WorldWideScience

Sample records for crystallization electronic resource

  1. Selection of Electronic Resources.

    Science.gov (United States)

    Weathers, Barbara

    1998-01-01

    Discusses the impact of electronic resources on collection development; selection of CD-ROMs, (platform, speed, video and sound, networking capability, installation and maintenance); selection of laser disks; and Internet evaluation (accuracy of content, authority, objectivity, currency, technical characteristics). Lists Web sites for evaluating…

  2. Electron spectroscopy of crystals

    CERN Document Server

    Nemoshkalenko, V V

    1979-01-01

    This book is conceived as a monograph, and represents an up-to-date collection of information concerning the use of the method of X-ray photoelectron spec­ troscopy in the study of the electron structure of crystals, as well as a personal interpretation of the subject by the authors. In a natural way, the book starts in Chapter 1 with a recapitulation of the fundamentals of the method, basic relations, principles of operation, and a com­ parative presentation of the characteristics and performances of the most com­ monly used ESCA instruments (from the classical ones-Varian, McPherson, Hewlett Packard, and IEEE-up to the latest model developed by Professor Siegbahn in Uppsala), and continues with a discussion of some of the difficult problems the experimentalist must face such as calibration of spectra, prepara­ tion of samples, and evaluation of the escape depth of electrons. The second chapter is devoted to the theory of photoemission from crystal­ line solids. A discussion of the methods of Hartree-Fo...

  3. Electronic Resource Management Systems

    Directory of Open Access Journals (Sweden)

    Mark Ellingsen

    2004-10-01

    Full Text Available Computer applications which deal with electronic resource management (ERM are quite a recent development. They have grown out of the need to manage the burgeoning number of electronic resources particularly electronic journals. Typically, in the early years of e-journal acquisition, library staff provided an easy means of accessing these journals by providing an alphabetical list on a web page. Some went as far as categorising the e-journals by subject and then grouping the journals either on a single web page or by using multiple pages. It didn't take long before it was recognised that it would be more efficient to dynamically generate the pages from a database rather than to continually edit the pages manually. Of course, once the descriptive metadata for an electronic journal was held within a database the next logical step was to provide administrative forms whereby that metadata could be manipulated. This in turn led to demands for incorporating more information and more functionality into the developing application.

  4. Electronic Resource Management and Design

    Science.gov (United States)

    Abrams, Kimberly R.

    2015-01-01

    We have now reached a tipping point at which electronic resources comprise more than half of academic library budgets. Because of the increasing work associated with the ever-increasing number of e-resources, there is a trend to distribute work throughout the library even in the presence of an electronic resources department. In 2013, the author…

  5. Electronic Resource Management and Design

    Science.gov (United States)

    Abrams, Kimberly R.

    2015-01-01

    We have now reached a tipping point at which electronic resources comprise more than half of academic library budgets. Because of the increasing work associated with the ever-increasing number of e-resources, there is a trend to distribute work throughout the library even in the presence of an electronic resources department. In 2013, the author…

  6. Electronic polarizability of ionic crystals

    Science.gov (United States)

    Ivanov, O. V.; Maksimov, E. G.

    1992-01-01

    The electronic polarizability of ionic crystals is considered in the framework of the Gordon-Kim electron gas model. First a polarization of a single ion is calculated by using the modified Sternheimer approach. Then the interaction between two ions with dipole momenta p n and p n' is studied using the Thomas-Fermi type approximation for the energy functional. By expressing the total energy as a functional of the polarizations p n instead of an electric field E and minimizing this functional with respect to p n linear equations for p n are obtained. Solution of these equations leads to the Clausius-Mossotti type expression for dielectric constant ∈ ∞ of ionic crystals in terms of a cell polarizability. It is shown that the cell polarizability can not be expressed in terms of an averaged ion polarizability only but includes also some non-local contributions due to a short-range interactions between ions. Numerical calculations lead to a good agreement with experimental data for a number of ionic crystals.

  7. Crystal fields and conduction electrons in praseodymium

    DEFF Research Database (Denmark)

    Clausen, K.N.; Aagaard Sørensen, S.; McEwen, K.A.

    1995-01-01

    The interactions between the crystal-field excitations, the phonons and the conduction electrons in Pr have been studied further. The low-energy satellites to the crystal-field excitations, which are believed to be associated with propagating paramagnon modes in the conduction-electron gas, appear...

  8. Electron crystallography of three dimensional protein crystals

    NARCIS (Netherlands)

    Georgieva, Dilyana

    2008-01-01

    This thesis describes an investigation of the potential of electron diffraction for studying three dimensional sub-micro-crystals of proteins and pharmaceuticals. A prerequisite for using electron diffraction for structural studies is the predictable availability of tiny crystals. A method for grow

  9. Managing electronic resources a LITA guide

    CERN Document Server

    Weir, Ryan O

    2012-01-01

    Informative, useful, current, Managing Electronic Resources: A LITA Guide shows how to successfully manage time, resources, and relationships with vendors and staff to ensure personal, professional, and institutional success.

