, all of which lead to degradation of the material. In this paper, the surface of electron-irradiated poly-ether ether ketone (PEEK) was studied by X-ray photoelectron spectroscopy (XPS). The irradiation in air was found to oxidize the PEEK surface producing carboxyl groups, the content of which dependant on the dose. Carboxyl groups were not produced in helium gas. Quantitative spectral analysis indicated that the aromatic structure might be decomposed. Some comparison was made between the semicrystalline and amorphous samples. The oxygen content resulting from irradiation, of semicrystalline PEEK increased more than that of amorphous PEEK. (author)

  8. Core-Hole Molecular Frame X-Ray Photoelectron Angular Distributions as Molecular Geometry Probes

    Science.gov (United States)

    Trevisan, Cynthia; Williams, Joshua; Menssen, Adrian; Weber, Thorsten; Rescigno, Thomas; McCurdy, Clyde; Landers, Allen

    2014-05-01

    We present experimental and theoretical results for the angular dependence of electrons ejected from the core orbitals of ethane (C2H6) and tetrafluoromethane (CF4) in an effort to understand the origin of the imaging effect by which the molecular frame photoelectron angular distributions (MFPADs) for removing an electron from a 1s orbital effectively image the geometry of a class of molecules. At low energies, our calculations predict the same imaging effect in X2H6 previously found in CH4, H2O and NH3. By contrast, in experiment and calculations CF4 displays an anti-imaging effect, whereby the electron ejected by core photoionization has the tendency to avoid molecular bonds, if averaged over directions of polarization of the incident X-ray beam. Our measurements employ the COLTRIMS method and the calculations were performed with the Complex Kohn Variational method.

  9. Ligand additivity in the valence photoelectron spectroscopy of phosphine-substituted molybdenum carbonyls

    International Nuclear Information System (INIS)

    Bursten, B.E.; Darensbourg, D.J.; Kellogg, G.E.; Lichtenberger, D.L.

    1984-01-01

    The He I valence photoelectron spectra in the 6-9-eV ionization region are reported for seven phosphine-substituted molybdenum carbonyls. The observation of vibrational structure due to excitation of a CO stretching mode in several of the spectra aids band assignment. These data are used to test the validity of the model of ligand additivity for determining the energetics of the dπ electrons in octahedral d 6 complexes. It is shown that the model successfully correlates the positions, intensities, and number of the ionization bands for the molybdenum compounds. A comparison of the results for the complexes of different phosphine ligands indicates that the trimethyl (PMe 3 ), triethyl (PEt 3 ), and tri-n-butyl (P-n-Bu 3 ) phosphines are comparable π-acceptors, but that the sigma-donor strength increases as PMe 3 3 3

  10. X-ray photoelectron spectroscopy of the uranium/oxygen system: Part 13

    International Nuclear Information System (INIS)

    Allen, G.C.; Stevens, J.C.H.

    1987-02-01

    The reaction between commercial H 2 and uranium metal leads to the formation of UO 2 due to traces of water vapour or oxygen. When extremely pure H 2 is used uranium hydride may be formed but, even with 99.9999% H 2 , uranium dioxide forms preferentially. The present work identifies the presence of UH 3 in the X-ray photoelectron spectrum of a uranium sample which has been exposed to ∼ 5 mbar H 2 at ∼ 200 0 C for 1 hour. This spectrum indicates that the hydride possesses a high degree of covalency, since the oxidation state of uranium in UH 3 appears to be ∼ 1.4. (U.K.)

  11. X-ray photoelectron spectroscopy study of CO2 reaction with polycrystalline uranium surface

    International Nuclear Information System (INIS)

    Liu Kezhao; Yu Yong; Zhou Juesheng; Wu Sheng; Wang Xiaolin; Fu Yibei

    1999-10-01

    The adsorption of CO 2 on 'clean' depleted polycrystalline uranium metal surface has been studied by X-ray photoelectron spectroscopy (XPS) at 300 K. The 'clean' surface were prepared by Ar + ion sputtering under ultra-high vacuum (UHV) condition with a base pressure 6.7 x 10 -8 Pa. The result s shows that adsorption of CO 2 on 'clean' uranium metal took place in total dissociation, and leads to the formation of uranium dioxide, uranium carbides and free carbon. The total dissociation of CO 2 produced carbon, oxygen species, CO 2 2- and CO 3 2- species. The diffusion tendency of carbon was much stronger than that of oxygen, and led to form a carbide in oxide-metal interface while the oxygen remained on their surface as an oxide

  12. Photodissociation and charge transfer dynamics of negative ions studied with femtosecond photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Zanni, Martin T.

    1999-01-01

    This dissertation presents studies aimed at understanding the potential energy surfaces and dynamics of isolated negative ions, and the effects of solvent on each. Although negative ions play important roles in atmospheric and solution phase chemistry, to a large extent the ground and excited state potential energy surfaces of gas phase negative ions are poorly characterized, and solvent effects even less well understood. In an effort to fill this gap, the author's coworkers and the author have developed a new technique, anion femtosecond photoelectron spectroscopy, and applied it to gas phase photodissociation and charge transfer processes. Studies are presented that (1) characterize the ground and excited states of isolated and clustered anions, (2) monitor the photodissociation dynamics of isolated and clustered anions, and (3) explore the charge-transfer-to-solvent states of atomic iodide clustered with polar and non-polar solvents

  13. Lyophilized histidine investigated using X-ray photoelectron spectroscopy and cryogenics: Deprotonation in vacuum

    International Nuclear Information System (INIS)

    Cardenas, Juan F.; Groebner, Gerhard

    2005-01-01

    Lyophilized histidine samples were investigated using X-ray photoelectron spectroscopy (XPS). Lyophilized samples were prepared from aqueous solutions at a pH in the range between ∼1.5 and ∼10, and with no further addition of electrolyte. The use of cryogenics allowed the determination of protonated to unprotonated molar ratios of sites in L-histidine, which correlates well with the dissociation constants of the residual amino acid sites. When cryogenics was not used deprotonation of the lyophilized samples occurred, where the degree and the total concentration of deprotonated sites correlates well with the formation constants and the decrease in Cl concentration, respectively. This later relation clearly indicates a correlation between deprotonation and the desorption of HCl from lyophilized samples

  14. 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.

  15. Analysis of Bacterial Cell Surface Chemical Composition Using Cryogenic X-Ray Photoelectron Spectroscopy.

    Science.gov (United States)

    Ramstedt, Madeleine; Shchukarev, Andrey

    2016-01-01

    This chapter describes a method for measuring the average surface chemical composition with respect to lipids, polysaccharides, and peptides (protein + peptidoglycan) for the outer part of the bacterial cell wall. Bacterial cultures grown over night are washed with a buffer or saline at controlled pH. The analysis is done on fast-frozen bacterial cell pellets obtained after centrifugation, and the analysis requires access to X-ray photoelectron spectroscopy instrumentation that can perform analyses at cryogenic temperatures (for example using liquid nitrogen). The method can be used to monitor changes in the cell wall composition following environmental stimuli or genetic mutations. The data obtained originate from the outermost part of the cell wall. Thus, it is expected that for gram-negative bacteria only the outer membrane and part of the periplasmic peptidoglycan layer is probed during analysis, and for gram-positive bacteria only the top nanometers of the peptidoglycan layer of the cell wall is monitored.

  16. Study by photoelectron spectroscopy of isotopic effects in various polyatomic molecules. Comparison between experimental and calculated vibrational transitions probabilities

    International Nuclear Information System (INIS)

    Carlier, J.; Botter, R.

    1978-01-01

    Isotopic substitution of polyatomic molecules shift the spectrum in photoelectron spectroscopy. This effect is easier to detect with substitution of hydrogen by deuterium than with heavier elements. Hydrogen partially or totally substituted in ethylene by deuterium is studied by photoelectron spectroscopy for frequency attribution and experimental results are compared with frequency ratio calculated by the Teller-Redlich rule. Vibrational transition probabilities are also determined with a good precision. Ionization potentials are higher for molecules with heavy isotopes but for partially substituted molecules a variation of symetry could shift slightly potential curves [fr

  17. Probing the KII 3p54p fine structure by photoelectron spectroscopy of laser-excited potassium

    International Nuclear Information System (INIS)

    Meyer, M; Cubaynes, D; Wuilleumier, F J; Heinecke, E; Richter, T; Zimmermann, P; Strakhova, S I; Grum-Grzhimailo, A N

    2006-01-01

    Photoelectron spectra of atomic potassium excited by laser optical pumping into the 3p 6 4p 2 P 1/2 and 2 P 3/2 states are measured with high-energy resolution. The relative intensities of the 3p 5 4p fine-structure lines depend strongly on the initial excitation to one of the 4p spin-orbit components. Similar to the case of sodium, dynamically and quasiforbidden transitions are observed in the photoelectron spectra of potassium. The theoretical predictions of the generalized geometrical model are in excellent agreement with the experimental data. (letter to the editor)

  18. Strong Circular Dichroism in Photoelectron Diffraction from Nonchiral, Nonmagnetic Material—Direct Observation of Rotational Motion of Electrons

    Science.gov (United States)

    Daimon, Hiroshi; Nakatani, Takeshi; Imada, Shin; Suga, Shigemasa; Kagoshima, Yasushi; Miyahara, Tsuneaki

    1993-10-01

    Strong circular dichroism is found in 2-dimensional angular distribution patterns of the Si 2p photoelectrons from the Si(001) surface, which has no chirality and magnetism. The forward focusing peaks in the pattern rotate clockwise or counterclockwise when the helicity of the incident circularly polarized light is reversed. These rotations of the pattern are explained by rotational motion of photoelectrons around the nuclei. This is the first direct observation of the rotational motion of the electrons and clarifies the correspondence between the classical and the quantum mechanical ideas of angular momentum.

  19. 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)

  20. Ambient Pressure Hard X-ray Photoelectron Spectroscopy for Functional Material Systems as Fuel Cells under Working Conditions.

    Science.gov (United States)

    Takagi, Yasumasa; Uruga, Tomoya; Tada, Mizuki; Iwasawa, Yasuhiro; Yokoyama, Toshihiko

    2018-03-20

    Heterogeneous interfaces play important roles in a variety of functional material systems and technologies, such as catalysis, batteries, and devices. A fundamental understanding of efficient functions at interfaces under realistic conditions is crucial for sophisticated designs of useful material systems and novel devices. X-ray photoelectron spectroscopy is one of the most promising and common methods to investigate such material systems. Although X-ray photoelectron spectroscopy is usually conducted under high vacuum because of the requirement of electron detection with the precise measurement of kinetic energies, extensive efforts have been devoted to the measurements in gaseous environments. Very recently, we have succeeded in measuring X-ray photoelectron spectra under real ambient atmosphere (10 5 Pa), using synchrotron radiation hard X-rays with the photon energy of 8 keV and the windowless electron spectrometer system. In this Account, the novel useful technique of real ambient pressure hard X-ray photoelectron spectroscopy is reviewed. As examples of (near) ambient pressure hard X-ray photoelectron spectroscopy, hydrogen storage of Pd nanoparticles is at first investigated by recording Pd 3d and valence band spectra under hydrogen atmosphere. The Pd 3d and valence band spectra are found to change rather abruptly depending on the hydrogen pressure, demonstrating a behavior like phase transformation. Subsequently, as a main topic in this Account, we describe investigations of the electronic states of platinum nanoparticles on the cathode electrocatalyst in a polymer electrolyte fuel cell (PEFC) under the voltage operating conditions using the near ambient pressure hard X-ray photoelectron spectroscopic system. The Pt 4f and 3d X-ray photoelectron spectra of the cathode Pt/C catalysts clearly show that the oxidized Pt species is at most divalent and the tetravalent Pt species does not exist on the Pt nanoparticles even at the positive cathode-anode voltage

  1. Electronic properties of semiconducting naphthalene bisimide derivatives—Ultraviolet photoelectron spectroscopy versus electrochemistry

    International Nuclear Information System (INIS)

    Rybakiewicz, Renata; Gawrys, Pawel; Tsikritzis, Dimitris; Emmanouil, Konstantinos; Kennou, Stella; Zagorska, Malgorzata; Pron, Adam

    2013-01-01

    Highlights: ► Electrochemical method for the determination of the ionization potential (IP) in organic semiconductors was validated. ► Excellent correlation was found between the IP values determined electrochemically and by UPS for naphthalene bisimides. ► Excellent correlation was found between the calculated (DFT) IP values and the experimentally determined ones. -- Abstract: Key parameters for organic semiconductors used as active layers in organic electronic devices are: solution processability, charge carriers mobility as well as the electron affinity (EA) and the ionization potential (IP) which determine their redox properties and by consequence their air stability. The purpose of the present work was to investigate the influence of different substituents at imide nitrogen atom (alkylaryl, thienylene and triarylamine) and at naphthalene core (triarylamine) on the IP and EA values in recently synthesized naphthalene bisimide derivatives, tested as promising semiconductors for flexible n-channel or ambipolar organic field effect transistors (OFETs). The ionization potentials were determined by Ultra-violet Photoelectron Spectroscopy (UPS) for thin semiconductor films evaporated in ultra-high vacuum. The values obtained by photoelectron spectroscopy were compared with the ones determined from electrochemical investigations of the semiconductors dissolved in an electrolyte solution. Using cyclic voltammetry the IPs was estimated from the onset of the first oxidation peak whereas EAs from the onset of the first reduction peak. In cases where it was not possible to record the oxidation wave in the electrolyte electrochemical window, the IPs values were calculated by subtracting the energy of the spectroscopically (UV–vis–NIR) determined band gap from the EA values and changing the sign. A good correlation between the spectroscopic (UPS) and electrochemical data was found

  2. 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

  3. Photoelectron spectroscopy: a strategy for the study of reactions at solid surfaces

    Science.gov (United States)

    Au, C. T.; Carley, A. F.; Roberts, M. W.

    The development of X-ray photoelectron spectroscopy for the study of the nature of chemisorbed species and the mechanisms of surface reactions is described. The methodology of data analysis and the establishment of data banks which enable photoelectron spectra to be assigned to specific surface species is discussed by reference to examples from recent studies. Although in the first instance the primary aim was to establish a qualitative logic in a well defined area of surface chemistry, this was then developed quantitatively and extended to studies of the mechanism of surface catalysed reactions. Emphasis is given here to the activation of molecules at metal surfaces either by surface modification or through chemical specificity which is associated with coadsorbed molecules. As illustration we discuss the activation of O-H and N-H bonds by `oxygen' resulting in reaction pathways being followed which would not have been predicted on the basis of the known reactivities of the individual molecules. The examples chosen also illustrate the severe limitations of mechanistic studies in surface chemistry based (a) on the study of the individual reactants separately; (b) on a post-mortem type of analysis of the surface and (c) on just a gaseous product analysis. An important concept that has emerged is the dual role of surface `oxygen'. It may either act as a promoter in activating an otherwise unreactive adsorbate molecule, or it may form an unreactive oxide overlayer. Parallel studies of metal oxides per se provide information on the defect nature of both oxide overlayers at metal surfaces and also bulk oxide surfaces. Close similarities are shown to exist between the `oxygen' activation of molecules at metal surfaces and the catalytic reactivity of defective bulk oxides. A common theme is that the dominant mechanism involves hydrogen abstraction by oxygen adatoms, which are assigned as O-(s) both at metal surfaces (by XPS) and at bulk oxide surfaces (by E.P.R. and XPS).

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

    International Nuclear Information System (INIS)

    Arnold, D.W.

    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 O 3 - . A characterization of these states is important to models for atmospheric ozone reaction kinetics. The fluoroformyloxyl radical, FCO 2 , 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 NNO 2 molecule. Several electronic states are observed for this species which is believed to play a role as a reactive intermediate in the N + NO 2 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 (C 2 - - C 11 - ), and van der Waals clusters (X - (CO 2 ) n , X = I, Br, Cl; n ≤ 13 and I - (N 2 O) 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 - (CO 2 )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

  5. 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.

  6. Surface composition analysis of HF vapour cleaned silicon by X-ray photoelectron spectroscopy

    Science.gov (United States)

    Ermolieff, A.; Martin, F.; Amouroux, A.; Marthon, S.; Westendorp, J. F. M.

    1991-06-01

    X-ray photoelectron spectroscopy (XPS) measurements on silicon surfaces treated by HF gaseous cleaning are described. Various cleaning recipes, which essentially differ by the amount of water present during the reaction were studied; the composition of the silicon surface was measured in terms of monolayer coverage of oxygen, fluorine and carbon. These gaseous cleaned surfaces are compared with those of commonly deglazed silicon samples by using an aqueous HF bath. The F(1s), O(1s), Si(2p), C(1s) photoelectron lines were monitored, and concentrations determined as usual by integration of the lines after removal of the non-linear backgroune. The F(1s), C(1s) and Si(2p) lines were decomposed into several components corresponding to different chemical bonds. The results show that the amount of fluorine is directly correlated with the amount of oxygen: the higher the oxygen level on the sample, the more important is the fluorine content till 0.7 ML, essentially in a O sbnd Si sbnd F bonding state. For more aggresive etching leaving less than one monolayer of oxygen, the Si sbnd F bond becomes predominant. The ratio of the SiF to OSiF concentrations is a significant signature of the deoxidation state of the surface. Hydrophobicity of the water appears in the range of 25% Si sbnd F bonds. With very aggresive etching processes, 67% Si sbnd F bonds and 33% O sbnd Si sbnd F bonds are reached and the total amount of fluoride drops below 0.3 ML. For comparison, only Si sbnd F bonds are observed after a wet etching in a dilute HF bath without a rinse with a much lower fluorine concentration. The balance between Si sbnd F and O sbnd Si sbnd F remains stable and seems to be representative of the surface states provided by the etching process.

  7. Electronic structures of U X3 (X =Al , Ga, and In) studied by photoelectron spectroscopy

    Science.gov (United States)

    Fujimori, Shin-ichi; Kobata, Masaaki; Takeda, Yukiharu; Okane, Tetsuo; Saitoh, Yuji; Fujimori, Atsushi; Yamagami, Hiroshi; Haga, Yoshinori; Yamamoto, Etsuji; Ōnuki, Yoshichika

    2017-09-01

    The electronic structures of U X3 (X =Al , Ga , and In ) were studied by photoelectron spectroscopy to understand the relationship between their electronic structures and magnetic properties. The band structures and Fermi surfaces of UAl3 and UGa3 were revealed experimentally by angle-resolved photoelectron spectroscopy (ARPES), and they were compared with the result of band-structure calculations. The topologies of the Fermi surfaces and the band structures of UAl3 and UGa3 were explained reasonably well by the calculation, although bands near the Fermi level (EF) were renormalized owing to the finite electron correlation effect. The topologies of the Fermi surfaces of UAl3 and UGa3 are very similar to each other, except for some minor differences. Such minor differences in their Fermi surface or electron correlation effect might take an essential role in their different magnetic properties. No significant changes were observed between the ARPES spectra of UGa3 in the paramagnetic and antiferromagnetic phases, suggesting that UGa3 is an itinerant weak antiferromagnet. The effect of chemical pressure on the electronic structures of U X3 compounds was also studied by utilizing the smaller lattice constants of UAl3 and UGa3 than that of UIn3. The valence band spectrum of UIn3 is accompanied by a satellitelike structure on the high-binding-energy side. The core-level spectrum of UIn3 is also qualitatively different from those of UAl3 and UGa3. These findings suggest that the U 5 f states in UIn3 are more localized than those in UAl3 and UGa3.

  8. An experimental and theoretical study of the valence shell photoelectron spectrum of tetrafluoromethane

    International Nuclear Information System (INIS)

    Holland, D.M.P.; Potts, A.W.; Trofimov, A.B.; Breidbach, J.; Schirmer, J.; Feifel, R.; Richter, T.; Godehusen, K.; Martins, M.; Tutay, A.; Yalcinkaya, M.; Al-Hada, M.; Eriksson, S.; Karlsson, L.

    2005-01-01

    The complete valence shell photoelectron spectrum of tetrafluoromethane has been recorded using synchrotron radiation and the observed structure has been interpreted using ionisation energies and relative spectral intensities computed using the third-order algebraic-diagrammatic-construction (ADC(3)) scheme for the one-particle Green's function and the outer valence Green's function (OVGF) method. The ADC(3) calculations were performed using both the original variant based on the Dyson equation and the recently proposed non-Dyson scheme. The theoretical predictions for the single-hole ionic states due to outer valence shell ionisation agree satisfactorily with the experimental results. Ionisation from the inner valence 2t 2 and 3a 1 orbitals is strongly influenced by reorganisation effects and the intensity is spread amongst numerous satellites. Highly resolved spectra have been measured for the C∼2T2 and the D∼2A1 states, and the vibrational structure has been associated primarily with excitation of the ν1+(a1) mode. However, the analyses also provide evidence for excitation of the Jahn-Teller active ν2+(e) mode in the C∼2T2 state, and the ν3+(t2) mode in the D∼2A1 state. Excitation of this latter mode can be explained in terms of vibronic coupling between the C∼2T2 and the D∼2A1 states. Photoelectron angular distributions and branching ratios have been determined and demonstrate that shape resonances affect the outer valence shell photoionisation dynamics. The experimental results are compared with previous theoretical predictions but a consistent interpretation has not been obtained. The major difficulty concerns the uncertainty in the locations of valence shell transitions into the 5a 1 and the 5t 2 virtual orbitals

  9. An experimental and theoretical study of the valence shell photoelectron spectrum of tetrafluoromethane

    Science.gov (United States)

    Holland, D. M. P.; Potts, A. W.; Trofimov, A. B.; Breidbach, J.; Schirmer, J.; Feifel, R.; Richter, T.; Godehusen, K.; Martins, M.; Tutay, A.; Yalcinkaya, M.; Al-Hada, M.; Eriksson, S.; Karlsson, L.

    2005-01-01

    The complete valence shell photoelectron spectrum of tetrafluoromethane has been recorded using synchrotron radiation and the observed structure has been interpreted using ionisation energies and relative spectral intensities computed using the third-order algebraic-diagrammatic-construction (ADC(3)) scheme for the one-particle Green's function and the outer valence Green's function (OVGF) method. The ADC(3) calculations were performed using both the original variant based on the Dyson equation and the recently proposed non-Dyson scheme. The theoretical predictions for the single-hole ionic states due to outer valence shell ionisation agree satisfactorily with the experimental results. Ionisation from the inner valence 2t 2 and 3a 1 orbitals is strongly influenced by reorganisation effects and the intensity is spread amongst numerous satellites. Highly resolved spectra have been measured for the C˜2T2 and the D˜2A1 states, and the vibrational structure has been associated primarily with excitation of the ν1+(a1) mode. However, the analyses also provide evidence for excitation of the Jahn-Teller active ν2+(e) mode in the C˜2T2 state, and the ν3+(t2) mode in the D˜2A1 state. Excitation of this latter mode can be explained in terms of vibronic coupling between the C˜2T2 and the D˜2A1 states. Photoelectron angular distributions and branching ratios have been determined and demonstrate that shape resonances affect the outer valence shell photoionisation dynamics. The experimental results are compared with previous theoretical predictions but a consistent interpretation has not been obtained. The major difficulty concerns the uncertainty in the locations of valence shell transitions into the 5a 1 and the 5t 2 virtual orbitals.

  10. UV-photoelectron spectroscopy of BN indoles: experimental and computational electronic structure analysis.

    Science.gov (United States)

    Chrostowska, Anna; Xu, Senmiao; Mazière, Audrey; Boknevitz, Katherine; Li, Bo; Abbey, Eric R; Dargelos, Alain; Graciaa, Alain; Liu, Shih-Yuan

    2014-08-20

    We present a comprehensive electronic structure analysis of two BN isosteres of indole using a combined UV-photoelectron spectroscopy (UV-PES)/computational chemistry approach. Gas-phase He I photoelectron spectra of external BN indole I and fused BN indole II have been recorded, assessed by density functional theory calculations, and compared with natural indole. The first ionization energies of these indoles are natural indole (7.9 eV), external BN indole I (7.9 eV), and fused BN indole II (8.05 eV). The computationally determined molecular dipole moments are in the order: natural indole (2.177 D) > fused BN indole II (1.512 D) > external BN indole I (0.543 D). The λmax in the UV-vis absorption spectra are in the order: fused BN indole II (292 nm) > external BN indole I (282 nm) > natural indole (270 nm). The observed relative electrophilic aromatic substitution reactivity of the investigated indoles with dimethyliminium chloride as the electrophile is as follows: fused BN indole II > natural indole > external BN indole I, and this trend correlates with the π-orbital coefficient at the 3-position. Nucleus-independent chemical shifts calculations show that the introduction of boron into an aromatic 6π-electron system leads to a reduction in aromaticity, presumably due to a stronger bond localization. Trends and conclusions from BN isosteres of simple monocyclic aromatic systems such as benzene and toluene are not necessarily translated to the bicyclic indole core. Thus, electronic structure consequences resulting from BN/CC isosterism will need to be evaluated individually from system to system.

  11. Effects of application boron on yields, yield component and oil ...

    African Journals Online (AJOL)

    STORAGESEVER

    2008-08-18

    Aug 18, 2008 ... The study was conducted to investigate the effects of five boron (B) doses; 0, 2.5, 5.0, 7.5 and 10.0 kg B ha-1 in B-deficient calcareous soils on yield and some yield components of four sunflower genotypes. Genotypes have shown variations with respect to their responses to B applications. AS-615 and ...

  12. Effects of application boron on yields, yield component and oil ...

    African Journals Online (AJOL)

    The study was conducted to investigate the effects of five boron (B) doses; 0, 2.5, 5.0, 7.5 and 10.0 kg B ha-1 in B-deficient calcareous soils on yield and some yield components of four sunflower genotypes. Genotypes have shown variations with respect to their responses to B applications. AS-615 and Coban had the ...

  13. Effect of biofertilizers on yield and yield components of cucumber

    Directory of Open Access Journals (Sweden)

    Faranak Moshabaki Isfahani

    2012-01-01

    Full Text Available Biofertilizer is defined as a substance which contains living organisms which, when applied to seed, plant surface, or soil, colonize the rhizosphere or interior of the plant and promote growth by increasing the supply or availability of primary nutrients to the host plant. Biofertilizers are well recognized as an important component of integrated plant nutrient management for sustainable agriculture and hold a great promise improve crop yield. The present study for the sake of evaluating the use of plant growth promoting rhizobacteria produced by Pseudomonas sp. and phosphate bio fertilizers produced by Pseudomonas putida strain P13 and Pantoea agglomerans strain P5 and chemical fertilizers in the separate treatments on yield and yield components of cucumber by using a factorial experiment in completely randomized block design with three repetition were performed in the field. The symbol of P represents chemical fertilizer by amount of respectively (0, 25%, 50%, 75%, 100%, B1 shows plant growth promoting rhizobacteria (PGPR and B2 indicates bio fertilizer-2. The results showed that P1B0 has the most yield, and control treatments has the least yield. P100B1 has the most length of plant and P100B0 has the least length of plant, P25B1 has the most amount of chlorophyll and P75B2 has the least chlorophyll. P75B2 has the most shoots dry weight and P100B0 has the least shoots dry weight. B1P50 has the most shoots fresh weight and P25B2 has the least shoots fresh weight. B1P50 has the most roots dry weight and P100B0 has the least roots dry weight. B1P50 has the most roots fresh weight and P25B2 has the least roots fresh weight. So the results indicate that use of biological fertilizers have caused increase yield and components yield of cucumber.

  14. 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.

  15. Anion photoelectron spectroscopy of small indium phosphide clusters (InxP-y; x,y=1--4)

    International Nuclear Information System (INIS)

    Xu, C.; de Beer, E.; Arnold, D.W.; Arnold, C.C.; Neumark, D.M.

    1994-01-01

    Small indium phosphide clusters having 2--8 atoms are studied using anion photoelectron spectroscopy of In x P - y (x,y=1--4). From these spectra, the electron affinities are determined. Both ground and low-lying excited electronic states of the neutral clusters are observed. An electronic gap is shown in the even cluster anion spectra

  16. An X-ray photoelectron spectroscopy study of the influence of hydrogen on the oxygen-silver interaction

    NARCIS (Netherlands)

    Lefferts, Leon; Van Ommen, Jan G.; Ross, Julian R H

    1987-01-01

    Hydrogen treatment of a pure silver catalyst before adsorption of oxygen influences the position and form of the O(1s) peak of the X-ray photoelectron spectra. It is possible that both the formation of sub-surface OH groups and an increase in the concentration of sub-surface oxygen, found to be of

  17. Study of the oxidation of W(110) by full-solid-angle photoelectron diffraction with chemical state and time resolution

    International Nuclear Information System (INIS)

    Ynzunza, R.X.; Tober, E.D.; Wang, Z.

    1997-01-01

    The brightness of third-generation synchrotron radiation from beamline 9.3.2 at the Advanced Light Source has been combined with the high-intensities and energy resolutions possible with its advanced photoelectron spectrometer/diffractometer experimental station in order to study the time dependence of the oxidation of the W(110) surface. This has been done via chemical-state-resolved core-level photoelectron spectroscopy and diffraction. This system has been studied previously by other methods such as LEED and STM, but several questions remain as to the basic kinetics of oxidation and the precise adsorption structures involved. By studying the decay and growth with time of various peaks in the W 4f 7/2 photoelectron spectra, it should be possible to draw quantitative conclusions concerning the reaction kinetics involved. The authors have also measured full-solid-angle photoelectron diffraction patterns for the two oxygen-induced W states, and these should permit fully defining the different structures involved in this oxidation process

  18. Ab Initio Determinations of Photoelectron Spectra Including Vibronic Features: An Upper-Level Undergraduate Physical Chemistry Laboratory

    Science.gov (United States)

    Lord, Richard L.; Davis, Lisa; Millam, Evan L.; Brown, Eric; Offerman, Chad; Wray, Paul; Green, Susan M. E.

    2008-01-01

    We present a first-principles determination of the photoelectron spectra of water and hypochlorous acid as a laboratory exercise accessible to students in an undergraduate physical chemistry course. This paper demonstrates the robustness and user-friendliness of software developed for the Franck-Condon factor calculation. While the calculator is…

  19. 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...

  20. Mn incorporation into the GaAs lattice investigated by hard x-ray photoelectron spectroscopy and diffraction

    Czech Academy of Sciences Publication Activity Database

    Bartoš, Igor; Píš, I.; Kobata, M.; Kobayashi, K.; Cukr, Miroslav; Jiříček, Petr; Sugiyama, T.; Ikenaga, E.

    2011-01-01

    Roč. 83, č. 23 (2011), 235327/1-235327/6 ISSN 1098-0121 R&D Projects: GA ČR GA202/07/0601 Grant - others:AVČR(CZ) Praemium Academiae Institutional research plan: CEZ:AV0Z10100521 Keywords : photoelectron spectroscopy * diffraction Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 3.691, year: 2011

  1. Feasibility of photoelectron sources with sharp lines of stable energy between 20 and 80 keV

    Czech Academy of Sciences Publication Activity Database

    Dragoun, Otokar; Špalek, Antonín; Kašpar, Jaromír; Bonn, J.; Kovalík, Alojz; Otten, E.W.; Vénos, Drahoslav; Weinheimer, Ch.

    2011-01-01

    Roč. 69, č. 4 (2011), s. 672-677 ISSN 0969-8043 R&D Projects: GA MŠk LC07050 Institutional research plan: CEZ:AV0Z10480505 Keywords : Photoelectron * Neutrino mass * Electron spectrometer Subject RIV: BG - Nuclear, Atomic and Molecular Physics, Colliders Impact factor: 1.172, year: 2011

  2. Photoelectron Spectroscopy and Theoretical Studies of Anion-pi Interactions: Binding Strength and Anion Specificity

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Jian; Zhou, Bin; Sun, Zhenrong; Wang, Xue B.

    2015-01-01

    Proposed in theory and confirmed to exist, anion–π interactions have been recognized as new and important non-covalent binding forces. Despite extensive theoretical studies, numerous crystal structural identifications, and a plethora of solution phase investigations, intrinsic anion–π interaction strengths that are free from complications of condensed phases’ environments, have not been directly measured in the gas phase. Herein we present a joint photoelectron spectroscopic and theoretical study on this subject, in which tetraoxacalix[2]arene[2]triazine 1, an electron-deficient and cavity self-tunable macrocyclic was used as a charge-neutral molecular host to probe its interactions with a series of anions with distinctly different shapes and charge states (spherical halides Cl⁻, Br⁻, I⁻, linear thiocyanate SCN⁻, trigonal planar nitrate NO₃⁻, pyramidic iodate IO₃⁻, and tetrahedral sulfate SO₄²⁻). The binding energies of the resultant gaseous 1:1 complexes (1•Cl⁻,1•Br⁻, 1•I⁻, 1•SCN⁻, 1•NO₃⁻, 1•IO₃⁻ and 1•SO₄²⁻) were directly measured experimentally, exhibiting substantial non-covalent interactions with pronounced anion specific effects. The binding strengths of Cl⁻, NO₃⁻, IO₃⁻ with 1 are found to be strongest among all singly charged anions, amounting to ca. 30 kcal/mol, but only about 40% of that between 1 and SO₄²⁻. Quantum chemical calculations reveal that all anions reside in the center of the cavity of 1 with anion–π binding motif in the complexes’ optimized structures, where 1 is seen to be able to self-regulate its cavity structure to accommodate anions of different geometries and three-dimensional shapes. Electron density surface and natural bond orbital charge distribution analysis further support anion–π binding formation. The calculated binding energies of the anions and 1 nicely reproduce the experimentally estimated electron binding energy increase. This work

  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. Impact of water vapour and carbon dioxide on surface composition of C{sub 3}A polymorphs studied by X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Dubina, E.; Plank, J. [Technische Universität München, Lehrstuhl für Bauchemie, Lichtenbergstr. 4, 85747 Garching bei München (Germany); Black, L., E-mail: l.black@leeds.ac.uk [Institute for Resilient Infrastructure, School of Civil Engineering, University of Leeds, Leeds LS2 9JT (United Kingdom)

    2015-07-15

    The surface specific analytical method, X-ray photoelectron spectroscopy (XPS), has been used to study the effects of water vapour and CO{sub 2} on the cubic and orthorhombic polymorphs of C{sub 3}A. Significant differences between the two polymorphs were observed in the XPS spectra. Upon exposure to water vapour, both polymorphs produced C{sub 4}AH{sub 13} on their surfaces. Additionally, the sodium-doped o-C{sub 3}A developed NaOH and traces of C{sub 3}AH{sub 6} on its surface. Subsequent carbonation yielded mono carboaluminate on both polymorphs. Large amounts of Na{sub 2}CO{sub 3} also formed on the surface of o-C{sub 3}A as a result of carbonation of NaOH. Furthermore, the extent of carbonation was much more pronounced for o-C{sub 3}A{sub o} than for c-C{sub 3}A.

  5. 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 HfO 2 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 CO 2 . 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.

  6. Time-and-state resolved spectroscopy, diffraction, and circular dichroism in core photoelectron emission from clean and oxygen-covered W(110)

    Energy Technology Data Exchange (ETDEWEB)

    Ynzunza, Ramon Xavier [Univ. of California, Berkeley, CA (United States)

    1998-10-01

    Several aspects of core-level photoelectron emission fi-om solid surfaces as excited by high-brightness variable-polarization synchrotrons radiation have been studied with a new beamline and experimental station at the Advanced Light Source in Berkeley. These include: resolution of different chemical states and site types via high-resolution photoelectron spectroscopy (PS), the use of state-resolved photoelectron difllaction (PD) to determine local atomic geometries, and the observation and analysis of circular dichroism (CD) effects in photoelectron diffraction. These methods have been applied to clean and oxygen-exposed surfaces of W(110). Full-solid-angle photoelectron diffraction from clean W(110) was measured, with the surface and bulk atoms being clearly resolved.

  7. Heterosis and combining ability for grain yield and yield component ...

    African Journals Online (AJOL)

    ... ranged from 0 to -13% indicating that the hybrids tend to be earlier in maturity than the parents. The mean squares due to GCA for days to maturity, ear diameter, member of kernels per row, 1000 kernel weight and grain yield were significant, indicating the importance of additive genetic variance in controlling these traits.

  8. Evaluation of Yield and Yield Attributes of Five Sweet Potato ...

    African Journals Online (AJOL)

    0087, and TIS 2532.OP.1.13) were evaluated for yield and agronomic performance in Imo State University Farm, Owerri. The experiment was laid out in a randomised complete block design with three replications. The planting density was 33,000 ...

  9. Inter-Relationships Between Yield And Yield Attributes Of Potato ...

    African Journals Online (AJOL)

    Temp 25oC, Mean Max Temp 31.5oC) during the rainy season of 1999 and 2000 to determine the inter-relationship between yield and some important agronomic traits in the potato grown under high ambient temperatures. The genotypes were laid out in a randomized complete block design with three replications.

  10. Correlation Analysis of some Growth, Yield, Yield Components and ...

    African Journals Online (AJOL)

    Correlation studies provide a better understanding of the association of different characters with grain yield (Dixet and Dubey, 1984). The study of associations ... of 120 kg ha-1. The date of sowing was as prescribed by the treatments. Four irrigations were applied to the crop before withholding water to allow for proper ...

  11. X-ray photoelectron spectroscopy study of the metal/cermet interface

    International Nuclear Information System (INIS)

    Lu Hua; Shen Dianhong; Xue Qikun

    2001-01-01

    Interfacial reactions between aluminium and polycrystalline cermet TiC 0.6 were investigated using x-ray photo-electron spectroscopy, Auger electron spectroscopy and x-ray diffraction. It was found that titanium exists in two chemical states. The carbide and oxide of titanium can be detected simultaneously, and the atomic ratio of Ti:C:O is 5:3:2. This suggests that TiC 0.6 is a Ti-oxycarbide or oxygenated Tic composite: Ti 5 C 3 O 2 (TiO 2 + 4TiC 0.75 ). When Al is deposited in vacuum on the Ti-oxycarbide surface, the active Al atoms react chemically only with TiO 2 at room temperature, but not with TiC 0.75 in Ti-oxycarbide. The reaction products are Al 2 O 3 and the intermetallic compound Al 3 Ti. Annealing the Al/TiC 0.6 interface at 750 degree C, Al reacts also with TiC 0.75 to form a brittle Al 4 C 3 phase

  12. 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.

  13. Simulation of photoelectric X-ray polarimetry and reconstruction of the photoelectron azimuthal angle

    International Nuclear Information System (INIS)

    Wang Shuo; Ji Jianfeng; Han Dong; Feng Hua

    2013-01-01

    Sensitive X-ray polarimetry in the keV energy range can be achieved by measuring the azimuthal angle distribution of emitted electrons after the photoelectric absorption of X-rays in a micropattern gas detector. However, the initial direction of the electron is not readily measurable due to the randomization of its motion during energy loss. By using the Geant4, Maxwell and Garfield packages, we simulated the detected electron tracks following photoelectric absorption, electron drift and diffusion in the gas, and proposed a technique capable of reconstructing the initial direction of the emitted photoelectron. The technique allows us to measure the angular modulation of flux predicted for a polarized X-ray beam. We calculated the modulation factors in 2-10 keV with a gas mixture of neon and CO 2 , and discussed how electron diffusion along the drift will dilute the track and suppress the modulation. These results are useful for the design of the X-ray polarimeter. (authors)

  14. Electronic structure of germanium selenide investigated using ultra-violet photo-electron spectroscopy

    International Nuclear Information System (INIS)

    Mishra, P; Lohani, H; Sekhar, B R; Kundu, A K; Menon, Krishnakumar S R; Patel, R; Solanki, G K

    2015-01-01

    The valence band electronic structure of GeSe single crystals has been investigated using angle resolved photoemission spectroscopy (ARPES) and x-ray photoelectron spectroscopy. The experimentally observed bands from ARPES, match qualitatively with our LDA-based band structure calculations along the Γ–Z, Γ–Y and Γ–T symmetry directions. The valence band maximum occurs nearly midway along the Γ–Z direction, at a binding energy of −0.5 eV, substantiating the indirect band gap of GeSe. Non-dispersive features associated with surface states and indirect transitions have been observed. The difference in hybridization of Se and Ge 4p orbitals leads to the variation of dispersion along the three symmetry directions. The predominance of the Se 4p z orbitals, evidenced from theoretical calculations, may be the cause for highly dispersive bands along the Γ–T direction. Detailed electronic structure analysis reveals the significance of the cation–anion 4p orbitals hybridization in the valence band dispersion of IV–VI semiconductors. This is the first comprehensive report of the electronic structure of a GeSe single crystal using ARPES in conjugation with theoretical band structure analysis. (paper)

  15. 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.

  16. X-ray photoelectron spectroscopy characterization of high dose carbon-implanted steel and titanium alloys

    Science.gov (United States)

    Viviente, J. L.; García, A.; Alonso, F.; Braceras, I.; Oñate, J. I.

    1999-04-01

    A study has been made of the depth dependence of the atomic fraction and chemical bonding states of AISI 440C martensitic stainless steel and Ti-6Al-4V alloy implanted with 75 keV C + at very high doses (above 10 18 ions cm -2), by means of X-ray photoelectron spectroscopy combined with an Ar + sputtering. A Gaussian-like carbon distribution was observed on both materials at the lowest implanted dose. More trapezoidal carbon depth-profiles were found with increasing implanted doses, and a pure carbon layer was observed only on the titanium alloy implanted at the highest dose. The implanted carbon was combined with both base metal and carbon itself to form metallic carbides and graphitic carbon. Furthermore, carbon-enriched carbides were also found by curve fitting the C 1s spectra. The titanium alloy showed a higher carbidic contribution than the steel implanted at the same C + doses. A critical carbon concentrations of about 33 at.% and 23 at.% were measured for the formation of C-C bonds in Ti-6Al-4V and steel samples, respectively. The carbon atoms were bound with metal to form carbidic compounds until these critical concentrations were reached; when this C concentration was exceeded the proportion of C-C bonds increased and resulted in the growth of carbonaceous layers.