  10. Electronic Resources Management Project Presentation 2012

    KAUST Repository

    Ramli, Rindra M.

    2012-11-05

    This presentation describes the electronic resources management project undertaken by the KAUST library. The objectives of this project is to migrate information from MS Sharepoint to Millennium ERM module. One of the advantages of this migration is to consolidate all electronic resources into a single and centralized location. This would allow for better information sharing among library staff.

  11. Implementing CORAL: An Electronic Resource Management System

    Science.gov (United States)

    Whitfield, Sharon

    2011-01-01

    A 2010 electronic resource management survey conducted by Maria Collins of North Carolina State University and Jill E. Grogg of University of Alabama Libraries found that the top six electronic resources management priorities included workflow management, communications management, license management, statistics management, administrative…

  12. Implementing CORAL: An Electronic Resource Management System

    Science.gov (United States)

    Whitfield, Sharon

    2011-01-01

    A 2010 electronic resource management survey conducted by Maria Collins of North Carolina State University and Jill E. Grogg of University of Alabama Libraries found that the top six electronic resources management priorities included workflow management, communications management, license management, statistics management, administrative…

  13. Flow-Directed Crystallization for Printed Electronics.

    Science.gov (United States)

    Qu, Ge; Kwok, Justin J; Diao, Ying

    2016-12-20

    The solution printability of organic semiconductors (OSCs) represents a distinct advantage for materials processing, enabling low-cost, high-throughput, and energy-efficient manufacturing with new form factors that are flexible, stretchable, and transparent. While the electronic performance of OSCs is not comparable to that of crystalline silicon, the solution processability of OSCs allows them to complement silicon by tackling challenging aspects for conventional photolithography, such as large-area electronics manufacturing. Despite this, controlling the highly nonequilibrium morphology evolution during OSC printing remains a challenge, hindering the achievement of high electronic device performance and the elucidation of structure-property relationships. Many elegant morphological control methodologies have been developed in recent years including molecular design and novel processing approaches, but few have utilized fluid flow to control morphology in OSC thin films. In this Account, we discuss flow-directed crystallization as an effective strategy for controlling the crystallization kinetics during printing of small molecule and polymer semiconductors. Introducing the concept of flow-directed crystallization to the field of printed electronics is inspired by recent advances in pharmaceutical manufacturing and flow processing of flexible-chain polymers. Although flow-induced crystallization is well studied in these areas, previous findings may not apply directly to the field of printed electronics where the molecular structures (i.e., rigid π-conjugated backbone decorated with flexible side chains) and the intermolecular interactions (i.e., π-π interactions, quadrupole interactions) of OSCs differ substantially from those of pharmaceuticals or flexible-chain polymers. Another critical difference is the important role of solvent evaporation in open systems, which defines the flow characteristics and determines the crystallization kinetics and pathways. In

  14. Resource Letter: TE-1: Teaching electronics

    Science.gov (United States)

    Henry, Dennis C.

    2002-01-01

    This Resource Letter examines the evolution, roles, and content of courses in electronics in the undergraduate physics curriculum, and provides a guide to resources for faculty teaching such courses. It concludes with a brief section addressing problems of electromagnetic interference in electronic systems, and provides an introduction to the literature and practice of electromagnetic compatibility. I have included textbooks, reference books, articles, collections of laboratory experiments and projects, sources of equipment and parts, software packages, videos, and websites.

  15. Electronic Resources Management System: Recommendation Report 2017

    KAUST Repository

    Ramli, Rindra M.

    2017-05-01

    This recommendation report provides an overview of the selection process for the new Electronic Resources Management System. The library has decided to move away from Innovative Interfaces Millennium ERM module. The library reviewed 3 system as potential replacements namely: Proquest 360 Resource Manager, Ex Libris Alma and Open Source CORAL ERMS. After comparing and trialling the systems, it was decided to go for Proquest 360 Resource Manager.

  16. Scattering of ultrarelativistic electrons in ultrathin crystals

    Science.gov (United States)

    Shul'ga, N. F.; Shulga, S. N.

    2017-06-01

    Quantum theory is proposed of high energy electrons scattering in ultrathin crystals. This theory is based upon a special representation of the scattering amplitude in the form of an integral over the surface surrounding the crystal, and on the spectral method of determination of the wave function. The comparison is performed of quantum and classical differential scattering cross-sections in the transitional range of crystal thicknesses, from those at which the channeling phenomenon is not developed up to those at which it is established. It is shown that in this thickness range the quantum scattering cross-section, unlike the classical one, contains sharp peaks corresponding to some specific scattering angles, that is connected with the diffraction of the incident plane wave onto the periodically distributed crystal atomic strings. It is shown that the value of the scattering cross-section in the peaks varies periodically with the change of the target thickness. We note that this must lead to a new interference effect in radiation that is connected with the rearrangement of incident wave packet in transitional area of crystal thicknesses.