  17. X-ray photoelectron spectroscopy studies of hard coatings formed by titanium on 304 stainless steel

    International Nuclear Information System (INIS)

    Nair, M.R.; Kothari, D.C.; Rangwala, A.A.; Lal, K.B.; Prabhawalkar, P.D.; Raole, P.M.

    1986-01-01

    Titanium ions are implanted (at 30 keV) in 304 stainless steel to a dose of 1.8x10 17 ions cm -2 using 15 μA cm -2 and 5 μA cm -2 beam current densities for specimens 2 and 3 respectively. X-ray photoelectron spectroscopy (XPS) measurements are performed at different temperatures. The microhardness of implanted and unimplanted specimens is also measured. In specimen 2 the microhardness does not increase significantly and XPS measurements give evidence of carburized surface alloy formation. At 250 0 C TiO 2 is detected on the surface and it migrates into the bulk phase above 350 0 C. In specimen 3 the XPS measurements exhibit an absence of iron owing to the radiation-induced segregation of titanium on the surface. This specimen shows an increase in microhardness. The XPS measurements reveal a layer of (TiC x -C) on the surface which is suggested to be responsible for the increase in microhardness. Upon heating, TiC x is seen to move into the bulk phase and the carbon concentration is increased. These changes occurring at higher temperatures are suggested as having an effect on the wear-resistant properties of titanium-implanted 304 stainless steel. (orig.)

  18. X-ray photoelectron spectroscopy investigation of the carburization of 310 stainless steel

    International Nuclear Information System (INIS)

    Tabet, N.; Allam, I.; Yin, R.C.

    2003-01-01

    The surface of 310 stainless steel (310SS) samples was investigated by X-ray photoelectron spectroscopy (XPS) after 500 h cyclic exposure to two carburizing atmospheres: CH 4 (2%)-H 2 (98%) at 800 deg. C, and CH 4 (10%)-H 2 (90%) at 1100 deg. C. The depth distribution of various elements in the surface region was obtained by XPS after successive cycles of argon etching. The microstructure of the alloy was observed by scanning electron microscopy (SEM) and the phases formed during the exposure were analyzed by X-ray diffraction (XRD). The results showed that the major phases that were formed within few micrometer depth during exposure at 800 deg. C include both iron and chromium carbides. (Mn, Cr) oxide was also formed as a result of the reaction with the residual oxygen of the atmosphere. A region of few microns width that was relatively depleted of chromium was formed under the surface as a result of the outwards diffusion of chromium. The exposure to the reducing atmosphere at 1100 deg. C led to the formation of various iron and chromium carbides. No oxide was formed during exposure. In all exposed samples, the surface was Cr enriched while nickel remained buried under the surface region that reacted with the atmosphere

  19. Quantum-classical calculations of X-ray photoelectron spectra of polymers—Polymethyl methacrylate revisited

    Science.gov (United States)

    Löytynoja, T.; Harczuk, I.; Jänkälä, K.; Vahtras, O.; Ågren, H.

    2017-03-01

    In this work, we apply quantum mechanics/molecular mechanics (QM/MM) approach to predict core-electron binding energies and chemical shifts of polymers, obtainable via X-ray photoelectron spectroscopy (XPS), using polymethyl methacrylate as a demonstration example. The results indicate that standard parametrizations of the quantum part (basis sets, level of correlation) and the molecular mechanics parts (decomposed charges, polarizabilities, and capping technique) are sufficient for the QM/MM model to be predictive for XPS of polymers. It is found that the polymer environment produces contributions to the XPS binding energies that are close to monotonous with the number of monomer units, totally amounting to approximately an eV decrease in binding energies. In most of the cases, the order of the shifts is maintained, and even the relative size of the differential shifts is largely preserved. The coupling of the internal core-hole relaxation to the polymer environment is found to be weak in each case, amounting only to one or two tenths of an eV. The main polymeric effect is actually well estimated already at the frozen orbital level of theory, which in turn implies a substantial computational simplification. These conclusions are best represented by the cases where the ionized monomer and its immediate surrounding are treated quantum mechanically. If the QM region includes only a single monomer, a couple of anomalies are spotted, which are referred to the QM/MM interface itself and to the neglect of a possible charge transfer.

  20. Quantum-classical calculations of X-ray photoelectron spectra of polymers-Polymethyl methacrylate revisited.

    Science.gov (United States)

    Löytynoja, T; Harczuk, I; Jänkälä, K; Vahtras, O; Ågren, H

    2017-03-28

    In this work, we apply quantum mechanics/molecular mechanics (QM/MM) approach to predict core-electron binding energies and chemical shifts of polymers, obtainable via X-ray photoelectron spectroscopy(XPS), using polymethyl methacrylate as a demonstration example. The results indicate that standard parametrizations of the quantum part (basis sets, level of correlation) and the molecular mechanics parts (decomposed charges, polarizabilities, and capping technique) are sufficient for the QM/MM model to be predictive for XPS of polymers. It is found that the polymer environment produces contributions to the XPS binding energies that are close to monotonous with the number of monomer units, totally amounting to approximately an eV decrease in binding energies. In most of the cases, the order of the shifts is maintained, and even the relative size of the differential shifts is largely preserved. The coupling of the internal core-hole relaxation to the polymer environment is found to be weak in each case, amounting only to one or two tenths of an eV. The main polymeric effect is actually well estimated already at the frozen orbital level of theory, which in turn implies a substantial computational simplification. These conclusions are best represented by the cases where the ionized monomer and its immediate surrounding are treated quantum mechanically. If the QM region includes only a single monomer, a couple of anomalies are spotted, which are referred to the QM/MM interface itself and to the neglect of a possible charge transfer.

  1. Normal emission photoelectron diffraction: a new technique for determining surface structure

    International Nuclear Information System (INIS)

    Kevan, S.D.

    1980-05-01

    One technique, photoelectron diffraction (PhD) is characterized. It has some promise in surmounting some of the problems of LEED. In PhD, the differential (angle-resolved) photoemission cross-section of a core level localized on an adsorbate atom is measured as a function of some final state parameter. The photoemission final state consists of two components, one of which propagates directly to the detector and another which scatters off the surface and then propagates to the detector. These are added coherently, and interference between the two manifests itself as cross-section oscillations which are sensitive to the local structure around the absorbing atom. We have shown that PhD deals effectively with two- and probably also three-dimensionally disordered systems. Its non-damaging and localized, atom-specific nature gives PhD a good deal of promise in dealing with molecular overlayer systems. It is concluded that while PhD will never replace LEED, it may provide useful, complementary and possibly also more accurate surface structural information

  2. Silica-supported silicotungstic acid: A study by X-ray photoelectron spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Berry, Frank J.; Derrick, Glyn R. [Department of Chemistry and Analytical Sciences, Robert Hooke Building, Open University, Walton Hall, Milton Keynes, MK7 6AA (United Kingdom); Marco, Jose F. [Instituto de Quimica -Fisica ' Rocasolano' , Consejo Superior de Investigaciones Cientificas, Serrano 119, 28006 Madrid (Spain); Mortimer, Michael [Department of Chemistry and Analytical Sciences, Robert Hooke Building, Open University, Walton Hall, Milton Keynes, MK7 6AA (United Kingdom)], E-mail: m.mortimer@open.ac.uk

    2009-04-15

    W 4f and O 1s X-ray photoelectron spectra for silicotungstic acid, H{sub 4}SiW{sub 12}O{sub 40}, in pure and silica-supported form are reported. W 4f XP spectra for the supported acid are analysed in terms of contributions from two W(VI) spin-orbit doublets arising from tungsten atoms in terminal W=O bonds some of which directly interact with the silica surface. At low loading (3.2 wt.%) significant changes in the relative contributions and binding energies of the two spin-orbit doublets are taken as evidence of a strong interaction of individual [SiW{sub 12}O{sub 40}]{sup 4-} anions with highly active sites on the silica surface. It is suggested that selective ordering of silanol groups can occur on the silica surface in order to accommodate the adsorption of individual [SiW{sub 12}O{sub 40}]{sup 4-} anions.

  3. X-ray photoelectron spectroscopy for identification of morphological defects and disorders in graphene devices

    Energy Technology Data Exchange (ETDEWEB)

    Aydogan, Pinar; Suzer, Sefik, E-mail: suzer@fen.bilkent.edu.tr [Department of Chemistry, Bilkent University, 06800 Ankara (Turkey); Polat, Emre O.; Kocabas, Coskun [Department of Physics, Bilkent University, 06800 Ankara (Turkey)

    2016-07-15

    The progress in the development of graphene devices is promising, and they are now considered as an option for the current Si-based electronics. However, the structural defects in graphene may strongly influence the local electronic and mechanical characteristics. Although there are well-established analytical characterization methods to analyze the chemical and physical parameters of this material, they remain incapable of fully understanding of the morphological disorders. In this study, x-ray photoelectron spectroscopy (XPS) with an external voltage bias across the sample is used for the characterization of morphological defects in large area of a few layers graphene in a chemically specific fashion. For the XPS measurements, an external +6 V bias applied between the two electrodes and areal analysis for three different elements, C1s, O1s, and Au4f, were performed. By monitoring the variations of the binding energy, the authors extract the voltage variations in the graphene layer which reveal information about the structural defects, cracks, impurities, and oxidation levels in graphene layer which are created purposely or not. Raman spectroscopy was also utilized to confirm some of the findings. This methodology the authors offer is simple but provides promising chemically specific electrical and morphological information.

  4. Photoelectron spectroscopy study on Li substituted NiO using PES beamline installed on Indus-1

    CERN Document Server

    Banerjee, A; Phase, D M; Dasannacharya, B A

    2003-01-01

    Photoelectron spectroscopy beamline based on a toroidal grating monochromator (TGM) is recently commissioned on Indus-1 storage ring. It has been used to carry out valence band photoemission study of Li substituted NiO. In this paper initially a brief description of the beamline components and the experimental station for angle integrated photoemission experiment is presented. The later part of this paper is devoted to studies carried out on Li sub x Ni sub 1 sub - sub x O with x=0.0, 0.35 and 0.5 samples. Thin pellets of polycrystalline samples were used for the measurements reported here. Valence band spectra recorded on polycrystalline Li sub x Ni sub 1 sub - sub x O samples show drastic changes in various features as compared to that of pure NiO. The prominent changes are: (i) change in the relative contributions of Ni-3d and O-2p emissions, (ii) change in the peak position of Ni-3d from the top of the valance band of NiO and (iii) no noticeable change in the Ni satellite peak. These results are evaluated...

  5. Wettability of Oil-Producing Reservoir Rocks as Determined from X-ray Photoelectron Spectroscopy

    Science.gov (United States)

    Toledo; Araujo; Leon

    1996-11-10

    Wettability has a dominant effect in oil recovery by waterflooding and in many other processes of industrial and environmental interest. Recently, the suggestion has been made that surface science analytical techniques (SSAT) could be used to rapidly determine the wettability of reservoir materials. Here, we bring the capability of X-ray photoelectron spectroscopy (XPS) to bear on the wettability evaluation of producing reservoir rocks. For a suite of freshly exposed fracture surfaces of rocks we investigate the relationship between wettability and surface composition as determined from XPS. The classical wettability index as measured with the Amott-Harvey test is used here as an indicator of the wettability of natural sandstones. The XPS spectra of oil-wet surfaces of rocks reveal the existence of organic carbon and also of an "organic" silicon species, of the kind Si-CH relevant to silanes, having a well-defined binding energy which differs from that of the Si-O species of mineral grains. We provide quantifiable evidence that chemisorbed organic material on the pore surfaces defines the oil-wetting character of various reservoir sandstones studied here which on a mineralogic basis are expected to be water-wet. This view is supported by a strong correlation between C content of pore surfaces and rock wettability. The results also suggest a correlation between organic silicon content on the pore surfaces and rock hydrophobicity.

  6. 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.)

  7. Surface characterization of IM7/5260 composites by x-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Ohno, Satomi; Lee, Moon-Hwan; Lin, Kuen Y.; Ohuchi, Fumio S.

    2001-01-01

    Surfaces of high-performance carbon fiber/bismeleimide (BMI) composites (IM7/5260) have been characterized by x-ray photoelectron spectroscopy. An experimental technique to separately examine the chemical natures of the carbon fibers and BMI resin in the composite form was developed. This technique uses a flood gun to establish differential charging conditions on the BMI resin. The binding energies from the BMI resin were shifted by an amount of voltage applied to the flood gun, whereas those from the carbon fibers were uniquely determined due to their electrically conducting nature. By adding external bias voltage to the sample, the binding energies for conducting fibers were further shifted from those of the BMI resin, thereby separating the IM7 phase completely from the BMI phase in the binding energy scale, allowing independent measurement of the chemical changes associated with those peaks. Using this technique, the effects of thermal aging and surface plasma treatment on the IM7/5260 composite were studied

  8. X-ray photoelectron spectroscopy for characterization of bionanocomposite functional materials for energy-harvesting technologies.

    Science.gov (United States)

    Artyushkova, Kateryna; Atanassov, Plamen

    2013-07-22

    The analysis of hybrid multicomponent bioorganic and bioinorganic composite materials related to energy technologies by using X-ray photoelectron spectroscopy is discussed. The approaches and considerations of overcoming the difficulties of analyzing hybrid multicomponent materials are demonstrated for different types of materials used in bioenzyme fuel cells, that is, enzyme immobilization in a hybrid inorganic-organic matrix, analysis of peptide binding and structure in the mediation of silica nanoparticle formation, analysis of enzyme-polymeric multilayered architectures obtained through layer-by-layer assembly, and study of the mechanism of electropolymerization. Thorough optimization of experimental design through analysis of an adequate set of reference materials, relevant timescales of sample preparation and X-ray exposure, careful peak decomposition and cross-correlation between elemental speciation, results in a detailed understanding of the chemistry of nanocomposite constituents and interactions between them. The methodology presented and examples discussed are of significant importance to the scientific and engineering communities focused on the immobilization of enzymes, proteins, peptides, and other large biological molecules on solid substrates. Copyright © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  9. Lab-based ambient pressure X-ray photoelectron spectroscopy from past to present

    Science.gov (United States)

    Arble, Chris; Jia, Meng; Newberg, John T.

    2018-05-01

    Chemical interactions which occur at a heterogeneous interface between a gas and substrate are critical in many technological and natural processes. Ambient pressure X-ray photoelectron spectroscopy (AP-XPS) is a powerful spectroscopy tool that is inherently surface sensitive, elemental and chemical specific, with the ability to probe sample surfaces in the presence of a gas phase. In this review, we discuss the evolution of lab-based AP-XPS instruments, from the first development by Siegbahn and coworkers up through modern day systems. A comprehensive overview is given of heterogeneous experiments investigated to date via lab-based AP-XPS along with the different instrumental metrics that affect the quality of sample probing. We conclude with a discussion of future directions for lab-based AP-XPS, highlighting the efficacy for this in-demand instrument to continue to expand in its ability to significantly advance our understanding of surface chemical processes under in situ conditions in a technologically multidisciplinary setting.

  10. Solid solutions of uranium and thorium phosphates: synthesis, characterization and X-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Dacheux, N.; Brandel, V.; Genet, M.; Bak, K.; Berthier, C.

    1996-01-01

    New solid solutions of uranium-thorium phosphates based on uranium-uranyl phosphate U(U O 2 )(P O 4 ) 2 and thorium phosphate-diphosphate Th 4 (P O 4 ) 4 (P 2 O 7 ) were synthesized in air or under an inert atmosphere via dry and wet chemical processes. The products were characterized by means of chemical analysis, X-ray diffraction and ultraviolet-visible and infrared absorption spectroscopies. Solid solutions of uranium-uranyl-thorium phosphates U 1-x Th x (U O 2 )(P O 4 ) 2 (with O≤ x ≤ 0.6) were obtained in air by substitution of uranium (IV) by thorium. Solid solutions of thorium-uranium phosphate-diphosphate (Th 1-y U y ) 4 (P O 4 ) 4 (P 2 O 7 ) (with Y ≤0.9) were prepared by substitution of thorium by uranium (IV) under an inert atmosphere. These new materials have been studied by XPS (X-ray photoelectron spectroscopy) in order to verify the oxidation states of uranium and to estimate the P/U, P/Th, P/O and U/Th ratios. (authors). 33 refs., 10 figs., 4 tabs

  11. 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.

  12. Lanthanum, cerium, praseodymium, and neodymium metals and their interaction with oxygen studied by photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Platau, A.

    1982-01-01

    Clean films of La, Ce, Pr, and Nd, prepared by in situ evaporation have been investigated by photoelectron spectroscopy. Different light sources He I (hv = 21.2 eV), He II (hv = 40.8 eV) and Mg Kα (hv = 1253.6 eV) have been used for the electron excitation in order to characterize the metals. Measurements have been performed after exposing the clean metals to various amounts of oxygen. From the vanishing of the emission from the sd conduction band upon exposure the conclusion is drawn that an oxide layer thicker than the probing depth (20 A) is formed on all four metals and that the oxide (at room temperature) has the form: Me 2 O 3 , Me=La, Ce, Pr, Nd. The tetravalent cerium oxide is obtained when the film is heated to about 600 0 C during oxygen exposure. The interaction with oxygen is also characterized by recording the oxygen 1s level and some metal core levels (Me 3d, 4d and 4p). The results from the pure metals and from the metal oxides give further experimental evidence for a 4f level binding energy of 1.9 eV in γ-cerium. (Auth.)

  13. 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.

  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. 5 years of ambient pressure photoelectron spectroscopy (APPES) at the Swiss Light Source (SLS)

    Energy Technology Data Exchange (ETDEWEB)

    Olivieri, Giorgia [Laboratory for Surface Science and Technology, Department of Materials, ETH Zürich, CH-8093, Zurich (Switzerland); Giorgi, Javier B. [Department of Chemistry and Biomolecular Sciences, and Centre for Catalysis Research and Innovation, University of Ottawa, Ottawa, Ontario, K1N 6N5 (Canada); Green, Richard G. [Measurement Science and Standards, National Research Council Canada, Ottawa, Ontario K1A 0R6 (Canada); Brown, Matthew A., E-mail: matthew.brown@mat.ethz.ch [Laboratory for Surface Science and Technology, Department of Materials, ETH Zürich, CH-8093, Zurich (Switzerland)

    2017-04-15

    Highlights: • A review of the ongoing research using the APPES endstation of the Swiss Light Source is presented. • Research interests include the liquid-vapor, liquid-nanoparticle and vapor-solid interfaces. • An outlook to the next five years of research at the Swiss Light Source is presented. - Abstract: In March of 2012 an endstation dedicated to ambient pressure photoelectron spectroscopy (APPES) was installed at the Swiss Light Source (SLS) synchrotron radiation facility on the campus of the Paul Scherrer Institute (PSI). The endstation is mobile and operated at the vacuum ultraviolet (VUV), Surfaces/Interfaces: Microscopy (SIM) and Phoenix beamlines, which together afford a nearly continuous photon energy range from 5−8000 eV. This broad energy range is by far the widest available to a single currently operational APPES endstation. During its first five years of operation this endstation has been used to address challenging fundamental problems in the areas of soft-matter colloidal nanoscience, environmental science and energy storage—research that encompasses the liquid-nanoparticle, liquid-vapor (or vacuum) and solid-vapor interfaces. Here we present select highlights of these results and offer an outlook to the next five years of APPES research at the SLS.

  16. 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.

  17. Multivariate statistical analysis for x-ray photoelectron spectroscopy spectral imaging: Effect of image acquisition time

    International Nuclear Information System (INIS)

    Peebles, D.E.; Ohlhausen, J.A.; Kotula, P.G.; Hutton, S.; Blomfield, C.