  17. Library Training to Promote Electronic Resource Usage

    DEFF Research Database (Denmark)

    Frandsen, Tove Faber; Tibyampansha, Dativa; Ibrahim, Glory

    2017-01-01

    Purpose: Increasing the usage of electronic resources is an issue of concern for many libraries all over the world. Several studies stress the importance of information literacy and instruction in order to increase the usage. Design/methodology/approach: The present article presents the results...

  18. Reviewing the Electronic Resources & Libraries Conference

    Science.gov (United States)

    Tijerina, Bonnie

    2008-01-01

    The third Electronic Resources & Libraries (ER&L) conference gathered at Georgia Institute of Technology's Global Learning and Conference Center in Atlanta, Georgia, March 18-21, 2008. Over 360 attendees, from six countries and from 80% of the United States, represented their libraries and organizations resulting in a diverse and…

  19. Making sense of the electronic resource marketplace: trends in health-related electronic resources.

    Science.gov (United States)

    Blansit, B D; Connor, E

    1999-07-01

    Changes in the practice of medicine and technological developments offer librarians unprecedented opportunities to select and organize electronic resources, use the Web to deliver content throughout the organization, and improve knowledge at the point of need. The confusing array of available products, access routes, and pricing plans makes it difficult to anticipate the needs of users, identify the top resources, budget effectively, make sound collection management decisions, and organize the resources effectively and seamlessly. The electronic resource marketplace requires much vigilance, considerable patience, and continuous evaluation. There are several strategies that librarians can employ to stay ahead of the electronic resource curve, including taking advantage of free trials from publishers; marketing free trials and involving users in evaluating new products; watching and testing products marketed to the clientele; agreeing to beta test new products and services; working with aggregators or republishers; joining vendor advisory boards; benchmarking institutional resources against five to eight competitors; and forming or joining a consortium for group negotiating and purchasing. This article provides a brief snapshot of leading biomedical resources; showcases several libraries that have excelled in identifying, acquiring, and organizing electronic resources; and discusses strategies and trends of potential interest to biomedical librarians, especially those working in hospital settings.

  20. Mineral resource of the month: cultured quartz crystal

    Science.gov (United States)

    ,

    2008-01-01

    The article presents information on cultured quartz crystals, a mineral used in mobile phones, computers, clocks and other devices controlled by digital circuits. Cultured quartz, which is synthetically produced in large pressurized vessels known as autoclaves, is useful in electronic circuits for precise filtration, frequency control and timing for consumer and military use. Several ingredients are used in producing cultured quartz, including seed crystals, lascas, a solution of sodium hydroxide or sodium carbonate, lithium salts and deionized water.

  1. Electronic resource management systems a workflow approach

    CERN Document Server

    Anderson, Elsa K

    2014-01-01

    To get to the bottom of a successful approach to Electronic Resource Management (ERM), Anderson interviewed staff at 11 institutions about their ERM implementations. Among her conclusions, presented in this issue of Library Technology Reports, is that grasping the intricacies of your workflow-analyzing each step to reveal the gaps and problems-at the beginning is crucial to selecting and implementing an ERM. Whether the system will be used to fill a gap, aggregate critical data, or replace a tedious manual process, the best solution for your library depends on factors such as your current soft

  2. Simulations of electron channeling in bent silicon crystal

    CERN Document Server

    Sushko, G B; Korol, A V; Greiner, Walter; Solov'yov, A V; Polozkov, R G; Ivanov, V K

    2013-01-01

    We report on the results of theoretical simulations of the electron channeling in a bent silicon crystal. The dynamics of ultra-relativistic electrons in the crystal is computed using the newly developed part [1] of the MBN Explorer package [2,3], which simulates classical trajectories of in a crystalline medium by integrating the relativistic equations of motion with account for the interaction between the projectile and crystal atoms. A Monte Carlo approach is employed to sample the incoming electrons and to account for thermal vibrations of the crystal atoms. The electron channeling along Si(110) crystallographic planes are studied for the projectile energies 195--855 MeV and different curvatures of the bent crystal.

  3. Electronic Resource Management System. Vernetzung von Lizenzinformationen

    Directory of Open Access Journals (Sweden)

    Michaela Selbach

    2014-12-01

    Full Text Available In den letzten zehn Jahren spielen elektronische Ressourcen im Bereich der Erwerbung eine zunehmend wichtige Rolle: Eindeutig lässt sich hier ein Wandel in den Bibliotheken (fort vom reinen Printbestand zu immer größeren E-Only-Beständen feststellen. Die stetig wachsende Menge an E-Ressourcen und deren Heterogenität stellt Bibliotheken vor die Herausforderung, die E-Ressourcen effizient zu verwalten. Nicht nur Bibliotheken, sondern auch verhandlungsführende Institutionen von Konsortial- und Allianzlizenzen benötigen ein geeignetes Instrument zur Verwaltung von Lizenzinformationen, welches den komplexen Anforderungen moderner E-Ressourcen gerecht wird. Die Deutsche Forschungsgemeinschaft (DFG unterstützt ein Projekt des Hochschulbibliothekszentrums des Landes Nordrhein-Westfalen (hbz, der Universitätsbibliothek Freiburg, der Verbundzentrale des Gemeinsamen Bibliotheksverbundes (GBV und der Universitätsbibliothek Frankfurt, in dem ein bundesweit verfügbares Electronic Ressource Managementsystem (ERMS aufgebaut werden soll. Ein solches ERMS soll auf Basis einer zentralen Knowledge Base eine einheitliche Nutzung von Daten zur Lizenzverwaltung elektronischer Ressourcen auf lokaler, regionaler und nationaler Ebene ermöglichen. Statistische Auswertungen, Rechteverwaltung für alle angeschlossenen Bibliotheken, kooperative Datenpflege sowie ein über standardisierte Schnittstellen geführter Datenaustausch stehen bei der Erarbeitung der Anforderungen ebenso im Fokus wie die Entwicklung eines Daten- und Funktionsmodells. In the last few years the importance of electronic resources in library acquisitions has increased significantly. There has been a shift from mere print holdings to both e- and print combinations and even e-only subscriptions. This shift poses a double challenge for libraries: On the one hand they have to provide their e-resource collections to library users in an appealing way, on the other hand they have to manage these

  4. Utilization of electronic information resources by academic staff at ...

    African Journals Online (AJOL)

    Utilization of electronic information resources by academic staff at Makerere University. ... AFRICAN JOURNALS ONLINE (AJOL) · Journals · Advanced Search ... It examined the academic staff awareness of the resources available, the types ...

  5. Crystal structure from one-electron theory

    DEFF Research Database (Denmark)

    Skriver, H. L.

    1985-01-01

    The authors have studied the crystal structure of all the 3d, 4d, and 5d transition metals at zero pressure and temperature by means of the linear muffin-tin orbital method and Andersen's force theorem. They find that, although the structural energy differences seem to be overestimated by the the......The authors have studied the crystal structure of all the 3d, 4d, and 5d transition metals at zero pressure and temperature by means of the linear muffin-tin orbital method and Andersen's force theorem. They find that, although the structural energy differences seem to be overestimated...... by the theory, the predicted crystal structures are in accord with experiment in all cases except 79Au. In addition, they have investigated the effect of pressure upon the alkali metals (3Li, 11Na, 37Rb, 55Cs) and selected lanthanide metals (57La, 58Ce, 71Lu) and actinide metals (90Th, 91Pa). In these cases...

  6. Effectiveness Analysis of Electronic Resources at the Hacettepe University

    OpenAIRE

    2011-01-01

    It is important to collect and analyze the usage data of electronic databases and periodicals in order to make policies regarding the composition, improvement and more extensive utilization of electronic resources of libraries. The aim of this study is to investigate how efficiently the full text accessible electronic resources of Hacettepe University Libraries are used. For this purpose the usage data obtained from COUNTER Software regarding the electronic databases to which Hacettepe Univer...

  7. The Study of Analytical Model of Library Electronic Resources Usage-A Case of Medical Electronic Resources

    OpenAIRE

    Chung-Yen Yu; Jiann-Cherng Shieh

    2014-01-01

    With the advents of internet, the importance of electronic resources is growing. Due to the increasing expensiveness of electronic resources, university libraries normally received budgets from parent institutions annually. They necessarily applied effective and systematic methods for decision making in electronic resources purchase or re-subscription. However, there are some difficulties in practices: First of all, libraries are unable to receive user records; second, the COUNTER statistics ...

  8. Overview of electron crystallography of membrane proteins: crystallization and screening strategies using negative stain electron microscopy.

    Science.gov (United States)

    Nannenga, Brent L; Iadanza, Matthew G; Vollmar, Breanna S; Gonen, Tamir

    2013-01-01

    Electron cryomicroscopy, or cryoEM, is an emerging technique for studying the three-dimensional structures of proteins and large macromolecular machines. Electron crystallography is a branch of cryoEM in which structures of proteins can be studied at resolutions that rival those achieved by X-ray crystallography. Electron crystallography employs two-dimensional crystals of a membrane protein embedded within a lipid bilayer. The key to a successful electron crystallographic experiment is the crystallization, or reconstitution, of the protein of interest. This unit describes ways in which protein can be expressed, purified, and reconstituted into well-ordered two-dimensional crystals. A protocol is also provided for negative stain electron microscopy as a tool for screening crystallization trials. When large and well-ordered crystals are obtained, the structures of both protein and its surrounding membrane can be determined to atomic resolution.

  9. Some Chemical and Electronic Considerations of Solid State Semiconductor Crystals.

    Science.gov (United States)

    Hinitz, Herman J.