    2004-01-01

    The acquisition of spectral images for x-ray photoelectron spectroscopy (XPS) is a relatively new approach, although it has been used with other analytical spectroscopy tools for some time. This technique provides full spectral information at every pixel of an image, in order to provide a complete chemical mapping of the imaged surface area. Multivariate statistical analysis techniques applied to the spectral image data allow the determination of chemical component species, and their distribution and concentrations, with minimal data acquisition and processing times. Some of these statistical techniques have proven to be very robust and efficient methods for deriving physically realistic chemical components without input by the user other than the spectral matrix itself. The benefits of multivariate analysis of the spectral image data include significantly improved signal to noise, improved image contrast and intensity uniformity, and improved spatial resolution - which are achieved due to the effective statistical aggregation of the large number of often noisy data points in the image. This work demonstrates the improvements in chemical component determination and contrast, signal-to-noise level, and spatial resolution that can be obtained by the application of multivariate statistical analysis to XPS spectral images

  18. Adsorbate induced surface alloy formation investigated by near ambient pressure X-ray photoelectron spectroscopy

    DEFF Research Database (Denmark)

    Nierhoff, Anders Ulrik Fregerslev; Conradsen, Christian Nagstrup; McCarthy, David Norman

    2014-01-01

    Formation of meta-stable surface-alloys can be used as a way to tune the binding strength of reaction intermediates and could therefore be used as improved catalyst materials for heterogeneous catalysis. Understanding the role of adsorbates on such alloy surfaces can provide new insights for engi...... and bulk Pt contributions. The study provides direct evidence on how it is possible to monitor the surface structure under near operation conditions. © 2014 Elsevier B.V. All rights reserved.......Formation of meta-stable surface-alloys can be used as a way to tune the binding strength of reaction intermediates and could therefore be used as improved catalyst materials for heterogeneous catalysis. Understanding the role of adsorbates on such alloy surfaces can provide new insights...... for engineering of more active or selective catalyst materials. Dynamical surface changes on alloy surfaces due to the adsorption of reactants in high gas pressures are challenging to investigate using standard characterization tools. Here we apply synchrotron illuminated near ambient pressure X-ray photoelectron...

  19. Photoelectron spectroscopy studies of mixed-valence states of Sm overlayers on transition-metal surfaces

    International Nuclear Information System (INIS)

    Tao Lian.

    1990-01-01

    To investigate and understand how the mixed-valent state of rare earths (RE) is formed and affected by their interactions with transition metals (TM), synchrotron-radiation-excited photoelectron spectroscopy was used to systematically study valence states of Sm overlayers on three TM surfaces as functions of Sm coverages. On polycrystalline Ta, Sm always has a mixed-valent state, consisting of the trivalent state and the divalent state. At a coverage of 0.02 monolayer, Sm has an average valence of 2.24. As the coverage increases, the Sm 3+ and Sm 2+ components increase at different rates. Sm on polycrystalline Cu behaves quite differently. At coverages below one monolayer, all the Sm ions adopt the trivalent state. When the coverage exceeds one monolayer, Sm 2+ ions appear, with a resulting average valence of 2.52. After that the average valence does not change significantly. On a Cu(110) single crystal surface, the situation is found to closely resemble that observed on polycrystalline Cu. These results indicate that the Sm-Ta interaction is weak compared to the Sm-Sm interaction, while the Sm-Cu interaction is stronger and affects the electronic structure

  20. Investigation of buried metal-organic interface with photoelectron spectroscopy (PES)

    Energy Technology Data Exchange (ETDEWEB)

    Vrdoljak, Pavo; Schoell, Achim; Reinert, Friedrich [Universitaet Wuerzburg, Experimentelle Physik II, 97074 Wuerzburg (Germany); Umbach, Eberhard [Forschungszentrum Karlsruhe, 76021 Karlsruhe (Germany)

    2008-07-01

    Metal-organic interfaces are of crucial importance for electronic devices since they influence the layer morphology, the electronic structure at contacts, and the charge carrier transport. Various investigations have addressed this issue from the viewpoint of surface science, applying model systems with thin organic films on flat (single crystalline or amorphous) metal substrates. The contacts in electronic devices, however, can be very different. This is mainly due to the morphological roughness of the interface in case of a metal top contact deposited on an organic layer and the possible influence on the electronic structure. In case of real contacts also interdiffusion has to be taken into account. However, surface sensitive techniques such as photoelectron spectroscopy (PES) and atomic force microscopy (AFM) can not immediately access the buried interface. To tackle this problem we have applied and optimised a lift-off technique which allows the removal of the metal top-contact in the UHV and analyse the interface between the contact and the organic film. We present first PES and AFM results of Au contacts deposited on PTCDA layers.

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

    Science.gov (United States)

    Huang, Yunguang; Li, Jinxu; Tang, Bin; Zhu, Liping; Hou, Keyong; Li, Haiyang

    2015-01-01

    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. PMID:26587023

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

    International Nuclear Information System (INIS)

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

    2004-01-01

    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

  3. Surface analysis of dental amalgams by X-ray photoelectron spectroscopy and X-ray diffraction.

    Science.gov (United States)

    Uo, Motohiro; Berglund, Anders; Cardenas, Juan; Pohl, Lars; Watari, Fumio; Bergman, Maud; Sjöberg, Staffan

    2003-11-01

    It is important to characterize the surface of dental amalgam in order to understand the process of mercury release from amalgam restorations in the oral cavity. The mercury evaporation occurs not only from the newly made restoration but also from the set material. The surfaces of four different types of amalgams, which had been well set, were analyzed with X-ray photoelectron spectroscopy (XPS) and X-ray diffraction (XRD) and the relationship between surface compositions and mercury release was studied. Fresh amalgam surfaces as well as aged surfaces, which were stored for 30 days in air, were investigated using XPS and the chemical states of amalgam components and oxygen were studied. The aged surfaces were also characterized with XRD and grazing angle XRD. With increased oxidation, the surface contents of tin and oxygen were increased in all amalgams. In contrast, the surface contents of copper and mercury were decreased. An increase of zinc or indium content were observed in zinc or indium containing amalgams, respectively. A surface layer enriched with indium and oxygen was clearly detected by XPS but not with grazing angle XRD. The thickness of the enriched surface layer is estimated to be in the order of few nanometer, which is approximately equal to the analysis depth of XPS. In addition, the presence of metallic elements, like tin and zinc, that readily form a stable oxide layer at the surface suppress the release of mercury.

  4. 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.

  5. Understanding the Impact of Film Disorder and Local Surface Potential in Ultraviolet Photoelectron Spectroscopy of PEDOT.

    Science.gov (United States)

    Muñoz, William A; Crispin, Xavier; Fahlman, Mats; Zozoulenko, Igor V

    2018-02-01

    The spectra of conducting polymers obtained using ultraviolet photoelectron spectroscopy (UPS) exhibit a typical broadening of the tail σ UPS ≈ 1 eV, which by an order of magnitude exceeds a commonly accepted value of the broadening of the tail of the density of states σ DOS ≈ 0.1 eV obtained using transport measurements. In this work, an origin of this anomalous broadening of the tail of the UPS spectra in a doped conducting polymer, PEDOT (poly(3,4-ethylenedioxythiophene)), is discussed. Based on the semiempirical approach and using a realistic morphological model, the density of valence states in PEDOT doped with molecular counterions is computed. It is shown that due to a disordered character of the material with randomly distributed counterions, the localized charge carriers in PEDOT crystallites experience spatially varying electrostatic potential. This leads to spatially varying local vacuum levels and binding energies. Taking this variation into account the UPS spectrum is obtained with the broadening of the tail comparable to the experimentally observed one. The results imply that the observed broadening of the tail of the UPS spectra in PEDOT provides information about a disordered spatially varying potential in the material rather than the broadening of the DOS itself. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  6. Ultrathin copper aluminum and nickel aluminide protective oxidation studied with an x-ray photoelectron spectrometer

    Science.gov (United States)

    Moore, J. F.; McCann, M. P.; Pellin, M. J.; Zinovev, A.; Hryn, J. N.

    2003-09-01

    Oxidation in a regime where diffusion is rapid and pressures are low is addressed. Kinetic effects under these conditions are minimized and a protective oxide film of near-equilibrium composition that is a few nanometers thick may form. Ultrathin oxides have great potential for addressing the corrosion resistance of metals, since they do not always suffer stress-induced cracking upon thermal cycling, and can be reformed under high temperature, oxidizing environments. Ultrathin oxide films are also preferable to those on a thick oxide scale for electrochemical applications due to their electrical properties. To study the growth of these oxide films, we have developed a high signal x-ray photoelectron spectrometer. The instrument can measure the near-surface composition during growth under oxygen partial pressures of up to 10-5 mbar and surface temperatures up to 1300 K. Under these conditions, films grow to a level of 3 nm in 1 h. Experiments with Cu-Al alloys show rapid segregation of Al upon oxygen exposure at 875 K, whereas exposures at lower temperatures result in a mixed oxide. With a Ni-Al intermetallic, higher temperatures were needed to preferentially segregate Al. Thermal cycling followed by exposure to chlorine in the same instrument is used as a measure of the degree of corrosion resistance of the oxides in question.

  7. 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.

  8. Atmospheric pressure X-ray photoelectron spectroscopy apparatus: Bridging the pressure gap

    Energy Technology Data Exchange (ETDEWEB)

    Velasco-Vélez, J. J., E-mail: velasco@fhi-berlin.mpg.de, E-mail: mh@fhi-berlin.mpg.de; Schlögl, R. [Department of Heterogeneous Reactions, Max Planck Institute for Chemical Energy Conversion, Mülheim an der Ruhr 45470 (Germany); Department of Inorganic Chemistry, Fritz-Haber-Institut der Max-Planck-Gesellschaft, Berlin 14195 (Germany); Pfeifer, V.; Algara-Siller, G.; Stotz, E.; Teschner, D.; Kube, P.; Knop-Gericke, A. [Department of Inorganic Chemistry, Fritz-Haber-Institut der Max-Planck-Gesellschaft, Berlin 14195 (Germany); Hävecker, M., E-mail: velasco@fhi-berlin.mpg.de, E-mail: mh@fhi-berlin.mpg.de; Skorupska, K. [Department of Heterogeneous Reactions, Max Planck Institute for Chemical Energy Conversion, Mülheim an der Ruhr 45470 (Germany); Wang, R.; Braeuninger-Weimer, P.; Hofmann, S. [Engineering Department, University of Cambridge, Cambridge CB3 0FA (United Kingdom); Centeno, A.; Zurutuza, A. [Graphenea, San Sebastian 20018 (Spain)

    2016-05-15

    One of the main goals in catalysis is the characterization of solid/gas interfaces in a reaction environment. The electronic structure and chemical composition of surfaces become heavily influenced by the surrounding environment. However, the lack of surface sensitive techniques that are able to monitor these modifications under high pressure conditions hinders the understanding of such processes. This limitation is known throughout the community as the “pressure gap.” We have developed a novel experimental setup that provides chemical information on a molecular level under atmospheric pressure and in presence of reactive gases and at elevated temperatures. This approach is based on separating the vacuum environment from the high-pressure environment by a silicon nitride grid—that contains an array of micrometer-sized holes—coated with a bilayer of graphene. Using this configuration, we have investigated the local electronic structure of catalysts by means of photoelectron spectroscopy and in presence of gases at 1 atm. The reaction products were monitored online by mass spectrometry and gas chromatography. The successful operation of this setup was demonstrated with three different examples: the oxidation/reduction reaction of iridium (noble metal) and copper (transition metal) nanoparticles and with the hydrogenation of propyne on Pd black catalyst (powder).

  9. Application of X-ray photoelectron spectroscopic analysis to protein adsorption on materials relevant to biomanufacturing.

    Science.gov (United States)

    Zangmeister, Rebecca A

    2012-04-01

    X-ray photoelectron spectroscopy (XPS) has been used to analyze the adsorption of a therapeutic monoclonal antibody (mAb), rituximab, and polyclonal human IgG (hIgG) on materials relevant to biomanufacturing of protein drug products. Details of the methods used to obtain qualitative confirmation of protein adsorption, using both the nitrogen (N 1s) signal originating from mAb proteins and an iodine heteroatom label, are presented. Both rituximab and hIgG were found to adsorb to a glass vial surface, vial rubber cap liner, syringe plunger tip, cell culture flask, serological pipette, and microcentrifuge tube. There was no evidence of protein adsorption on samples of polyvinylchloride (PVC) tubing or the barrel of a syringe. Differences in XPS heteroatom peak intensities, based on whether the heteroatom label was added to the protein prior to surface adsorption or after, suggest that adsorbed rituximab on a glass vial surface is in a structural conformation that allows extensive heteroatom labeling. Using a simple uniform overlayer model, the coverage of rituximab on a glass vial surface was determined by XPS to be 3.6 mg/m(2) , a value consistent with that expected for a theoretical monolayer. Copyright © 2012 Wiley Periodicals, Inc.

  10. Multielectron effects in the photoelectron momentum distribution of noble-gas atoms driven by visible-to-infrared-frequency laser pulses: A time-dependent density-functional-theory approach

    Science.gov (United States)

    Murakami, Mitsuko; Zhang, G. P.; Chu, Shih-I.

    2017-05-01

    We present the photoelectron momentum distributions (PMDs) of helium, neon, and argon atoms driven by a linearly polarized, visible (527-nm) or near-infrared (800-nm) laser pulse (20 optical cycles in duration) based on the time-dependent density-functional theory (TDDFT) under the local-density approximation with a self-interaction correction. A set of time-dependent Kohn-Sham equations for all electrons in an atom is numerically solved using the generalized pseudospectral method. An effect of the electron-electron interaction driven by a visible laser field is not recognizable in the helium and neon PMDs except for a reduction of the overall photoelectron yield, but there is a clear difference between the PMDs of an argon atom calculated with the frozen-core approximation and TDDFT, indicating an interference of its M -shell wave functions during the ionization. Furthermore, we find that the PMDs of degenerate p states are well separated in intensity when driven by a near-infrared laser field, so that the single-active-electron approximation can be adopted safely.

  11. Electronic and Structural Evolution of Monoiron Sulfur Clusters, FeSn- and FeSn (n=1-6), from Anion Photoelectron Spectroscopy

    International Nuclear Information System (INIS)

    Zhai, Hua-Jin; Kiran, Boggavarapu; Wang, Lai-Sheng

    2003-01-01

    We report a photoelectron spectroscopic investigation of a series of monoiron-sulfur clusters FeSn- (n= 1-6) at various photon energies. Vibrationally resolved spectra were measured for FeS- and FeS3-. A wealth of electronic structure information was obtained for FeS and were tentatively assigned, yielding a (5)Delta ground state for FeS and a (7)Sigma(+) and a (5)Delta excited state at 0.675 and 1.106 eV above the ground state, respectively. Franck-Condon factor simulations were performed for the vibrationally resolved (5)Delta ground state and the (5)Delta excited state, yielding an Fe-S bond length of 2.18 and 2.29 Angstrom for the anion ground state and the (5)Delta excited state, respectively, as well as a vibrational temperature of 180 K for the anion. The electron affinities (EA's) of FeSn were measured to be 1.725 ± 0.10, 3.222 ± 0.009, 2.898 ± 0.008, 3.129 ± 0.008, 3.262 ± 0.010, and 3.52 ± 0.02 eV for n= 1-6, respectively. A significant EA increase was only observed from FeS to FeS2, whereas all larger species FeSn (n= 3-6) possess EA's similar to that of FeS2 within ± 0.3 eV. By comparing the trend of EA in FeSn to that of FeOn, we proposed that all the FeSn- (n > 1) species take (S-m(2-))Fe3+(S-n-m(2-)) type structures, in which Fe assumes its favorite+3 formal oxidation state. Preliminary density functional calculations were carried out and the obtained structures support the proposed structural evolution of the FeSn clusters

  12. COMPARATIVE YIELD AND CHARACTERIZATION OF ...

    African Journals Online (AJOL)

    userpc

    ABSTRACT. Flavonoids represent a wide spread group of water soluble phenolic derivatives, known for their medicinal effect. This paper is focused on identifying the functional groups present in flavonoids of Blighia sapida stem bark and root sample. The percentage yield was higher with methanol extract of the stem bark ...

  13. GENETIC ANALYSIS OF YIELD AND YIELD COMPONENTS IN ...

    African Journals Online (AJOL)

    ACSS

    2017-11-16

    Nov 16, 2017 ... used different genotypes and the environmental conditions under which their ... and Jinks (1971):. Y = m + aa + βd + a2aa + 2aβad +β2dd … .... /plant, 100-grain weight per plant and Grain yield per plant (g) of six generations in IET6279 X IR70445-146-3-. 3 cross. Traits. Generation. Mean. Standard. Range.

  14. Potato yield and yield structure depending on irrigation

    Directory of Open Access Journals (Sweden)

    Milić Stanko

    2010-01-01

    Full Text Available In the agroclimatic conditions of the Vojvodina Province, the application of an economic water regime and modern technology is necessary for stable and intensive potato production. A two-year experiment on calcareous chernozem was carried out to determine how irrigation and different pre-irrigation soil moisture affect potato yield and distribution of tuber fraction in the potato yield. The block-design trial had four replicates and was adapted for sprinkler irrigation conditions. It included four treatments: irrigation with pre-irrigation moisture levels of 60 % of field water capacity (FC, irrigation with pre-irrigation moisture levels of 70 % (FC, irrigation with pre-irrigation moisture levels of 80% (FC, and a non-irrigated control treatment. Irrigation significantly increased the yield of potato, which increased from 37.27 % to 75.86 %. Under irrigation, the percentage of small fractions decreased in favour of the 55 mm one, or fractions above the 45-55 mm range. On average, irrigated treatments produced significantly more tubers than the conditions of natural water supply. .

  15. Transient and steady state photoelectronic analysis in TlInSe{sub 2} crystals

    Energy Technology Data Exchange (ETDEWEB)

    Qasrawi, A.F., E-mail: aqasrawi@atilim.edu.tr [Group of Physics, Faculty of Engineering, Atilim University, 06836 Ankara (Turkey); Department of Physics, Arab-American University, Jenin, West Bank, Palestine (Country Unknown); Gasanly, N.M. [Department of Physics, Middle East Technical University, 06531 Ankara (Turkey)

    2011-08-15

    Highlights: {yields} The steady state and time dependent photoconductivity kinetics of the TlInSe{sub 2} crystals are investigated in the temperature region of 100-350 K. {yields} The photocurrent of the sample exhibited linear, sublinear, and supralinear recombination mechanisms, at, above and below 160 K, respectively. {yields} Steady state photoconductivity revealed two recombination centres located at 234 and 94 meV. {yields} The transient photoconductivity is limited by a trapping center located at 173 meV. {yields} The capture coefficient of the trap for holes was determined as 3.11 x 10{sup -22} cm{sup -2}. -- Abstract: The temperature and illumination effects on the transient and steady state photoconductivities of TlInSe{sub 2} crystals have been studied. Namely, two recombination centres located at 234 and at 94 meV and one trap center located at 173 meV were determined from the temperature-dependent steady state and transient photoconductivities, respectively. The illumination dependence of photoconductivity indicated the domination of sublinear and supralinear recombination mechanisms above and below 160 K, respectively. The change in the recombination mechanism is attributed to the exchange of roles between the linear recombination at the surface and trapping centres in the crystal, which become dominant as temperature decreases. The transient photoconductivity measurement allowed the determination of the capture coefficient of traps for holes as 3.11 x 10{sup -22} cm{sup -2}.

  16. Beam emittance and the effects of the rf, space charge and wake fields: Application to the ATF photoelectron beam

    International Nuclear Information System (INIS)

    Parsa, Z.

    1991-01-01

    Laser driven photoelectron guns are of interest for use in new methods of accelerations, future development of Linear Colliders and new experiments such as Free Electron laser (IFEL). Such guns are potential source of low emittance-high current and short bunch length electron beams, where the emitted electrons are accelerated quickly to a relativistic energy by a strong rf, electric field in the cavity. We present a brief overview of the beam dynamic studies, e.g. emittance for the Brookhaven National Laboratory (BNL) ATF high brightness photocathode radio frequency gun (now in operation), and show the effects of the rf, Space Charge, and Wake fields on the photoelectrons. 4 refs., 7 figs

  17. Wavelength dependent photoelectron circular dichroism of limonene studied by femtosecond multiphoton laser ionization and electron-ion coincidence imaging

    Science.gov (United States)

    Rafiee Fanood, Mohammad M.; Janssen, Maurice H. M.; Powis, Ivan

    2016-09-01

    Enantiomers of the monoterpene limonene have been investigated by (2 + 1) resonance enhanced multiphoton ionization and photoelectron circular dichroism employing tuneable, circularly polarized femtosecond laser pulses. Electron imaging detection provides 3D momentum measurement while electron-ion coincidence detection can be used to mass-tag individual electrons. Additional filtering, by accepting only parent ion tagged electrons, can be then used to provide discrimination against higher energy dissociative ionization mechanisms where more than three photons are absorbed to better delineate the two photon resonant, one photon ionization pathway. The promotion of different vibrational levels and, tentatively, different electronic ion core configurations in the intermediate Rydberg states can be achieved with different laser excitation wavelengths (420 nm, 412 nm, and 392 nm), in turn producing different state distributions in the resulting cations. Strong chiral asymmetries in the lab frame photoelectron angular distributions are quantified, and a comparison made with a single photon (synchrotron radiation) measurement at an equivalent photon energy.

  18. An Efficient Analytic Approach for Calculation of Multi-Dimensional Franck-Condon Factors and Associated Photoelectron Spectra.