    1986-01-01

    Describes the trend toward the use of electronic instrumentation to monitor and measure various parameters in chemical reactions. Stresses that a knowledge of the operational relationships involved in such instruments is essential for students beginning in science. Discusses electrostatic charges, semiconductor crystals, electronic conductors,…

  10. Electron Crystallographic Study on Structure Determination for Minute Crystals

    Institute of Scientific and Technical Information of China (English)

    LI Fanghua; FAN Haifu; WAN Zhenghua; HU Jianjun; TANG Dong

    2007-01-01

    @@ In the 1970s the development of high-resolution electron microscopy (HREM) provided a new approach to structure determination for minute crystals, which is thoroughly different from the diffraction methods.However, the previous method of trial and error has its own limits, such as some preliminary structural information must be known in advance; the crystals must be sufficient strong under the electron beam irradiation;and not all atoms can be seen in the image. Two ideas were proposed to initiate the present research project:one is to transform an arbitrary image into the crystal structure map, and the other is to enhance the image resolution by combining the information contained in the image and the corresponding electron diffraction pattern. These ideas have been realized via the combination of electron microscopy and diffraction crystallography.

  11. The Role of the Acquisitions Librarian in Electronic Resources Management

    Science.gov (United States)

    Pomerantz, Sarah B.

    2010-01-01

    With the ongoing shift to electronic formats for library resources, acquisitions librarians, like the rest of the profession, must adapt to the rapidly changing landscape of electronic resources by keeping up with trends and mastering new skills related to digital publishing, technology, and licensing. The author sought to know what roles…

  12. On coherent radiation by relativistic electrons in ultrathin crystals

    Energy Technology Data Exchange (ETDEWEB)

    Shul' ga, N.F., E-mail: shulga@kipt.kharkov.ua [National Science Center “Kharkov Institute of Physics and Technology”, 1, Akademicheskaya str., Kharkov 61108 (Ukraine); Karazin Kharkov National University, 31, Kurchatov ave., Kharkov 61108 (Ukraine); Shul' ga, S.N. [National Science Center “Kharkov Institute of Physics and Technology”, 1, Akademicheskaya str., Kharkov 61108 (Ukraine); Karazin Kharkov National University, 31, Kurchatov ave., Kharkov 61108 (Ukraine)

    2014-08-22

    A quantitative theory of the radiation process by ultrarelativistic electrons in ultrathin crystals is proposed. The theory is based upon the factorization theorem of the radiation cross-section and upon the description of the scattering process on the basis of the eikonal approximation of quantum electrodynamics. The conditions are obtained, under which the effect of radiation suppression in ultrathin crystals must take place. It is shown that these conditions may be fulfilled at the interaction of electrons with the energy accessible on CERN accelerator with ultrathin silicon crystals. Since the last years one can produce such crystals for the experiments in high energy physics. This opens new possibilities in study of interaction of high energy particles with matter.

  13. Electronic Bands Behaviour at Sinusoidal Potential Presence of Incommensurate Crystals

    OpenAIRE

    Vlokh R.; Vlokh O.; Lukiyanets B.

    2004-01-01

    On the basis of solving the Schrodinger and Mathieu equations, for the case of crystal field perturbed by one-dimensional sinusoidal potential of the modulated phase in uniaxial ferroelectrics, it has been shown that the positions of electronic levels are sensitive to the ratio of periods of the crystal field and the perturbation potential. Considering the energy states as prototypes of bands normalized by perturbation, one can come to the conclusion that the level of the states is the same a...

  14. Resonance electronic Raman scattering in rare earth crystals

    Energy Technology Data Exchange (ETDEWEB)

    Williams, G.M.

    1988-11-10

    The intensities of Raman scattering transitions between electronic energy levels of trivalent rare earth ions doped into transparent crystals were measured and compared to theory. A particle emphasis was placed on the examination of the effect of intermediate state resonances on the Raman scattering intensities. Two specific systems were studied: Ce/sup 3 +/(4f/sup 1/) in single crystals of LuPO/sub 4/ and Er/sup 3 +/(4f/sup 11/) in single crystals of ErPO/sub 4/. 134 refs., 92 figs., 33 tabs.

  15. Dynamical matrix of two-dimensional electron crystals

    Science.gov (United States)

    Côté, R.; Lemonde, M.-A.; Doiron, C. B.; Ettouhami, A. M.

    2008-03-01

    In a quantizing magnetic field, the two-dimensional electron gas has a rich phase diagram with broken translational symmetry phases such as Wigner, bubble, and stripe crystals. In this paper, we derive a method to obtain the dynamical matrix of these crystals from a calculation of the density response function performed in the generalized random-phase approximation (GRPA). We discuss the validity of our method by comparing the dynamical matrix calculated from the GRPA with that obtained from standard elasticity theory with the elastic coefficients obtained from a calculation of the deformation energy of the crystal.

  16. Electronic resources preferred by pediatric hospitalists for clinical care.

    Science.gov (United States)

    Beck, Jimmy B; Tieder, Joel S

    2015-10-01

    There is little research on pediatric hospitalists' use of evidence-based resources. The aim of this study was to determine the electronic resources that pediatric hospitalists prefer. Using a web-based survey, the authors determined hospitalists' preferred electronic resources, as well as their attitudes toward lifelong learning, practice, and experience characteristics. One hundred sixteen hospitalists completed the survey. The most preferred resource for general information, patient handouts, and treatment was UpToDate. Online search engines were ranked second for general information and patient handouts. Pediatric hospitalists tend to utilize less rigorous electronic resources such as UpToDate and Google. These results can set a platform for discussing the quality of resources that pediatric hospitalists use.

  17. Valence electron theory of graphite spheroidizing in primary crystallization

    Institute of Scientific and Technical Information of China (English)

    刘志林; 孙振国; 李志林

    1995-01-01

    Bond-length-difference (BLD) analysis results show that austenrte and cementite containing Mg, Zr. S have very different valence electron structures from Fe -C austenite and cementite. We find that this difference is the tie of absorption hypothesis, surface tension hypothesis, undercooling hypothesis in graphite spheroidizing theory. By using "the model of valence electron theory of drag-like effect" in our previous paper in crystallization theory, the spheroidizing effect of Mg and Zr and the anti-spheroidizing effect of S can be explained with the valence electron structure data of phases. Therefore, electron theory of graphite spheroidizing can be advanced.

  18. Theory of scattering of crystal electrons at magnons

    Science.gov (United States)

    Haag, Michael; Illg, Christian; Fähnle, Manfred

    2013-06-01

    Electron-magnon scatterings are very important for many effects in spintronics and therefore an ab initio treatment of these processes is highly desirable. Based on the spin-density functional electron theory, an operator for the electron-magnon scattering is constructed in a second-quantization formalism for crystal electron states which are represented by linear-muffin-tin-orbital basis functions. An outlook is given as to how this operator can be used to investigate the possible contribution of these scattering processes to the ultrafast demagnetization of films after exposure to a fs optical laser pulse.

  19. Cataloging and Indexing of Electronic Information Resources

    Science.gov (United States)

    2003-04-01

    digital library, but it facilitates the exchange of these objects among digital libraries . METS provides an XML DTD that can point to metadata in other...International Federation of Library Associations and Institutions (IFLA). (2002). Digital Libraries : Metadata Resources. Retrieved May 3, 2002 from the

  20. Adoption and use of electronic information resources by medical ...

    African Journals Online (AJOL)

    ... were analysed with descriptive Statistics(Simple percentage and frequency count). ... for doing assignment, Google search, for personal development, and getting ... major problems encountered when using electronic Information Resources.

  1. Radiation damage of insulating crystals induced by electronic excitation

    Energy Technology Data Exchange (ETDEWEB)

    Itoh, Noriaki

    1988-05-01

    A review is given on radiation damage of insulating crystals arising from energy imparted to solids into electronic excitation. Emphasis is placed in describing the mechanism. The role of the exciton-phonon interaction in the production of radiation damage is described and the radiation damage processes in a few typical insulators such as alkali halides, alkali earth fluorides and silicon dioxide are described.

  2. Euler European Libraries and Electronic Resources in Mathematical Sciences

    CERN Document Server

    The Euler Project. Karlsruhe

    The European Libraries and Electronic Resources (EULER) Project in Mathematical Sciences provides the EulerService site for searching out "mathematical resources such as books, pre-prints, web-pages, abstracts, proceedings, serials, technical reports preprints) and NetLab (for Internet resources), this outstanding engine is capable of simple, full, and refined searches. It also offers a browse option, which responds to entries in the author, keyword, and title fields. Further information about the Project is provided at the EULER homepage.

  3. Electronic and vibrational spectra of some rare earth trifluoromethanesulfonates crystals

    Science.gov (United States)

    Paul, P.; Ghosh, M.; Neogy, D.; Mallick, P. K.

    2011-01-01

    The Raman and infrared spectra of some rare earth (dysprosium and terbium) trifluoromethanesulfonates crystals have been analyzed. Different vibrational frequencies of trifluoromethanesulfonate ions (CF 3SO 3-) are identified and assigned to different vibrations of the SO 3 and CF 3 groups. Electronic transitions of R 3+ ions (R = Dy, Tb) in these salts have been assigned to transitions from the ground to different energy levels of the ground multiplet. The electronic energy levels of the rare earth ions are also determined theoretically with the help of single electron crystal field theory. They are found to yield results not only in good agreement with the observed spectral data but also in good conformity with those obtained previously from magnetic measurements.

  4. Building an electronic resource collection a practical guide

    CERN Document Server

    Lee, Stuart D

    2004-01-01

    This practical book guides information professionals step-by-step through building and managing an electronic resource collection. It outlines the range of electronic products currently available in abstracting and indexing, bibliographic, and other services and then describes how to effectively select, evaluate and purchase them.