    Science.gov (United States)

    Sattasathuchana, Tosaporn; Murri, Riccardo; Baldridge, Kim K

    2017-05-09

    The implementation, optimization, and performance of a generalized analytic treatment of multidimensional Franck-Condon Factors (FCF) within the harmonic oscillator approximation and associated photoelectron spectra (PES) for N-dimensional systems, including consideration of Eckart conditions in the displacement minimization and Cartesian coordinate handedness for evaluation of the Duschinsky Effect, is carried out in this work. A new efficient strategy for algorithmic efficiency for high dimensional systems is introduced, and demonstrated for 3-, 15-, and 30-dimensional systems. Determination of the photoelectron spectra for H 2 O + (B̃ 2 B 2 ), vinyl alcohol, and C 6 H 6 + (X̃ 2 E 1g ) validates the capabilities with a high degree of accuracy with respect to experiment.

  19. 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.

  20. Experiment study on the thick GEM-like multiplier for X-ray photoelectrons energy deposition gaining

    International Nuclear Information System (INIS)

    Zhu Pengfei; Ye Yan; Long Yan; Cao Ningxiang; Jia Xing; Li Jianfeng

    2009-01-01

    The GEM is a novel detector with high gain,high time and location resolution. Imitating the structure of the GEM, a thick GEM-like multiplier which has the similar function with that of the GEM is designed and manufactured. The characteristics of the thick GEM-like multiplier increasing electron energy deposition in absorbing medium has been experimentally studied. The results indicate that the energy deposition gain of x-ray photoelectron in medium is apparent, and the maximum energy deposition can increase by more than 40%. Some suggestions of further increasing the energy deposition are given, and the future application of the way of increasing the x-ray photoelectron energy deposition by the thick GEM-like multiplier in hard x-ray imaging is prospected. (authors)

  1. Summary: Update to ASTM guide E 1523 to charge control and charge referencing techniques in x-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Baer, D.R.

    2005-01-01

    An updated version of the American Society for Testing and Materials (ASTM) guide E 1523 to the methods to charge control and charge referencing techniques in x-ray photoelectron spectroscopy has been released by ASTM [Annual Book of ASTM Standards Surface Analysis (American Society for Testing and Materials, West Conshohocken, PA, 2004), Vol. 03.06]. The guide is meant to acquaint x-ray photoelectron spectroscopy (XPS) users with the various charge control and charge referencing techniques that are and have been used in the acquisition and interpretation of XPS data from surfaces of insulating specimens. The current guide has been expanded to include new references as well as recommendations for reporting information on charge control and charge referencing. The previous version of the document had been published in 1997 [D. R. Baer and K. D. Bomben, J. Vac. Sci. Technol. A 16, 754 (1998)

  2. Non-dipole effects in spin polarization of photoelectrons from 3d electrons of Xe, Cs and Ba

    Energy Technology Data Exchange (ETDEWEB)

    Amusia, M Ya [Racah Institute of Physics, Hebrew University, Jerusalem 91904 (Israel); Cherepkov, N A [State University of Aerospace Instrumentation, St. Petersburg 190000 (Russian Federation); Chernysheva, L V [A F Ioffe Physical-Technical Institute, St. Petersburg 194021 (Russian Federation); Felfli, Z [Department of Physics and Center for Theoretical Studies of Physical Systems, Clark Atlanta University, Atlanta GA 30314 (United States); Msezane, A Z [Department of Physics and Center for Theoretical Studies of Physical Systems, Clark Atlanta University, Atlanta GA 30314 (United States)

    2005-04-28

    The non-dipole contribution to spin polarization of photoelectrons from Xe, Cs and Ba 3d{sub 5/2} and 3d{sub 3/2} levels is calculated. The calculation is carried out within the framework of a modified version of the spin-polarized random phase approximation with exchange. The effects of relaxation of excited electrons due to the 3d-vacancy creation are also accounted for. It is demonstrated that the parameters that characterize the photoelectron angular distribution as functions of the incoming photon energy, although being predictably small, acquire additional peculiarities when the interaction between electrons that belong to the 3d{sub 5/2} and 3d{sub 3/2} components of the spin-orbit doublet is taken into account.

  3. submitter Measurement of LYSO Intrinsic Light Yield Using Electron Excitation

    CERN Document Server

    Martinez Turtos, Rosana; Pizzichemi, Marco; Ghezzi, Alessio; Pauwels, Kristof; Auffray, Etiennette; Lecoq, Paul; Paganoni, Marco

    2016-01-01

    The determination of the intrinsic light yield $(LY_{int})$ of scintillating crystals, i.e. number of optical photons created per amount of energy deposited, constitutes a key factor in order to characterize and optimize their energy and time resolution. However, until now measurements of this quantity are affected by large uncertainties and often rely on corrections for bulk absorption and surface/edge state. The novel idea presented in this contribution is based on the confinement of the scintillation emission in the central upper part of a 10 mm cubic crystal using a 1.5 MeV electron beam with diameter of 1 mm. A black non-reflective pinhole aligned with the excitation point is used to fix the light extraction solid angle (narrower than total reflection angle), which then sets a light cone travel path through the crystal. The final number of photoelectrons detected using a Hamamatsu R2059 photomultiplier tube (PMT) was corrected for the extraction solid angle, the Fresnel reflection coefficient and quantum...

  4. 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

  5. Examining the Amine Functionalization in Dicarboxylates: Photoelectron Spectroscopy and Theoretical Studies of Aspartate and Glutamate

    Energy Technology Data Exchange (ETDEWEB)

    Deng, Shihu; Hou, Gao-Lei; Kong, Xiangyu; Valiev, Marat; Wang, Xue B.

    2014-06-30

    Aspartate (Asp2-) and Glutamate (Glu2-), two doubly charged conjugate bases of the corresponding amino acids were investigated using low temperature negative ion photoelectron spectroscopy (NIPES) and ab-initio calculations. The effect of amine functionalization was studied by a direct comparison to the parent dicarboxylate species (-CO2–(CH2)n–CO2-, DCn2-) -- succinate (DC22-) and propionate (DC32-). Experimentally the addition of amine group for n = 2 case (DC22-, Asp2-) significantly improves the stability of the resultant Asp2- dianionic species, albeit that NIPES shows only a small increase in adiabatic electron detachment energy (ADE) (+0.05eV). In contrast, for n = 3 (DC32-, Glu2-), much larger ADE increase is observed (+0.15eV). Similar results are obtained through ab-initio calculations. The latter indicates that increased stability of Asp2- can be attributed to the lowering of the energy of singlet dianion state due to hydrogen bonding effects. The effect of the amino group on the doublet monoanion state is more complicated, and results in the weakening of the binding of the adjacent carboxylate group due to electronic structure resonance effects. This conclusion is confirmed by the analysis of NIPES results that show enhanced production of near zero kinetic energy electrons observed experimentally for amine-functionalized species.

  6. Study of the photoelectron and electron momentum spectra of cyclopentene using benchmark Dyson orbital theories.

    Science.gov (United States)

    Huang, Yan R; Ning, Chuan G; Deng, Jing K; Deleuze, Michael S

    2008-05-07

    A complete study of the valence electronic structure and related electronic excitation properties of cyclopentene in its C(s) ground state geometry is presented. Ionization spectra obtained from this compound by means of photoelectron spectroscopy (He I and He II) and electron momentum spectroscopy have been analyzed in details up to electron binding energies of 30 eV using one-particle Green's function (1p-GF) theory along with the outer-valence (OVGF) and the third-order algebraic diagrammatic construction [ADC(3)] schemes. The employed geometries derive from DFT/B3LYP calculations in conjunction with the aug-cc-pVTZ basis set, and closely approach the structures inferred from experiments employing microwave spectroscopy or electron diffraction in the gas phase. The 1p-GF/ADC(3) calculations indicate that the orbital picture of ionization breaks down at electron binding energies larger than approximately 17 eV in the inner-valence region, and that the outer-valence 7a' orbital is also subject to a significant dispersion of the ionization intensity over shake-up states. This study confirms further the rule that OVGF pole strengths smaller than 0.85 foretell a breakdown of the orbital picture of ionization at the ADC(3) level. Spherically averaged (e, 2e) electron momentum distributions at an electron impact energy of 1200 eV that were experimentally inferred from an angular analysis of EMS intensities have been interpreted by comparison with accurate simulations employing ADC(3) Dyson orbitals. Very significant discrepancies were observed with momentum distributions obtained from several outer-valence ionization bands using standard Kohn-Sham orbitals.

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

    International Nuclear Information System (INIS)

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

    2015-01-01

    Highlights: • Black chromium electrodeposited from a Cr(III) bath is composed of oxide, hydroxide and metallic chromium. • Metallic phase is absent in black chromium electrodeposited from a Cr(III) + ZnO bath. • The near-surface layer is rich in hydroxides, whereas oxides of both metals predominate in the depth of the coatings. - Abstract: 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

  8. 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.

  9. Optical phonon cascade emission by photoelectrons at a p-GaN (Cs,O)-vacuum interface

    Science.gov (United States)

    Rozhkov, S. A.; Bakin, V. V.; Gorshkov, D. V.; Kosolobov, S. N.; Scheibler, H. E.; Terekhov, A. S.

    2016-07-01

    It has been experimentally established that the transfer of photoelectrons from the bulk of a p-GaN (Cs,O) photocathode to vacuum is accompanied by the emission of a cascade of optical phonons. In the quantum efficiency spectrum of the p-GaN (Cs,O) photocathode, an exciton peak has been identified, indicating a significant contribution of the electron-hole interaction to the generation of free electrons in heavily doped p-GaN.

  10. Structure determination of Ga As (110) p (1 x 1) - Sb using scanned-energy photoelectron diffraction

    International Nuclear Information System (INIS)

    Ascolani, H.; Asensio, M.C.; Fritzsche, W.

    1996-01-01

    Photoelectron diffraction (PD) in the scanned-energy mode has proven to be a powerfull tool for structural determination of the first few surface layers. The scanned-energy mode involves the measurement of the intensity of photoelectrons emitted from a core level as a function of the incident photon energy for different emission directions. The atom specificity of PD allows the investigation of the local structure of adsorbed atoms without interference of the substrate. In addition, if a measurable chemical shift exists, this technique is also able to discriminate between atoms of the same species adsorbed in inequivalent sites. The Ga As (110) p (1x1)-Sb (1 ML) surface represents a prototype system to study atom adsorption on III-V semiconductors. The epitaxial continued layer structure (ECLS) is generally accepted as the geometry corresponding to this surface, although some authors have claimed that the p 3 model forms a stable geometry equivalent to the ECLS, and that it provides an equally good description of their experimental results. So far, the conclusions about the atomic structure of this surface had been derived on the basis of indirect methods. This work exploits to the utmost the possibilities of analysis offered by the scanned-energy PD technique, namely, chemical shift analysis and direct inversion. The energy spectrum of Sb-4d photoelectrons emitted from the Ga As (110)-p (1x1) Sb surface has two chemically-shifted components. We have inverted the scanned-energy photoelectron diffraction data corresponding to these two components to obtain the positions of the Ga and As atoms which are nearest neighbors of two inequivalent Sb atoms. Our results contradict various models proposed for this surface and are consistent only with the ECLS. For a more detailed atomic structure determination, the best fit between experiment and multiple-scattering calculations was determined by a trial-and-error procedure. (author)

  11. Ultra high vacuum compatible versatile design of a sample holder for photoelectron spectroscopy and low energy electron diffraction

    International Nuclear Information System (INIS)

    Dhaka, R.S.; Shukla, A.K.; Barman, S.R.

    2008-01-01

    A versatile new sample holder design is presented, which overcome most frequent problems associated with single crystal transfer mechanism for photoelectron spectrometer. This sample holder was mounted and tested under ultrahigh vacuum condition during photoemission studies of different single crystal samples. It permits the cooling by liquid nitrogen and resistive heating up to 1000 K of the sample as well as in situ tilt motion to make it perfectly vertical, particularly for low energy electron diffraction study. (author)

  12. The structure of the Ni(100)c(2X2)-N.sub.2./sub. surface: a photoelectron diffraction determination

    Czech Academy of Sciences Publication Activity Database

    Saygo, D. I.; Kittel, M.; Hoef, J. T.; Polčík, Martin; Pascal, M.; Lamont, C. L. A.; Toomes, R. L.; Robinson, J.; Woodruff, D. P.

    2003-01-01

    Roč. 538, - (2003), s. 59-75 ISSN 0039-6028 Grant - others:Eur. Comm.Large Scale Fac (XE) XX; Phys. Sci.Engng.Counc.(GB) XX Institutional research plan: CEZ:AV0Z1010914 Keywords : density functional calculations * photoelectron diffraction * chemisorption * surface structure * morphology * roughness * nickel * nitrogen molecule * low index single crystal surfaces Subject RIV: BM - Solid Matter Physics ; Magnetism Impact fac tor: 2.063, year: 2003

  13. Oxidation Half-Reaction of Aqueous Nucleosides and Nucleotides via Photoelectron Spectroscopy Augmented by ab Initio Calculations

    Czech Academy of Sciences Publication Activity Database

    Schroeder, C. A.; Pluhařová, Eva; Seidel, R.; Schroeder, W. P.; Faubel, M.; Slavíček, P.; Winter, B.; Jungwirth, Pavel; Bradforth, S. E.

    2015-01-01

    Roč. 137, č. 1 (2015), s. 201-209 ISSN 0002-7863 R&D Projects: GA ČR GBP208/12/G016 Grant - others:GA ČR(CZ) GA13-34168S Institutional support: RVO:61388963 Keywords : DNA damage * photoelectron spectroscopy * DNA charge migration Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 13.038, year: 2015 http://pubs.acs.org/doi/10.1021/ja508149e

  14. Inner-shell photoelectron angular distributions from fixed-in-space OCS molecules: comparison between experiment and theory

    Energy Technology Data Exchange (ETDEWEB)

    Golovin, A V [Photon Factory, Institute of Materials Structure Science, Tsukuba 305-0801 (Japan); Institute of Physics, St Petersburg State University, 198504 St Petersburg (Russian Federation); Adachi, J [Photon Factory, Institute of Materials Structure Science, Tsukuba 305-0801 (Japan); Graduate School of Science, University of Tokyo, Bunkyo-ku, Tokyo 113-0033 (Japan); Motoki, S [Graduate School of Science, University of Tokyo, Bunkyo-ku, Tokyo 113-0033, (Japan); Takahashi, M [Institute for Molecular Science, Okazaki 444-8585 (Japan); Yagishita, A [Photon Factory, Institute of Materials Structure Science, Tsukuba 305-0801 (Japan); Graduate School of Science, University of Tokyo, Bunkyo-ku, Tokyo 113-0033 (Japan)

    2005-10-28

    Photoelectron angular distributions (PADs) for O 1s, C 1s and S 2p{sub 1/2}, 2p{sub 3/2} ionization of OCS molecules have been measured in shape resonance regions. These PAD results are compared with the results for O 1s and C 1s ionization of CO molecules, and multi-scattering X{alpha} (MSX{alpha}) calculations. The mechanism of the PAD formation both for parallel and perpendicular transitions differs very significantly in these molecules and a step from a two-centre potential (CO) to a three-centre potential (OCS) plays a principal role in electron scattering and the formation of the resulting PAD. For parallel transitions, it is found that for the S 2p and O 1s ionization the photoelectrons are emitted preferentially in a hemisphere directed to the ionized S and O atom, respectively. In OCS O 1s ionization, the S-C fragment plays the role of a strong 'scatterer' for photoelectrons, and in the shape resonance region most intensities of the PADs are concentrated on the region directed to the O atom. The MSX{alpha} calculations for perpendicular transitions reproduce the experimental data, but not so well as in the case of parallel transitions. The results of PAD, calculated with different l{sub max} on different atomic centres, reveal the important role of the d (l = 2) partial wave for the S atom in the partial wave decompositions of photoelectron wavefunctions.

  15. 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

  16. 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.

  17. Development of an Apparatus for High-Resolution Auger Photoelectron Coincidence Spectroscopy (APECS) and Electron Ion Coincidence (EICO) Spectroscopy

    Science.gov (United States)

    Kakiuchi, Takuhiro; Hashimoto, Shogo; Fujita, Narihiko; Mase, Kazuhiko; Tanaka, Masatoshi; Okusawa, Makoto

    We have developed an electron electron ion coincidence (EEICO) apparatus for high-resolution Auger photoelectron coincidence spectroscopy (APECS) and electron ion coincidence (EICO) spectroscopy. It consists of a coaxially symmetric mirror electron energy analyzer (ASMA), a miniature double-pass cylindrical mirror electron energy analyzer (DP-CMA), a miniature time-of-flight ion mass spectrometer (TOF-MS), a magnetic shield, an xyz stage, a tilt-adjustment mechanism, and a conflat flange with an outer diameter of 203 mm. A sample surface was irradiated by synchrotron radiation, and emitted electrons were energy-analyzed and detected by the ASMA and the DP-CMA, while desorbed ions were mass-analyzed and detected by the TOF-MS. The performance of the new EEICO analyzer was evaluated by measuring Si 2p photoelectron spectra of clean Si(001)-2×1 and Si(111)-7×7, and by measuring Si-L23VV-Si-2p Auger photoelectron coincidence spectra (Si-L23VV-Si-2p APECS) of clean Si(001)-2×1.

  18. 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.

  19. Measuring fundamental properties in operating solid oxide electrochemical cells by using in situ X-ray photoelectron spectroscopy

    Science.gov (United States)

    Zhang, Chunjuan; Grass, Michael E.; McDaniel, Anthony H.; Decaluwe, Steven C.; Gabaly, Farid El; Liu, Zhi; McCarty, Kevin F.; Farrow, Roger L.; Linne, Mark A.; Hussain, Zahid; Jackson, Gregory S.; Bluhm, Hendrik; Eichhorn, Bryan W.

    2010-11-01

    Photoelectron spectroscopic measurements have the potential to provide detailed mechanistic insight by resolving chemical states, electrochemically active regions and local potentials or potential losses in operating solid oxide electrochemical cells (SOCs), such as fuel cells. However, high-vacuum requirements have limited X-ray photoelectron spectroscopy (XPS) analysis of electrochemical cells to ex situ investigations. Using a combination of ambient-pressure XPS and CeO2-x/YSZ/Pt single-chamber cells, we carry out in situ spectroscopy to probe oxidation states of all exposed surfaces in operational SOCs at 750°C in 1mbar reactant gases H2 and H2O. Kinetic energy shifts of core-level photoelectron spectra provide a direct measure of the local surface potentials and a basis for calculating local overpotentials across exposed interfaces. The mixed ionic/electronic conducting CeO2-x electrodes undergo Ce3+/Ce4+ oxidation-reduction changes with applied bias. The simultaneous measurements of local surface Ce oxidation states and electric potentials reveal the active ceria regions during H2 electro-oxidation and H2O electrolysis. The active regions extend ~150μm from the current collectors and are not limited by the three-phase-boundary interfaces associated with other SOC materials. The persistence of the Ce3+/Ce4+ shifts in the ~150μm active region suggests that the surface reaction kinetics and lateral electron transport on the thin ceria electrodes are co-limiting processes.

  20. 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.

  1. Energy deposition by X-ray photoelectrons into interstellar molecular clouds

    Science.gov (United States)

    Voit, G. M.

    1991-01-01

    The deposition of energy by 100-10,000 eV electrons into molecular hydrogen and helium gas of cosmic abundances and fractional ionization ranging from 10 to the -12th to 0.1 is considered. In order to account for energy deposition by both discrete and continuous degradation processes, the loss spectrum, a form of the Spencer-Fano degradation spectrum particularly suited to describing electron energy deposition in a partially ionized gas is considered. The calculated excitation and ionization yields drop as the fractional ionization increases. The dependences of these yields on fractional ionization are fitted to a form suitable for swift numerical computation.

  2. Measurement of the {gamma}-anisotropy in n{yields}+p{yields}{yields}d+{gamma}

    Energy Technology Data Exchange (ETDEWEB)

    Mueller, T.M.; Dubbers, D.; Hautle, P.; Bunyatova, E.I.; Korobkina, E.I.; Zimmer, O

    2000-02-11

    The study of the radiative neutron capture by protons, n+p{yields}d+{gamma}, provides valuable information about the nucleon-nucleon interaction. So far, no experimental value has existed for the {gamma}-anisotropy which may appear if neutrons and protons both are polarised. A non-vanishing {gamma}-anisotropy {eta} is a clear-cut signal for the existence of transitions {sup 3}S{sub 1}{yields} {sup 3}d{sub 1} from the triplet initial state to the ground state of the deuteron. We report the first measurement of this observable. The result is {eta}=(1.0{+-}2.5)x10{sup -4} at 50.5% polarisation of neutrons and protons.