  5. Electron energy can oscillate near a crystal dislocation

    Science.gov (United States)

    Li, Mingda; Cui, Wenping; Dresselhaus, Mildred S.; Chen, Gang

    2017-01-01

    Crystal dislocations govern the plastic mechanical properties of materials but also affect the electrical and optical properties. However, a fundamental and quantitative quantum field theory of a dislocation has remained undiscovered for decades. Here we present an exactly-solvable one-dimensional quantum field theory of a dislocation, for both edge and screw dislocations in an isotropic medium, by introducing a new quasiparticle which we have called the ‘dislon’. The electron-dislocation relaxation time can then be studied directly from the electron self-energy calculation, which is reducible to classical results. In addition, we predict that the electron energy will experience an oscillation pattern near a dislocation. Compared with the electron density’s Friedel oscillation, such an oscillation is intrinsically different since it exists even with only single electron is present. With our approach, the effect of dislocations on materials’ non-mechanical properties can be studied at a full quantum field theoretical level.

  6. Single Crystal Diamond Needle as Point Electron Source

    Science.gov (United States)

    Kleshch, Victor I.; Purcell, Stephen T.; Obraztsov, Alexander N.

    2016-10-01

    Diamond has been considered to be one of the most attractive materials for cold-cathode applications during past two decades. However, its real application is hampered by the necessity to provide appropriate amount and transport of electrons to emitter surface which is usually achieved by using nanometer size or highly defective crystallites having much lower physical characteristics than the ideal diamond. Here, for the first time the use of single crystal diamond emitter with high aspect ratio as a point electron source is reported. Single crystal diamond needles were obtained by selective oxidation of polycrystalline diamond films produced by plasma enhanced chemical vapor deposition. Field emission currents and total electron energy distributions were measured for individual diamond needles as functions of extraction voltage and temperature. The needles demonstrate current saturation phenomenon and sensitivity of emission to temperature. The analysis of the voltage drops measured via electron energy analyzer shows that the conduction is provided by the surface of the diamond needles and is governed by Poole-Frenkel transport mechanism with characteristic trap energy of 0.2-0.3 eV. The temperature-sensitive FE characteristics of the diamond needles are of great interest for production of the point electron beam sources and sensors for vacuum electronics.

  7. Simulation of Electronic Center Formation by Irradiation in Silicon Crystals

    Science.gov (United States)

    Yeritsyan, H. N.; Sahakyan, A. A.; Grigoryan, N. E.; Harutyunyan, V. V.; Tsakanov, V. M.; Grigoryan, B. A.; Yeremyan, A. S.; Amatuni, G. A.

    2017-02-01

    We present the results of a study on localized electronic centers formed in crystals by external influences (impurity introduction and irradiation). The main aim is to determine the nature of these centers in the forbidden gap of the energy states of the crystal lattice. For the case of semiconductors, silicon (Si) was applied as model material to determine the energy levels and concentration of radiation defects for application to both doped and other materials. This method relies on solving the appropriate equation describing the variation of the charge carrier concentration as a function of temperature n( T) for silicon crystals with two different energy levels and for a large set of N 1, N 2 (concentrations of electronic centers at each level), and n values. A total of almost 500 such combinations were found. For silicon, energy level values of ɛ 1 = 0.22 eV and ɛ 2 = 0.34 eV were used for the forbidden gap (with corresponding slopes determined from experimental temperature-dependent Hall-effect measurements) and compared with photoconductivity spectra. Additionally, it was shown that, for particular correlations among N 1, N 2, and n, curve slopes of ɛ 1/2 = 0.11 eV, ɛ 2/2 = 0.17 eV, and α = 1/2( ɛ 1 + ɛ 2) = 0.28 eV also apply. Comparison between experimental results for irradiation of silicon crystals by 3.5-MeV energy electrons and Co60 γ-quanta revealed that the n( T) curve slopes do not always coincide with the actual energy levels (electronic centers).

  8. Laser-initiated explosive electron emission from flat germanium crystals

    Science.gov (United States)

    Porshyn, V.; Mingels, S.; Lützenkirchen-Hecht, D.; Müller, G.

    2016-07-01

    Flat Sb-doped germanium (100) crystals were investigated in the triode configuration under pulsed tunable laser illumination (pulse duration tlaser = 3.5 ns and photon energy hν = 0.54-5.90 eV) and under DC voltages 1 MW/cm2 corresponding to a high quantum efficiency up to 3.3% and cathode currents up to 417 A. This laser-induced explosive electron emission (EEE) from Ge was characterized by its voltage-, laser power- and hν-sensitivity. The analysis of the macroscopic surface damage caused by the EEE is included as well. Moreover, we have carried out first direct measurements of electron energy distributions produced during the EEE from the Ge samples. The measured electron spectra hint for electron excitations to the vacuum level of the bulk and emission from the plasma plume with an average kinetic energy of ˜0.8 eV.