  3. 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

  4. Study of photoelectronic properties of semiconductors by the advanced method of transient microwave photoconductivity (AMTMP)

    Science.gov (United States)

    Grabtchak, Serguei Yuryevich

    The current work has described the new experimental method, Advanced Method of Transient Microwave Photoconductivity (AMTMP) and its capabilities to study the photoelectronic properties of semiconductors. AMTMP measures not only the effect proportional to the excess conduction band electrons ("photoconductivity" itself, related to the changes in the imaginary part of the complex dielectric constant), but also the changes in the real part of the complex dielectric constant ("photodielectric effect"). In a rigorous treatment of the complex dielectric constant changes in a microwave cavity general expressions relating the changes in complex dielectric constant to two experimentally measured quantities (change in the cavity quality factor and the shift of the resonance frequency) were derived. Based on this method it was possible to systematize basic types of excitations (free electrons, plasma, trapped electrons, excitons) as bound/non-bound states. To interpret the behavior of the kinetics in semiconductors having distributions of the localized states in the band gap the simulation approach based on solving numerically multiple trapping rate equations was developed. With this approach the major basic types of distributions (rectangular, linear, exponential, Gaussian) were explored thoroughly. We tested the method on various semiconductors: two types of polycrystalline CdSe thin films (#1 and #2), semi-insulating (SI) GaAs, single crystal Si and porous Si. We identified the distributions present in CdSe #1 as an exponential distribution and in CdSe #2 as a Gaussian-like peaked distribution. The parameters of the distributions were estimated. We showed that with respect to the distribution, the transient methods always probe only the part of the real distribution which is present in a sample. The distribution becomes distorted from the initial form by the Fermi function describing the occupational probability and truncated at high energies by the demarcation level. For

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

    International Nuclear Information System (INIS)

    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 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 3+ is substituted for Na + . 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

  6. 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.

  7. Band structures of 4f and 5f materials studied by angle-resolved photoelectron spectroscopy.

    Science.gov (United States)

    Fujimori, Shin-ichi

    2016-04-20

    Recent remarkable progress in angle-resolved photoelectron spectroscopy (ARPES) has enabled the direct observation of the band structures of 4f and 5f materials. In particular, ARPES with various light sources such as lasers (hν ~ 7 eV) or high-energy synchrotron radiations (hν >/~ 400 eV) has shed light on the bulk band structures of strongly correlated materials with energy scales of a few millielectronvolts to several electronvolts. The purpose of this paper is to summarize the behaviors of 4f and 5f band structures of various rare-earth and actinide materials observed by modern ARPES techniques, and understand how they can be described using various theoretical frameworks. For 4f-electron materials, ARPES studies of CeMIn5(M = Rh, Ir, and Co) and YbRh2Si2 with various incident photon energies are summarized. We demonstrate that their 4f electronic structures are essentially described within the framework of the periodic Anderson model, and that the band-structure calculation based on the local density approximation cannot explain their low-energy electronic structures. Meanwhile, electronic structures of 5f materials exhibit wide varieties ranging from itinerant to localized states. For itinerant U5f compounds such as UFeGa5, their electronic structures can be well-described by the band-structure calculation assuming that all U5f electrons are itinerant. In contrast, the band structures of localized U5f compounds such as UPd3 and UO2 are essentially explained by the localized model that treats U5f electrons as localized core states. In regards to heavy fermion U-based compounds such as the hidden-order compound URu2Si2, their electronic structures exhibit complex behaviors. Their overall band structures are generally well-explained by the band-structure calculation, whereas the states in the vicinity of EF show some deviations due to electron correlation effects. Furthermore, the electronic structures of URu2Si2 in the paramagnetic and hidden-order phases are

  8. Yields of historical exploration programs

    International Nuclear Information System (INIS)

    Huslende, T.

    1995-01-01

    The paper relates to an method of evaluation developed for analysing the yield of historical exploration programs by computerized simulation. The most important elements show in coarse features how the results can be used in the different analyses. The evaluation is to be executed annually for the comparison and sorting of data from different offshore sites. Topics are exploration evaluation study, evaluation process, handling of exploration costs, discovered reserves, development projects, cash flow analysis, analysis of results, finding cost, international comparison. 1 ref., 11 figs

  9. Crop diversity for yield increase.

    Directory of Open Access Journals (Sweden)

    Chengyun Li

    2009-11-01

    Full Text Available Traditional farming practices suggest that cultivation of a mixture of crop species in the same field through temporal and spatial management may be advantageous in boosting yields and preventing disease, but evidence from large-scale field testing is limited. Increasing crop diversity through intercropping addresses the problem of increasing land utilization and crop productivity. In collaboration with farmers and extension personnel, we tested intercropping of tobacco, maize, sugarcane, potato, wheat and broad bean--either by relay cropping or by mixing crop species based on differences in their heights, and practiced these patterns on 15,302 hectares in ten counties in Yunnan Province, China. The results of observation plots within these areas showed that some combinations increased crop yields for the same season between 33.2 and 84.7% and reached a land equivalent ratio (LER of between 1.31 and 1.84. This approach can be easily applied in developing countries, which is crucial in face of dwindling arable land and increasing food demand.

  10. The minimum yield in channeling

    International Nuclear Information System (INIS)

    Uguzzoni, A.; Gaertner, K.; Lulli, G.; Andersen, J.U.

    2000-01-01

    A first estimate of the minimum yield was obtained from Lindhard's theory, with the assumption of a statistical equilibrium in the transverse phase-space of channeled particles guided by a continuum axial potential. However, computer simulations have shown that this estimate should be corrected by a fairly large factor, C (approximately equal to 2.5), called the Barrett factor. We have shown earlier that the concept of a statistical equilibrium can be applied to understand this result, with the introduction of a constraint in phase-space due to planar channeling of axially channeled particles. Here we present an extended test of these ideas on the basis of computer simulation of the trajectories of 2 MeV α particles in Si. In particular, the gradual trend towards a full statistical equilibrium is studied. We also discuss the introduction of this modification of standard channeling theory into descriptions of the multiple scattering of channeled particles (dechanneling) by a master equation and show that the calculated minimum yields are in very good agreement with the results of a full computer simulation

  11. Narrowband Compton Scattering Yield Enhancement

    Science.gov (United States)

    Rykovanov, Sergey; Seipt, Daniel; Kharin, Vasily

    2017-10-01

    Compton Scattering (CS) of laser light off high-energy electrons is a well-established source of X- and gamma-rays for applications in medicine, biology, nuclear and material sciences. Main advantage of CS photon sources is the possibility to generate narrow spectra as opposed to a broad continuum obtained when utilizing Bremsstrahlung. However, due to the low cross-section of the linear process, the total photon yield is quite low. The most straightforward way to increase the number of photon-electron beam scattering events is to increase the laser pulse intensity at the interaction point by harder focusing. This leads to an unfortunate consequence. Increase in the laser pulse normalized amplitude a0, leads to additional ponderomotive spectrum broadening of the scattered radiation. The ponderomotive broadening is caused by the v × B force, which slows the electron down near the peak of the laser pulse where the intensity is high, and can be neglected near the wings of the pulse, where the intensity is low. We show that laser pulse chirping, both nonlinear (laser pulse frequency ''following'' the envelope of the pulse) and linear, leads to compensation of the ponderomotive broadening and considerably enhances the yield of the nonlinear Compton sources. Work supported by the Helmholtz Association via Helmholtz Young Investigators Grant (VH-NG-1037).

  12. An X-ray photoelectron spectroscopy study of surface changes on brominated and sulfur-treated activated carbon sorbents during mercury capture: performance of pellet versus fiber sorbents.

    Science.gov (United States)

    Saha, Arindom; Abram, David N; Kuhl, Kendra P; Paradis, Jennifer; Crawford, Jenni L; Sasmaz, Erdem; Chang, Ramsay; Jaramillo, Thomas F; Wilcox, Jennifer

    2013-12-03

    This work explores surface changes and the Hg capture performance of brominated activated carbon (AC) pellets, sulfur-treated AC pellets, and sulfur-treated AC fibers upon exposure to simulated Powder River Basin-fired flue gas. Hg breakthrough curves yielded specific Hg capture amounts by means of the breakthrough shapes and times for the three samples. The brominated AC pellets showed a sharp breakthrough after 170-180 h and a capacity of 585 μg of Hg/g, the sulfur-treated AC pellets exhibited a gradual breakthrough after 80-90 h and a capacity of 661 μg of Hg/g, and the sulfur-treated AC fibers showed no breakthrough even after 1400 h, exhibiting a capacity of >9700 μg of Hg/g. X-ray photoelectron spectroscopy was used to analyze sorbent surfaces before and after testing to show important changes in quantification and oxidation states of surface Br, N, and S after exposure to the simulated flue gas. For the brominated and sulfur-treated AC pellet samples, the amount of surface-bound Br and reduced sulfur groups decreased upon Hg capture testing, while the level of weaker Hg-binding surface S(VI) and N species (perhaps as NH4(+)) increased significantly. A high initial concentration of strong Hg-binding reduced sulfur groups on the surface of the sulfur-treated AC fiber is likely responsible for this sorbent's minimal accumulation of S(VI) species during exposure to the simulated flue gas and is linked to its superior Hg capture performance compared to that of the brominated and sulfur-treated AC pellet samples.

  13. Photoelectron Spectroscopy of Free Multiply Charged Keggin Anions α-[PM12O40]3- (M = Mo, W) in the Gas Phase

    Energy Technology Data Exchange (ETDEWEB)

    Waters, Tom; Huang, Xin; Wang, Xue B.; Woo, Hin-koon; O' Hair, Richard Aj; Wedd, Anthony G.; Wang, Lai S.

    2006-09-21

    Two polyoxometalate Keggin-type anions, a-PM12O403- (M = Mo, W), were transferred to the gas phase by electrospray; their electronic structure and stability were probed by photoelectron spectroscopy. These triply charged anions were found to be highly stable in the gas phase with large adiabatic electron detachment energies of 1.7 and 2.1 eV for M = Mo and W, respectively. The magnitude of the repulsive Coulomb barrier was measured as ~3.4 eV for both anions, providing an experimental estimate for the intramolecular Coulomb repulsion present in these highly charged anions. Density functional theory calculations were carried out and compared with the experimental data, providing insight into the electronic structure and valence molecular orbitals of the two Keggin anions. The calculations indicated that the highest occupied molecular orbital and other frontier orbitals for PM12O403- are localized primarily on the u2-oxo bridging ligands of the polyoxometalate framework, consistent with the reactivity on the u2-oxo sites observed in solution. It was shown that the HOMO of PW12O403- is stabilized relative to that of PMo12O403- by ~0.35 eV. The experimental adiabatic electron detachment energies of PM12O403- (i.e., the electron affinities of PM12O402-) are combined with recent calculations on the proton affinity of PM12O403- to yield O-H bond dissociation energies in PM12O39(OH)2- as ~5.1 eV

  14. Reference binding energies of transition metal carbides by core-level x-ray photoelectron spectroscopy free from Ar+ etching artefacts

    Science.gov (United States)

    Greczynski, G.; Primetzhofer, D.; Hultman, L.

    2018-04-01

    We report x-ray photoelectron spectroscopy (XPS) core level binding energies (BE's) for the widely-applicable groups IVb-VIb transition metal carbides (TMCs) TiC, VC, CrC, ZrC, NbC, MoC, HfC, TaC, and WC. Thin film samples are grown in the same deposition system, by dc magnetron co-sputtering from graphite and respective elemental metal targets in Ar atmosphere. To remove surface contaminations resulting from exposure to air during sample transfer from the growth chamber into the XPS system, layers are either (i) Ar+ ion-etched or (ii) UHV-annealed in situ prior to XPS analyses. High resolution XPS spectra reveal that even gentle etching affects the shape of core level signals, as well as BE values, which are systematically offset by 0.2-0.5 eV towards lower BE. These destructive effects of Ar+ ion etch become more pronounced with increasing the metal atom mass due to an increasing carbon-to-metal sputter yield ratio. Systematic analysis reveals that for each row in the periodic table (3d, 4d, and 5d) C 1s BE increases from left to right indicative of a decreased charge transfer from TM to C atoms, hence bond weakening. Moreover, C 1s BE decreases linearly with increasing carbide/metal melting point ratio. Spectra reported here, acquired from a consistent set of samples in the same instrument, should serve as a reference for true deconvolution of complex XPS cases, including multinary carbides, nitrides, and carbonitrides.

  15. Weathering properties of treated southern yellow pine wood examined by X-ray photoelectron spectroscopy, scanning electron microscopy and physical characterization

    International Nuclear Information System (INIS)

    Salaita, Ghaleb N.; Ma, Frank M.S.; Parker, Trudy C.; Hoflund, Gar B.

    2008-01-01

    In this study the weathering behavior of southern yellow pine (SYP) wood samples pretreated in different solutions has been examined using X-ray photoelectron spectroscopy (XPS), scanning electron microscopy (SEM) and various types of physical characterization regarding material loss and discoloration. The treatment solutions include water as a control, a commercially available water repellent (WR) wood treating additive and polyethylene glycol (PEG) products including PEG PLUS TM , PEG 8000 solutions and Compound 20M in varying concentrations. All contained the wood preservative chromated copper arsenate (CCA). One sample was treated with a CCA solution only. The treatments were carried out at 20 deg. C and 150 psig for 1/2 h after exposure to vacuum (28 mmHg) for 15 min. Simulated weathering was achieved in an Atlas 65-W Weather-Ometer for 2000 h with both light and dark periods and rain. The temperature ranged from 23 deg. C during the dark cycle to 35 deg. C during the light cycle. With weathering the XPS O/C ratios increase due to oxidation of the surface. Exposure to UV light results in bond breakage and reaction with oxygen in the presence of air to form organic functional groups such as , , C=O and/or O-C-O. These oxidized products can protect the underlying wood from deterioration if they are insoluble in water and remain on the surface as a protective coating. If soluble, rain washes the compounds away and assists in the degradation. Correlated changes are observed in the XPS O/C ratios, the high-resolution XPS C 1s spectra, the SEM micrographs and physical measurements including thickness alteration, weight loss, and discoloration by yellowing or whitening of the weathered wood. The PEG treatments are effective in protecting wood with the 2% PEG PLUS treatment providing the best weathering behavior similar to that of the CCA treatment. The WR and water treatments yield the poorest weathering properties

  16. 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.

  17. 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.

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

    International Nuclear Information System (INIS)

    Embong, Zaidi; Johar, Saffuwan; Tajudin, Saiful Azhar Ahmad; Sahdan, Mohd Zainizan

    2015-01-01

    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 2+ and Al 2+ cation mobility under the influence of voltage potential between the cathode and anode will be discussed in detail

  19. Deep subthreshold photofission yields analysis

    International Nuclear Information System (INIS)

    Bellia, G.; Del Zoppo, A.; Migneco, E.; Barna, R.C.; De Pasquale, D.

    1979-01-01

    Photofission yield measurements on 232 Th and /sup 235,236,238/U, showing the ''shelf effect,'' have been analyzed in terms of a double-humped fission barrier. From the characteristic of the shelf it was possible to evaluate the excitation energy E/sub II/ of the shape isomer. In the framework of the double-humped barrier, with the competition between γ decay to the shape isomer and tunneling through the outer barrier of a compound state in the second well, it was possible to deduce fission branching ratios in agreement with those known in the literature. In particular for 232 Th a three-humped fission barrier is proposed, the second deep minimum causing the shelf effect and the third one the narrow resonances detected in this isotope

  20. Deep subthreshold photofission yields analysis

    Energy Technology Data Exchange (ETDEWEB)

    Bellia, G.; Del Zoppo, A.; Migneco, E.; Barna, R.C.; De Pasquale, D.

    1979-09-01

    Photofission yield measurements on /sup 232/Th and /sup 235,236,238/U, showing the ''shelf effect,'' have been analyzed in terms of a double-humped fission barrier. From the characteristic of the shelf it was possible to evaluate the excitation energy E/sub II/ of the shape isomer. In the framework of the double-humped barrier, with the competition between ..gamma.. decay to the shape isomer and tunneling through the outer barrier of a compound state in the second well, it was possible to deduce fission branching ratios in agreement with those known in the literature. In particular for /sup 232/Th a three-humped fission barrier is proposed, the second deep minimum causing the shelf effect and the third one the narrow resonances detected in this isotope.

  1. 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

  2. Three-Dimensional X-Ray Photoelectron Tomography on the Nanoscale: Limits of Data Processing by Principal Component Analysis

    DEFF Research Database (Denmark)

    Hajati, S.; Walton, J.; Tougaard, S.

    2013-01-01

    In a previous article, we studied the influence of spectral noise on a new method for three-dimensional X-ray photoelectron spectroscopy (3D XPS) imaging, which is based on analysis of the XPS peak shape [Hajati, S., Tougaard, S., Walton, J. & Fairley, N. (2008). Surf Sci 602, 3064-3070]. Here, we...... study in more detail the influence of noise reduction by principal component analysis (PCA) on 3D XPS images of carbon contamination of a patterned oxidized silicon sample and on 3D XPS images of Ag covered by a nanoscale patterned octadiene layer. PCA is very efficient for noise reduction, and using...

  3. X-ray photoelectron and Raman studies of microwave Plasma Assisted Chemical Vapour Deposition (PACVD) diamond films

    Science.gov (United States)

    Humbert, Bernard; Hellala, Nesrine; Ehrhardt, Jean Jacques; Barrat, Silvère; Bauer-grosse, Elizabeth

    2008-08-01

    X-ray photoelectron and Raman spectroscopies were used to investigate the chemical and the structural properties of thin diamond films synthesised by Plasma Assisted Chemical Vapour Deposition (PACVD). Continuous polycrystalline diamond films were grown under different plasma conditions and based on the combination of detailed XPS and Raman spectroscopic analysis two main topics are highlighted (i) the stress measurements were discussed by distinguishing clearly the chemical effects from the mechanical effects; (ii) an electronic gap at 2.7 eV probed by Raman resonance that corresponds to an energy loss peak on the XPS carbon signal, was related to the surface hydrogenation.

  4. X-ray photoelectron spectroscopy of an industrially sulphided commercial CoMo-γAl2O3 catalyst

    International Nuclear Information System (INIS)

    Demanet, C.M.

    1984-01-01

    An X-ray photoelectron spectroscopic (XPS) study of an industrially sulphided commercial CoMo-γAl 2 O 3 catalyst is reported. In the fresh (oxidized) catalyst, Co is present as Co 3 O 4 and Mo is in the form of Mosup(VI). When sulphided under industrial conditions, Co is in the form of CoS, Mo is present in the Mosup(IV) and Mosup(VI), and three different sulphur species are distinguished. The variation of the intensity of the XPS signals with temperature is considered in drawing conclusions about the nature of the surface

  5. Photoelectron angular distributions from O K shell of oriented CO molecules: A critical comparison between theory and experiment

    Science.gov (United States)

    Ito; Adachi; Hikosaka; Motoki; Soejima; Yagishita; Raseev; Cherepkov

    2000-07-03

    The dynamical information (ten dipole matrix elements and eight phase differences) has been deduced from the measured angular distributions of photoelectrons from O K shell of oriented CO molecules near the ionization threshold in the region of a sigma(*) shape resonance. Light polarization parallel and perpendicular to the molecular axis has been used. An important contribution of six lsigma partial waves with 0

  6. Gas-Phase Tautomerism in the Triazoles and Tetrazoles: A Study by Photoelectron Spectroscopy and ab Initio Molecular Orbital Calculations

    Science.gov (United States)

    Palmer, Michael H.; Simpson, Isobel; Wheeler, J. Ross

    1981-11-01

    The photoelectron spectra of the tautomeric 1,2,3,- and 1,2,4-triazole and 1,2,3,4-tetrazole systems have been compared with the corresponding N-methyl derivatives. The dominant tautomers in the gas phase have been identified as 2 H-1,2,3-triazole, 1 H-1,2,4-triazole and 2H-tetrazole. Full optimisation of the equilibrium geometry by ab initio molecular orbital methods leads to the same conclusions, for relative stability of the tautomers in each of the triazoles, but the calculations wrongly predict the tetrazole tautomerism.

  7. Self-detection of x-ray Fresnel transmissivity using photoelectron-induced gas ionization

    OpenAIRE

    Stoupin, Stanislav

    2015-01-01

    Electric response of an x-ray mirror enclosed in a gas flow ionization chamber was studied under the conditions of total external reflection for hard x-rays. It is shown that the electric response of the system as a function of the incidence angle is defined by x-ray Fresnel transmissivity and photon-electron attenuation properties of the mirror material. A simple interpretation of quantum yield of the system is presented. The approach could serve as a basis for non-invasive in-situ diagnosti...

  8. Yield trends and yield gap analysis of major crops in the world

    NARCIS (Netherlands)

    Hengsdijk, H.; Langeveld, J.W.A.

    2009-01-01

    This study aims to quantify the gap between current and potential yields of major crops in the world, and the production constraints that contribute to this yield gap. Using an expert-based evaluation of yield gaps and the literature, global and regional yields and yield trends of major crops are

  9. 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.

  10. Irradiation-induced degradation of PTB7 investigated by valence band and S 2p photoelectron spectroscopy

    Science.gov (United States)

    Darlatt, Erik; Muhsin, Burhan; Roesch, Roland; Lupulescu, Cosmin; Roth, Friedrich; Kolbe, Michael; Gottwald, Alexander; Hoppe, Harald; Richter, Mathias

    2016-08-01

    Monochromatic radiation with known absolute radiant power from an undulator at the electron storage ring Metrology Light Source (MLS) was used to irradiate PTB7 (a thieno[3, 4-b]thiophene-alt-benzodithiophene polymer) thin films at wavelengths (photon energies) of 185 nm (6.70 eV), 220 nm (5.64 eV), 300 nm (4.13 eV), 320 nm (3.88 eV), 356 nm (3.48 eV) and 675 nm (1.84 eV) under ultra-high vacuum conditions for the investigation of radiation-induced degradation effects. The characterization of the thin films is focused at ultraviolet photoelectron spectroscopy (UPS) of valence bands and is complemented by S 2p x-ray photoelectron spectroscopy (S 2p XPS) before and after the irradiation procedure. The radiant exposure was determined for each irradiation by means of photodiodes traceably calibrated to the international system of units SI. The valence band spectra show the strongest changes for the shortest wavelengths and no degradation effect at 356 nm and 675 nm even with the highest radiant exposure applied. In the spectral range where the Sun appears bright on the Earth’s surface, no degradation effects are observed.

  11. Photoelectron imaging and photodissociation of ozonide in O3(-)⋅(O2)n (n = 1-4) clusters.

    Science.gov (United States)

    Mann, Jennifer E; Troyer, Mary E; Jarrold, Caroline Chick

    2015-03-28

    The photoelectron images of O3 (-) and O3 (-) ⋅ (O2)n (n = 1-4) have been measured using 3.49 eV photon energy. The spectra exhibit several processes, including direct photodetachment and photodissociation with photodetachment of O(-) photofragments. Several spectra also exhibit autodetachment of vibrationally excited O2 (-) photofragments. Comparison of the bare O3 (-) photoelectron spectra to that of the complexes shows that the O3 (-) core is preserved upon clustering with several O2 molecules, though subtle changes in the Franck-Condon profile of the ground state photodetachment transition suggest some charge transfer from O3 (-) to the O2 molecules. The electron affinities of the complexes increase by less than 0.1 eV with each additional O2 molecule, which is comparable to the corresponding binding energy [K. Hiraoka, Chem. Phys. 125, 439-444 (1988)]. The relative intensity of the photofragment O(-) detachment signal to the O3 (-) ⋅ (O2)n direct detachment signal increases with cluster size. O2 (-) autodetachment signal is only observed in the O3 (-), O3 (-) ⋅ (O2)3, and O3 (-) ⋅ (O2)4 spectra, suggesting that the energy of the dissociative state also varies with the number of O2 molecules present in the cluster.

  12. Assignment of the photoelectron spectrum of the nitrate anion NO3- and vibronic interactions in the nitrate free radical

    Science.gov (United States)

    Hirota, Eizi

    2018-01-01

    The unpaired electron orbital of NO3 is of a2‧ symmetry in the ground electronic state, and thus its motion about the symmetry axis of the molecule is free rotation. When a degenerate vibration is excited, however, the free azimuthal rotation of the unpaired electron is perturbed much by nuclear motions of the degenerate mode, as evidenced by high-resolution spectroscopic studies. Thus the ν4 fundamental state, for example, bears some characters of the B ˜ excited electronic state through the Herzberg-Teller (H-T) interaction, and Neumark et al. explained anomalous ν4 progression in the photoelectron spectra of the NO3- anion by the H-T mechanism. However, the interaction parameter Neumark required was too large to reproduce the ν4 molecular parameters in the ground electronic state precisely determined by high-resolution IR spectroscopy. This discrepancy was resolved by the fact that the upper ν4 overtone/combination states of Neumark's photoelectron transitions were primarily of vibrational in nature. The present study thus showed that NO3 bears both vibrational and H-T induced electronic characters in excited states of degenerate modes in the ground electronic state.

  13. Dissociation of strong acid revisited: X-ray photoelectron spectroscopy and molecular dynamics simulations of HNO3 in water

    Energy Technology Data Exchange (ETDEWEB)

    Lewis, Tanza; Winter, Berndt; Stern, Abraham C.; Baer, Marcel D.; Mundy, Christopher J.; Tobias, Douglas J.; Hemminger, J. C.

    2011-08-04

    Molecular-level insight into the dissociation of nitric acid in water is obtained from photoelectron X-ray spectroscopy and first-principles molecular dynamics (MD) simulations. Our combined studies reveal surprisingly abrupt changes in solvation configurations of undissociated nitric acid at approximately 4 M concentration. Experimentally, this is inferred from N1s binding energy shifts of HNO3(aq) as a function of concentration, and is associated with variations in the local electronic structure of the nitrogen atom. It also shows up as a discontinuity in the degree of dissociation as a function of concentration, determined here from the N1s photoelectron signal intensity, which can be separately quantified for undissociated HNO3(aq) and dissociated NO3-(aq). Intermolecular interactions within the nitric acid solution are discussed on the basis of MD simulations, which reveal that molecular HNO3 interacts remarkably weakly with solvating water molecules at low concentration; around 4 M there is a turnover to a more structured solvation shell, accompanied by an increase in hydrogen bonding between HNO3 and water. We suggest that the driving force behind the more structured solvent configuration of HNO3 is the overlap of nitric acid solvent shells that sets in around 4 M concentration. This work was supported by the US Department of Energy Basic Energy Sciences' Chemical Sciences, Geosciences & Biosciences Division. Pacific Northwest National Laboratory is operated by Battelle for the US Department of Energy.

  14. Individual Atomic Imaging of Multiple Dopant Sites in As-Doped Si Using Spectro-Photoelectron Holography.

    Science.gov (United States)

    Tsutsui, Kazuo; Matsushita, Tomohiro; Natori, Kotaro; Muro, Takayuki; Morikawa, Yoshitada; Hoshii, Takuya; Kakushima, Kuniyuki; Wakabayashi, Hitoshi; Hayashi, Kouichi; Matsui, Fumihiko; Kinoshita, Toyohiko

    2017-12-13

    The atomic scale characterization of dopant atoms in semiconductor devices to establish correlations with the electrical activation of these atoms is essential to the advancement of contemporary semiconductor process technology. Spectro-photoelectron holography combined with first-principles simulations can determine the local three-dimensional atomic structures of dopant elements, which in turn affect their electronic states. In the work reported herein, this technique was used to examine arsenic (As) atoms doped into a silicon (Si) crystal. As 3d core level photoelectron spectroscopy demonstrated the presence of three types of As atoms at a total concentration of approximately 10 20 cm -3 , denoted as BEH, BEM, and BEL. On the basis of Hall effect measurements, the BEH atoms corresponded to electrically active As occupying substitutional sites and exhibiting larger thermal fluctuations than the Si atoms, while the BEM atoms corresponded to electrically inactive As embedded in the As n V (n = 2-4) type clusters. Finally, the BEL atoms were assigned to electrically inactive As in locally disordered structures.

  15. Photoelectron spectroscopy of 4f, 5f, and 2p orbital electrons and the thermochemistry of uranium oxides

    International Nuclear Information System (INIS)

    Murch, G.E.; Thorn, R.J.

    1979-01-01

    The basic reaction describing the partial pressure of oxygen in equilibrium with UO 2 +x is resolved into a set of elementary reactions for which the energies can be obtained through 5f- an 2p-orbital electron energies measured with X-ray photoelectron spectroscopy. It is shown that the energies of the valence orbitals are a direct measure of the oxygen potential and that the orbital binding energies adjusted for the coulombic self potential are linearly related to the ionicity derived from the optical dispersion theory of Phillips and van Vechten. Measurements of the O 2- (1s 2 ---) orbital energies in alkaline earth and UO 2 and ThO 2 indicates an ionicity of o.93 for the two actinide dioxides. From measurements of the intensities of the photoelectron emitted from the 5f orbital in uranium metal, uranium dioxide and uranium tetrafluoride it is shown that the densities of electrons in the 5f orbitals are the same in U,UO 2 and UF 4 . (orig.) [de

  16. Time-resolved photoelectron spectroscopy of IR-driven electron dynamics in a charge transfer model system.

    Science.gov (United States)

    Falge, Mirjam; Fröbel, Friedrich Georg; Engel, Volker; Gräfe, Stefanie

    2017-08-02

    If the adiabatic approximation is valid, electrons smoothly adapt to molecular geometry changes. In contrast, as a characteristic of diabatic dynamics, the electron density does not follow the nuclear motion. Recently, we have shown that the asymmetry in time-resolved photoelectron spectra serves as a tool to distinguish between these dynamics [Falge et al., J. Phys. Chem. Lett., 2012, 3, 2617]. Here, we investigate the influence of an additional, moderately intense infrared (IR) laser field, as often applied in attosecond time-resolved experiments, on such asymmetries. This is done using a simple model for coupled electronic-nuclear motion. We calculate time-resolved photoelectron spectra and their asymmetries and demonstrate that the spectra directly map the bound electron-nuclear dynamics. From the asymmetries, we can trace the IR field-induced population transfer and both the field-driven and intrinsic (non-)adiabatic dynamics. This holds true when considering superposition states accompanied by electronic coherences. The latter are observable in the asymmetries for sufficiently short XUV pulses to coherently probe the coupled states. It is thus documented that the asymmetry is a measure for phases in bound electron wave packets and non-adiabatic dynamics.

  17. Magnetometry of buried layers—Linear magnetic dichroism and spin detection in angular resolved hard X-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Gloskovskii, Andrei; Stryganyuk, Gregory; Fecher, Gerhard H.; Felser, Claudia; Thiess, Sebastian; Schulz-Ritter, Heiko; Drube, Wolfgang; Berner, Götz; Sing, Michael; Claessen, Ralph; Yamamoto, Masafumi

    2012-01-01

    Highlights: ► Newly commissioned HAXPES instrument at P09 beamline of the PETRA III ring at DESY. ► We report HAXPES studies on buried magnetic nanolayers in a multi-layer sample. ► Linear magnetic dichroism of photoelectrons from buried CoFe–Ir 78 Mn 22 layers. ► Spin-resolved HAXPES measurements on buried magnetic multilayers using Mott detector. - Abstract: The electronic properties of buried magnetic nano-layers were studied using the linear magnetic dichroism in the angular distribution of photoemitted Fe, Co, and Mn 2p electrons from a CoFe–Ir 78 Mn 22 multi-layered sample. The buried layers were probed using hard X-ray photoelectron spectroscopy, HAXPES, at the undulator beamline P09 of the 3rd generation storage ring PETRA III. The results demonstrate that this magnetometry technique can be used as a sensitive element specific probe for magnetic properties suitable for application to buried ferromagnetic and antiferromagnetic magnetic materials and multilayered spintronics devices. Using the same instrument, spin-resolved Fe 2p HAXPES spectra were obtained from the buried layer with good signal quality.

  18. An algorithm for removing charging effects from X-ray photoelectron spectra of nanoscaled non-conductive materials

    Energy Technology Data Exchange (ETDEWEB)

    Gulyaev, R.V., E-mail: gulyaev@catalysis.ru [Boreskov Institute of Catalysis SB RAS, Novosibirsk 630090 (Russian Federation); Novosibirsk State University, Novosibirsk 630090 (Russian Federation); Koscheev, S.V. [Boreskov Institute of Catalysis SB RAS, Novosibirsk 630090 (Russian Federation); Malykhin, S.E. [Boreskov Institute of Catalysis SB RAS, Novosibirsk 630090 (Russian Federation); Novosibirsk State University, Novosibirsk 630090 (Russian Federation)

    2015-07-15

    Graphical abstract: - Highlights: • Algorithm for restoration of XP-spectra distorted by surface charging was developed. • Pd3d spectra of Pd/SnO{sub 2}, Pd/CeO{sub 2}–SnO{sub 2} catalysts were successfully restored. • Algorithm performance is comparable with “hardware” charging neutralization technique. - Abstract: Inhomogeneous surface charging could lead to a distortion of X-ray photoelectron (XP) spectra, which complicates the spectra analysis and sometimes results in an incorrect interpretation of elements chemical states of the sample. The charging effects might be especially strong in the case of XPS application for the characterization of heterogeneous catalysts, which are usually based on the dielectric or semiconductor materials with complex morphology. In this paper, we propose an algorithm to restore XP spectra when distortion is caused by inhomogeneous and/or non-constant surface charging effects. A photoelectron line of a reference element can be used to eliminate the distortions from experimental spectra of other elements by an iterative deconvolution procedure. The successful application of the algorithm for the restoration of a Pd3d line shape using a reference Sn3d{sub 5/2} line was demonstrated for the Pd/SnO{sub 2} and Pd/CeO{sub 2}–SnO{sub 2} catalysts.

  19. Light yield determination in large sodium iodide detectors applied in the search for dark matter

    Science.gov (United States)

    Oliván, M. A.; Amaré, J.; Cebrián, S.; Cuesta, C.; García, E.; Martínez, M.; Ortigoza, Y.; Ortiz de Solórzano, A.; Pobes, C.; Puimedón, J.; Sarsa, M. L.; Villar, J. A.; Villar, P.

    2017-07-01

    Application of NaI(Tl) detectors in the search for galactic dark matter particles through their elastic scattering off the target nuclei is well motivated because of the long standing DAMA/LIBRA highly significant positive result on annual modulation, still requiring confirmation. For such a goal, it is mandatory to reach very low threshold in energy (at or below the keV level), very low radioactive background (at a few counts/keV/kg/day), and high detection mass (at or above the 100 kg scale). One of the most relevant technical issues is the optimization of the crystal intrinsic scintillation light yield and the efficiency of the light collecting system for large mass crystals. In the frame of the ANAIS (Annual modulation with NaI Scintillators) dark matter search project large NaI(Tl) crystals from different providers coupled to two photomultiplier tubes (PMTs) have been tested at the Canfranc Underground Laboratory. In this paper we present the estimates of the NaI(Tl) scintillation light collected using full-absorption peaks at very low energy from external and internal sources emitting gammas/electrons, and single-photoelectron events populations selected by using very low energy pulses tails. Outstanding scintillation light collection at the level of 15 photoelectrons/keV can be reported for the final design and provider chosen for ANAIS detectors. Taking into account the quantum efficiency of the PMT units used, the intrinsic scintillation light yield in these NaI(Tl) crystals is above 40 photons/keV for energy depositions in the range from 3 up to 25 keV. This very high light output of ANAIS crystals allows triggering below 1 keV, which is very important in order to increase the sensitivity in the direct detection of dark matter.

  20. GDP growth and the yield curvature

    DEFF Research Database (Denmark)

    Møller, Stig Vinther

    2014-01-01

    This paper examines the forecastability of GDP growth using information from the term structure of yields. In contrast to previous studies, the paper shows that the curvature of the yield curve contributes with much more forecasting power than the slope of yield curve. The yield curvature also...... predicts bond returns, implying a common element to time-variation in expected bond returns and expected GDP growth....

  1. Photoelectron spectroscopy of self-assembled monolayers of molecular switches on noble metal surfaces; Photoelektronenspektroskopie selbstorganisierter Adsorbatschichten aus molekularen Schaltern auf Edelmetalloberflaechen

    Energy Technology Data Exchange (ETDEWEB)

    Heinemann, Nils

    2012-09-12

    Self-assembled monolayers (SAMs) of butanethiolate (C4) on single crystalline Au(111) surfaces were prepared by adsorption from solution. The thermally activated desorption behaviour of the C4 molecules from the gold substrate was examined by qualitative thermal desorption measurements (TDM), through this a desorption temperature T{sub Des}=473 K could be determined. With this knowledge, it was possible to produce samples of very good surface quality, by thermal treatment T{sub Sample}yielded different adsorption geometries of C4 molecules on Au(111). The ex situ preparation scheme produced samples in p x {radical}(3) and p(4 x 4) phases, the high coverage ({radical}(3) x {radical}(3))R30 phase was not observed. The focus of the spectroscopy of C4/Au was on the samples of the p x {radical}(3) phase using two-photon photoemission spectroscopy (2PPE). The spectra revealed clear signatures of two unoccupied resonance states at energies E-E{sub F}=3.7 eV and 3.9 eV. The low-energy state was assigned to the characteristic {sigma}*-resonance associated with the Au-S bond of the thiolate. The energy of the other resonance state agreed well with an interface state reported before for SAMs of an other alkanethiol on Au(111) in a densely packed phase. Furthermore the 2PPE data indicated that the high quality of the ex situ prepared SAMs supported the formation of image potential states. The reversible photo- and thermally activated isomerization of the molecular switch 3-(4-(4-Hexyl-phenylazo)-phenoxy)-propane-1-thiol (ABT), deposited by self-assembly from solution on Au(111), was examined using laser-based photoelectron spectroscopy. Differences in the molecular dipole moment characteristic for the trans and the cis isomer of ABT were observed via changes in the sample work function, accessible by detection of the threshold energy for photoemission. A quantitative

  2. modelling relationship between rainfall variability and yields

    African Journals Online (AJOL)

    yield models should be used for planning and forecasting the yield of millet and sorghum in the study area. Key words: modelling, rainfall, yields, millet, sorghum. INTRODUCTION. Meteorological variables, such as rainfall parameters, temperature, sunshine hours, relative humidity, and wind velocity and soil moisture are.

  3. Yield surface evolution for columnar ice

    Directory of Open Access Journals (Sweden)

    Zhiwei Zhou

    Full Text Available A series of triaxial compression tests, which has capable of measuring the volumetric strain of the sample, were conducted on columnar ice. A new testing approach of probing the experimental yield surface was performed from a single sample in order to investigate yield and hardening behaviors of the columnar ice under complex stress states. Based on the characteristic of the volumetric strain, a new method of defined the multiaxial yield strengths of the columnar ice is proposed. The experimental yield surface remains elliptical shape in the stress space of effective stress versus mean stress. The effect of temperature, loading rate and loading path in the initial yield surface and deformation properties of the columnar ice were also studied. Subsequent yield surfaces of the columnar ice have been explored by using uniaxial and hydrostatic paths. The evolution of the subsequent yield surface exhibits significant path-dependent characteristics. The multiaxial hardening law of the columnar ice was established experimentally. A phenomenological yield criterion was presented for multiaxial yield and hardening behaviors of the columnar ice. The comparisons between the theoretical and measured results indicate that this current model is capable of giving a reasonable prediction for the multiaxial yield and post-yield properties of the columnar ice subjected to different temperature, loading rate and path conditions. Keywords: Columnar ice, Multiaxial loading, Hardening rule, Path dependency, Yield criterion

  4. Fission yield data evaluation system FYDES

    International Nuclear Information System (INIS)

    Liu Tingjin

    1998-01-01

    Taking account of some features of fission yield data, to do the fission yield data evaluation conveniently, a fission yield data evaluation system FYDES has been developed for last two years. Outline of the system, data retrieval and data table standardization, data correction codes, data averaging code, simultaneous evaluation code and data fit programs were introduced

  5. Nodal yield in selective neck dissection

    DEFF Research Database (Denmark)

    Norling, Rikke; Therkildsen, Marianne H; Bradley, Patrick J

    2013-01-01

    The total lymph node yield in neck dissection is highly variable and depends on anatomical, surgical and pathological parameters. A minimum yield of six lymph nodes for a selective neck dissection (SND) as recommended in guidelines lies in the lower range of the reported clinical nodal yields...

  6. Analysis of yield advantage in mixed cropping

    NARCIS (Netherlands)

    Ranganathan, R.

    1993-01-01

    It has long been recognized that mixed cropping can give yield advantages over sole cropping, but methods that can identify such yield benefits are still being developed. This thesis presents a method that combines physiological and economic principles in the evaluation of yield advantage.

  7. Light yield of an undoped CsI crystal coupled directly to a photomultiplier tube at 77 Kelvin

    International Nuclear Information System (INIS)

    Liu, J.; Soma, A.K.; Yamashita, M.

    2016-01-01

    A light yield of 20.4 ± 0.8 photoelectrons/keV was achieved with an undoped CsI crystal coupled directly to a photomultiplier tube at 77 Kelvin. This is by far the largest yield in the world achieved with CsI crystals. An energy threshold that is several times lower than the current dark matter experiments utilizing CsI(Tl) crystals may be achievable using this technique. Together with novel CsI crystal purification methods, the technique may be used to improve the sensitivities of dark matter and coherent elastic neutrino-nucleus scattering experiments. Also measured were the scintillation light decay constants of the undoped CsI crystal at both room temperature and 77 Kelvin. The results are consistent with those in the literature.

  8. Nitrogen-doped carbon nanotubes with tunable structure and high yield produced by ultrasonic spray pyrolysis

    Science.gov (United States)

    Liu, Jian; Zhang, Yong; Ionescu, Mihnea Ioan; Li, Ruying; Sun, Xueliang

    2011-06-01

    Nitrogen-doped carbon nanotubes (CN x) were prepared by ultrasonic spray pyrolysis from mixtures of imidazole and acetonitrile. Imidazole, as an additive, was used to control the structure and nitrogen doping in CN x by adjusting its concentration in the mixtures. Scanning electron microscopy observation showed that the addition of imidazole increased the nanotube growth rate and yield, while decreased the nanotube diameter. Transmission electron microscopy study indicated that the addition of imidazole promoted the formation of a dense bamboo-like structure in CN x. X-ray photoelectron spectroscopy analysis demonstrated that the nitrogen content varied from 3.2 to 5.2 at.% in CN x obtained with different imidazole concentrations. Raman spectra study showed that the intensity ratio of D to G bands gradually increased, while that of 2D to G bands decreased, due to increasing imidazole concentration. The yield of CN x made from mixtures of imidazole and acetonitrile can reach 192 mg in 24 min, which is 15 times that of CN x prepared from only acetonitrile. The aligned CN x, with controlled nitrogen doping, tunable structure and high yield, may find applications in developing non-noble catalysts and novel catalyst supports for fuel cells.

  9. Measurements of beryllium sputtering yields at JET

    Science.gov (United States)

    Jet-Efda Contributors Stamp, M. F.; Krieger, K.; Brezinsek, S.

    2011-08-01

    The lifetime of the beryllium first wall in ITER will depend on erosion and redeposition processes. The physical sputtering yields for beryllium (both deuterium on beryllium (Be) and Be on Be) are of crucial importance since they drive the erosion process. Literature values of experimental sputtering yields show an order of magnitude variation so predictive modelling of ITER wall lifetimes has large uncertainty. We have reviewed the old beryllium yield experiments on JET and used current beryllium atomic data to produce revised beryllium sputtering yields. These experimental measurements have been compared with a simple physical sputtering model based on TRIM.SP beryllium yield data. Fair agreement is seen for beryllium yields from a clean beryllium limiter. However the yield on a beryllium divertor tile (with C/Be co-deposits) shows poor agreement at low electron temperatures indicating that the effect of the higher sputtering threshold for beryllium carbide is important.

  10. Luminescence and light yield of (Gd.sub.2./sub.Y)(Ga.sub.3./sub.Al.sub.2./sub.)O.sub.12./sub.:Pr.sup.3+./sup. single crystal scintillators

    Czech Academy of Sciences Publication Activity Database

    Lertloypanyachai, P.; Pathumrangsan, N.; Sreebunpeng, K.; Pattanaboonmee, N.; Chewpraditkul, W.; Yoshikawa, A.; Kamada, K.; Nikl, Martin

    2017-01-01

    Roč. 468, Jun (2017), s. 369-372 ISSN 0022-0248 R&D Projects: GA ČR GA16-15569S Institutional support: RVO:68378271 Keywords : (Gd 2 Y)(Ga 3 Al 2 )O 12 :Pr 3+ * photoelectron yield * luminescence * scintillation Subject RIV: BM - Solid Matter Physics ; Magnetism OBOR OECD: Condensed matter physics (including formerly solid state physics, supercond.) Impact factor: 1.751, year: 2016

  11. 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

  12. X-ray photoelectron microscope with a compact x-ray source generated by line-focused laser irradiation

    International Nuclear Information System (INIS)

    Yamaguchi, N.; Okamoto, Y.; Hara, T.; Takahashi, Z.; Nishimura, Y.; Sakata, A.; Watanabe, K.; Azuma, H.

    2004-01-01

    Full text: A laboratory-sized microscopic system of x-ray photoelectrons has been developing using a compact x-ray source produced by line-focused laser irradiation. The system is a scanning type photoelectron microscope where x-ray beam is micro-focused via a Schwartzschild optics. A compact laser-plasma x-ray source has been developed with a YAG laser system, a line-focus lens system, a tape-target driving system and a debris prevention system, that was operated at repetition rate of 10 Hz or 50 Hz. X-rays were delivered along line plasma whose length was 0.6 to 11 mm with higher intensity than that from a point-focused source. Because the transition line of Al V (13.1 nm) was prominent in the soft x-ray spectrum when the Al tape target irradiated at the lower power density of 10 11 W/cm 2 , the 13.1 nm x-ray was used as an excitation source. The Schwartzschild optics was set on the beamline at a distance about 1 m from the source, which was coated with Mo/Si multilayers for 13.1 nm x-ray. The designed demagnification is 224 that was confirmed in the previous experiment. Therefore, an x-ray micro spot of sub-micron size can be formed on a sample surface when the source size is less than about 0.2 mm. Samples were set on a two-axis high-precision piezo stage mounted to a four-axis manipulator. The electron energy analyzer was a spherical capacitor analyzer with mean diameter of 279.4 mm. The electron detector was a microchannel plate (MCP) with a phosphor screen and the optical image of electrons on the exit plane of the analyzer was taken and recorded by using an ultra low dark noise CCD camera, that was suited for detection of vast photoelectrons excited by x-ray pulse of ns-order duration. We performed spatial resolution test measurements by using a GaAs wafer coated with photo-resist that formed a stripe pattern. The spatial resolution less than 3 micron has been obtained from the variation of As 3d electron intensity along the position of the GaAs sample

  13. Contribution to the study of a structure for amplifying and locating photoelectrons using jointly a vacuum tube and a semiconductor target

    International Nuclear Information System (INIS)

    Vaz de Mello, F.L.

    1975-01-01

    The problem of scintigraphic cameras is raised and a new unconventional system is described, specially designed for medical scintigraphy. A detailed bibliographical study is devoted to the various physical phenomena involved in the working of the planned camera. Its two main elements, the photoelectron concentration system and the detection targets for these electrons, are studied with a view to their construction. The bibliographical study is supplemented by an inventory of various more prospective ideas for improving the efficiency of the instrument (polycrystalline layers, electron emitter by lowering the output potential, amplifying detection targets etc...). The study and development of the photoelectron focussing system led to a device which can be used on the camera. The development of post-acceleration photoelectron detection targets also led to a diode technology perfectly adaptable to the instrument [fr

  14. Austenitic and duplex stainless steels in simulated physiological solution characterized by electrochemical and X-ray photoelectron spectroscopy studies.

    Science.gov (United States)

    Kocijan, Aleksandra; Conradi, Marjetka; Schön, Peter M

    2012-04-01

    A study of oxide layers grown on 2205 duplex stainless steel (DSS) and AISI 316L austenitic stainless steel in simulated physiological solution is presented here in order to establish the possibility of replacement of AISI 316 L with 2205 DSS in biomedical applications. The results of the potentiodynamic measurements show that the extent of the passive range significantly increased for DSS 2205 compared to AISI 316L stainless steel. Cyclic voltammetry was used to investigate electrochemical processes taking place on the steel surfaces. Oxide layers formed by electrochemical oxidation at different oxidation potentials were studied by X-ray photoelectron spectroscopy, and their compositions were analyzed as a function of depth. The main constituents on both the investigated materials were Cr- and Fe-oxides. Atomic force microscopy topography studies revealed the higher corrosion resistance of the DSS 2205 compared to the AISI 316L under the chosen experimental conditions. Copyright © 2012 Wiley Periodicals, Inc.

  15. X-ray photoelectron spectroscopy studies on Pd doped SnO2 liquid petroleum gas sensor

    Science.gov (United States)

    Phani, A. R.

    1997-10-01

    The present investigation deals with the electrical response of palladium doped tin oxide, as a means of improving the selectivity for liquid petroleum gas (LPG) in the presence of CO, CH4. The sensor element with the composition of Pd(1.5 wt %) in the base material SnO2 sintered at 800 °C, has shown a high sensitivity towards LPG with a negligible cross interference of CO and CH4 at an operating temperature of 350 °C. This greatly suggests the possibility of utilizing the sensor for the detection of LPG. X-ray photoelectron spectroscopy studies have been carried out to determine the possible chemical species involved in the gas-solid interaction and the enhancing mechanism of the Pd doped SnO2 sensor element, towards LPG sensitivity.

  16. 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.

  17. Core-valence coupling in the Ru 4p photoexcitation/Auger decay process: Auger-photoelectron coincidence spectroscopy study

    International Nuclear Information System (INIS)

    Gotter, R.; Siu, W.-K.; Bartynski, R. A.; Hulbert, S. L.; Wu, Xilin; Zitnik, M.; Nozoye, H.

    2000-01-01

    The N 23 VV Auger spectrum of Ru has been measured in coincidence with 4p 1/2 and with 4p 3/2 photoelectrons. Unlike other metals that exhibit bandlike Auger decays, we find that the two Auger spectra are not shifted by the difference in core level binding energies. A consistent description of these transitions and the core level line shape requires consideration of the relativistic multiplet splitting in the intermediate core hole state and two-valence-hole Auger final state. The results suggest that the large linewidth of the 4p levels is primarily due to multiplet splitting, and that an N 2 (N 3 N 45 )N 45 N 45 super-Coster-Kronig transition is only a minor decay channel. (c) 2000 The American Physical Society

  18. 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.

  19. 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.

  20. 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.

  1. Photo-electron spectroscopy using synchrotron radiation of molecular radicals and fragments produced by laser photo-dissociation

    International Nuclear Information System (INIS)

    Nahon, Laurent

    1991-01-01

    This research thesis reports the combined use of a laser and of a synchrotron radiation in order to respectively photo-dissociate a molecule and to photo-ionize fragments which are analysed by photo-electron spectroscopy. This association allows, on the one hand, radical photo-ionization to be studied, and, on the other hand, polyatomic molecule photo-dissociation to be studied. The author studied the photo-excitation and/or photo-ionization in layer 4d (resp. 3d) of atomic iodine (resp. bromine) produced almost complete laser photo-dissociation of I 2 (resp. Br 2 ). He discuses the processes of relaxation of transitions from valence 4d to 5p (resp. 3d to 4p) which occur either by direct self-ionization or by resonant Auger effect, and reports the study of photo-dissociation of s-tetrazine (C 2 N 4 H 2 ) [fr

  2. X-ray photoelectron spectroscopy analysis of cleaning procedures for synchrotron radiation beamline materials at the Advanced Photon Source

    International Nuclear Information System (INIS)

    Li, Y.; Ryding, D.; Liu, C.; Kuzay, T.M.; McDowell, M.W.; Rosenberg, R.A.

    1994-01-01

    TZM (a high temperature molybdenum alloy), machinable tungsten, and 304 stainless steel were cleaned using environmentally safe, commercially available cleaning detergents. The surface cleanliness was evaluated by x-ray photoelectron spectroscopy (XPS). It was found that a simple alkaline detergent is very effective at removal of organic and inorganic surface contaminants or foreign particle residue from machining processes. The detergent can be used with ultrasonic agitation at 140 F to clean the TZM molybdenum, machinable tungsten, and 304 stainless steel. A citric-acid-based detergent was also found to be effective at cleaning metal oxides, such as iron oxide, molybdenum oxide, as well as tungsten oxides at mild temperatures with ultrasonic agitation, and it can be used to replace strong inorganic acids to improve cleaning safety and minimize waste disposal and other environmental problems. The efficiency of removing the metal oxides depends on both cleaning temperature and time

  3. Ag induced modifications on WO3 films studied by AFM, Raman and x-ray photoelectron spectroscopy

    International Nuclear Information System (INIS)

    Bittencourt, C; Llobet, E; Ivanov, P; Vilanova, X; Correig, X; Silva, M A P; Nunes, L A O; Pireaux, J J

    2004-01-01

    In this paper, the morphology, vibrational spectra and electronic properties of WO 3 films loaded with different levels of Ag, prepared by screen printing onto Si substrates and annealed in air at 600 deg. C were investigated. AFM micrography showed that the films are grain-like, and the grain size increases with an increase in the Ag loading level. Raman spectroscopy results showed the formation of a AgWO 3 bronze structure that results in a more stable film. X-ray photoelectron spectroscopy results showed that the Ag concentration is 1.8 times higher than the nominal concentration indicating that Ag diffuses to the WO 3 grain surface. No strong electronic interaction between the Ag clusters and the WO 3 grains was found. Sensors fabricated with the WO 3 : Ag films exhibited a significant increase in their sensitivity and selectivity towards NO 2 detection

  4. 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.

  5. Band alignments at interface of ZnO/FAPbI3 heterojunction by X-ray photoelectron spectroscopy

    Science.gov (United States)

    Ding, Tao; Li, Ruifeng; Kong, Weiguang; Zhang, Bingpo; Wu, Huizhen

    2015-12-01

    The band alignments at the interface of ZnO/HC(NH2)2PbI3 (FAPbI3) heterojunction were measured by X-ray photoelectron spectroscopy. Core levels of Pb 5d and Zn 3d were utilized to align the valence-band offset (VBO). The VBO was determined to be 1.86 ± 0.30 eV, and the conduction-band offset (CBO) was concluded to be 0.05 ± 0.30 eV, manifesting that the ZnO/FAPbI3 heterojunction has a type-I band alignment. The data of the band alignment of ZnO/FAPbI3 heterojunction may benefit the design and development of novel perovskite solar cells (PSCs).

  6. X-ray photoelectron spectroscopy study of interaction of Np5+ with goethite α-FeOOH

    Directory of Open Access Journals (Sweden)

    Teterin Yury A.

    2005-01-01

    Full Text Available Neptunyl NpO2n+ complexes on the surface of goethite α-(FeOOH resulted from the interaction of neptunyl nitrate (NpO2NO3, 10-6 M in the aqueous media with the background electrolyte (NaClO4 of ionic force 0.1 M (pH = 7.0 ± 0.2 were formed and studied with the X-ray photo electron spectroscopy. The X-ray photoelectron spectroscopy ionic and elemental quantitative analysis of the goethite and products of its interaction with neptunyl and plutonyl nitrates was carried out. It was established that during the studied neptunyl nitrate - goethite interaction Np4+ and Np6+ com pounds did not to form, while the complexes of neptunyl group NpO21+ containing Np5+ ions with oxygen, water and/or car bon ate ions in the equatorial planes did.

  7. 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.

  8. 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.

  9. Band alignment of TiO2/FTO interface determined by X-ray photoelectron spectroscopy: Effect of annealing

    Directory of Open Access Journals (Sweden)

    Haibo Fan

    2016-01-01

    Full Text Available The energy band alignment between pulsed-laser-deposited TiO2 and FTO was firstly characterized using high-resolution X-ray photoelectron spectroscopy. A valence band offset (VBO of 0.61 eV and a conduction band offset (CBO of 0.29 eV were obtained across the TiO2/FTO heterointerface. With annealing process, the VBO and CBO across the heterointerface were found to be -0.16 eV and 1.06 eV, respectively, with the alignment transforming from type-I to type-II. The difference in the band alignment is believed to be dominated by the core level down-shift of the FTO substrate, which is a result of the oxidation of Sn. Current-voltage test has verified that the band alignment has a significant effect on the current transport of the heterojunction.

  10. 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.

  11. X-ray photoelectron spectroscopy study of the initial oxidation of uranium metal in oxygen+water-vapour mixtures

    International Nuclear Information System (INIS)

    Allen, G.C.; Tucker, P.M.; Lewis, R.A.

    1984-01-01

    X-ray photoelectron spectroscopy (X.p.s.) has been used to study the chemical nature of the oxide film initially produced on clean uranium metal in oxygen + water-vapour atmospheres. The rate of reaction has been monitored and the nature of the surface film determined. From a consideration of the O 1s and U 4f X.p. spectra it has been possible to advance a mechanism which explains the complex nature of the surface oxide and the lack of satellite structure in the spectra. This is postulated to be a consequence of the way in which OH - is involved in the growth of the oxide and the presence of hydrogen in the surface film. The presence of oxygen retards the water oxidation reaction by inhibiting the decomposition of water vapour at the gas/oxide interface. (author)

  12. Envelope composition of Salmonella typhimurium 395 MS and 395 MR10 assesses by X-ray photoelectron spectroscopy (ESCA)

    International Nuclear Information System (INIS)

    Magnusson, K.F.; Johansson, L.

    1977-01-01

    The Salmonella typhimurium 395 MS and MR10 bacteria and lipopolysaccharide (LPS) were studied by X-ray photoelectron spectroscopy with the aid of the ESCA technique for the in situ analysis of chemical elements (C, O and N) at the surface. The nitrogen peak was large in both bacteria implying the presence of protein in the very outer part of the bacterial envelope due to the surface-sensitive measurement. The nitrogen peak was larger in the MR10 than in the MS bacteria, presumably reflecting an increased exposure of proteins concomitantly with the reduction of the LPS in MR10. After corrections for background and sensitivity of detection the relative intensities of the peaks agreed appreciably well with the proposed chemical structure of the LPS, indicating that at least semiquantitative relationships between the elements were obtained. (author)

  13. Calculation of X-ray photoelectron spectra with the use of the normalized elimination of the small component method

    International Nuclear Information System (INIS)

    Klooster, Rob; Broer, Ria; Filatov, Michael

    2012-01-01

    Graphical abstract: A newly developed method for the calculation of X-ray photoelectron spectra (XPS) is applied to study the 4p and 5p XPS of ytterbium phosphide YbP. The results of the calculations suggest an alternative interpretation of the satellite peaks in the 4p XPS of YbP. Highlights: ► A new method based on NESC for calculating XPS spectra has been developed. ►Results for U 5+ show excellent agreement compared to fully relativistic methods. ►Large systems can be treated at the computational cost of non-relativistic methods. ►Calculations on YbP show the effects of the crystal environment on the spectra. ►Alternative interpretation of the satellite peaks in the 4p XPS of YbP. - Abstract: A method for the calculation of X-ray photoelectron spectra (XPS) based on the use of the normalized elimination of the small component (NESC) formalism combined with the restricted active space state interaction (RASSI) approach with atomic mean field integrals (AMFI) is developed. Benchmark calculations carried out for the 4f XPS of U 5+ show that the NESC/RASSI/AMFI method is capable of reproducing the results of the full 4-component relativistic calculations with excellent accuracy. The NESC/RASSI/AMFI method is applied to study the 4p and 5p XPS of ytterbium phosphide YbP. The results of the calculations suggest an alternative interpretation of the satellite peaks in the 4p XPS of YbP.

  14. 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.

  15. Alumina Yield in the Bayer Process

    Science.gov (United States)

    Den Hond, R.

    The alumina industry has historically been able to reduce alumina production costs, by increasing the liquor alumina yield. To know the potential for further yield increases, the phase diagram of the ternary system Na2O-Al2O -H2O at various temperature levels was analysed. It was found that the maximum theorical precipitation alumina yield is 160 g/l, while that for digestion was calculated to be 675 g/l.

  16. Disagreement about inflation and the yield curve

    OpenAIRE

    Ehling, P; Gallmeyer, M; Heyerdahl-Larsen, C; Illeditsch, P

    2018-01-01

    We show that inflation disagreement, not just expected inflation, has an impact on nominal interest rates. In contrast to expected inflation, which mainly affects the wedge between real and nominal yields, inflation disagreement affects nominal yields predominantly through its impact on the real side of the economy. We show theoretically and empirically that inflation disagreement raises real and nominal yields and their volatilities. Inflation disagreement is positively related to consumers’...

  17. Yield stress determination of a physical gel

    DEFF Research Database (Denmark)

    Hvidt, Søren

    2013-01-01

    Pluronic F127 solutions form gels in water with high elastic moduli. Pluronic gels can, however, only withstand small deformations and stresses. Different steady shear and oscillatory methods traditionally used to determine yield stress values are compared. The results show that the yield stresse...... values of these gels depend on test type and measurement time, and no absolute yield stress value can be determined for these physical gels....

  18. Equity Volatility and Corporate Bond Yields

    OpenAIRE

    John Y. Campbell; Glen B. Taksler

    2002-01-01

    This paper explores the effect of equity volatility on corporate bond yields. Panel data for the late 1990s show that idiosyncratic firm-level volatility can explain as much cross-sectional variation in yields as can credit ratings. This finding, together with the upward trend in idiosyncratic equity volatility documented by Campbell, Lettau, Malkiel, and Xu (2001), helps to explain recent increases in corporate bond yields. The definitive version is available at www.blackwell-synergy.com.

  19. Improved Method of Fluorescence Quantum Yield Determination.

    Science.gov (United States)

    Nawara, Krzysztof; Waluk, Jacek

    2017-09-05

    In the most widely used procedure for luminescence quantum yield determination, absorption and emission spectra are measured on two different instruments. This leads to errors caused by wavelength misalignment and different monochromator characteristics of the spectrophotometer and the spectrofluorometer. These errors can be avoided using a method for fluorescence quantum yield determination that relies on simultaneous absorption and fluorescence emission (SAFE) measurement using a single commercial spectrofluorometer. The method's performance is compared with the standard routinely used procedure for the relative quantum yield determination. The advantages of SAFE measurement are discussed. The proposed novel approach eliminates a number of potential errors in quantum yield determination protocol and provides higher accuracy.

  20. Status of fission product yield data

    International Nuclear Information System (INIS)

    Cuninghame, J.G.

    1978-01-01

    The topics covered in this paper are: (a) cumulative yields in thermal neutron fission and in fast fission up to 14 MeV incident neutron energy, (b) dependence of the yields on incident neutron energy and spectrum, (c) independent yields, (d) charge dispersion and distribution, and (e) yields of light particles from ternary fission. The paper reviews information on these subjects for fission of actinides from 232 Th upwards with special emphasis on data published since the 1973 Bologna FPND Panel, compares data sets, and discusses the gaps still to be found in them. (author)