  9. Why and How to Measure the Use of Electronic Resources

    Directory of Open Access Journals (Sweden)

    Jean Bernon

    2008-11-01

    Full Text Available A complete overview of library activity implies a complete and reliable measurement of the use of both electronic resources and printed materials. This measurement is based on three sets of definitions: document types, use types and user types. There is a common model of definitions for printed materials, but a lot of questions and technical issues remain for electronic resources. In 2006 a French national working group studied these questions. It relied on the COUNTER standard, but found it insufficient and pointed out the need for local tools such as web markers and deep analysis of proxy logs. Within the French national consortium COUPERIN, a new working group is testing ERMS, SUSHI standards, Shibboleth authentication, along with COUNTER standards, to improve the counting of the electronic resources use. At this stage this counting is insufficient and its improvement will be a European challenge for the future.

  10. Access to electronic resources by visually impaired people

    Directory of Open Access Journals (Sweden)

    Jenny Craven

    2003-01-01

    Full Text Available Research into access to electronic resources by visually impaired people undertaken by the Centre for Research in Library and Information Management has not only explored the accessibility of websites and levels of awareness in providing websites that adhere to design for all principles, but has sought to enhance understanding of information seeking behaviour of blind and visually impaired people when using digital resources.

  11. The Study of Analytical Model of Library Electronic Resources Usage-A Case of Medical Electronic Resources

    Directory of Open Access Journals (Sweden)

    Chung-Yen Yu

    2014-10-01

    Full Text Available With the advents of internet, the importance of electronic resources is growing. Due to the increasing expensiveness of electronic resources, university libraries normally received budgets from parent institutions annually. They necessarily applied effective and systematic methods for decision making in electronic resources purchase or re-subscription. However, there are some difficulties in practices: First of all, libraries are unable to receive user records; second, the COUNTER statistics does not include details about users and their affiliation. As a result, one cannot conduct advanced user analysis based on the usage of users, institutions, and departments. To overcome the difficulties, this study presents a feasible model to analyze electronic resource usage effectively and flexibly. We set up a proxy server to collect actual usage raw data. By analyzing items in internet browsing records, associated with original library automatic system, this study aims at exploring how to use effective ways to analyze big data of website log data. We also propose the process of how original data to be transformed, cleared, integrated, and demonstrated. This study adopted a medical university library and its subscription of medical electronic resources as a case. Our data analysis includes (1 year of subscription,(2 title of journal, (3 affiliation, (4 subjects, and (5 specific journal requirements, etc. The findings of the study are contributed to obtain further understanding in policy making and user behavior analysis. The integrated data provides multiple applications in informatics research, information behavior, bibliomining, presenting diverse views and extended issues for further discussion.

  12. Practical guide to electronic resources in the humanities

    CERN Document Server

    Dubnjakovic, Ana

    2010-01-01

    From full-text article databases to digitized collections of primary source materials, newly emerging electronic resources have radically impacted how research in the humanities is conducted and discovered. This book, covering high-quality, up-to-date electronic resources for the humanities, is an easy-to-use annotated guide for the librarian, student, and scholar alike. It covers online databases, indexes, archives, and many other critical tools in key humanities disciplines including philosophy, religion, languages and literature, and performing and visual arts. Succinct overviews of key eme

  13. Discipline, availability of electronic resources and the use of Finnish National Electronic Library - FinELib

    Directory of Open Access Journals (Sweden)

    Sanna Torma

    2004-01-01

    Full Text Available This study elaborated relations between digital library use by university faculty, users' discipline and the availability of key resources in the Finnish National Electronic Library (FinELib, Finnish national digital library, by using nationwide representative survey data. The results show that the perceived availability of key electronic resources by researchers in FinELib was a stronger predictor of the frequency and purpose of use of its services than users' discipline. Regardless of discipline a good perceived provision of central resources led to a more frequent use of FinELib. The satisfaction with the services did not vary with the discipline, but with the perceived availability of resources.

  14. Microscopic verification of topological electron-vortex binding in the lowest Landau-level crystal state.

    Science.gov (United States)

    Chang, Chia-Chen; Jeon, Gun Sang; Jain, Jainendra K

    2005-01-14

    When two-dimensional electrons are subjected to a very strong magnetic field, they are believed to form a triangular crystal. By a direct comparison with the exact wave function, we demonstrate that this crystal is not a simple Hartree-Fock crystal of electrons but an inherently quantum mechanical crystal characterized by a nonperturbative binding of quantized vortices to electrons. It is suggested that this has qualitative consequences for experiment.

  15. Providing Access to Electronic Information Resources in Further Education

    Science.gov (United States)

    Banwell, Linda; Ray, Kathryn; Coulson, Graham; Urquhart, Christine; Lonsdale, Ray; Armstrong, Chris; Thomas, Rhian; Spink, Sin; Yeoman, Alison; Fenton, Roger; Rowley, Jennifer

    2004-01-01

    This article aims to provide a baseline for future studies on the provision and support for the use of digital or electronic information services (EIS) in further education. The analysis presented is based on a multi-level model of access, which encompasses access to and availability of information and communication technology (ICT) resources,…

  16. ANALYTICAL REVIEW OF ELECTRONIC RESOURCES FOR THE STUDY OF LATIN

    Directory of Open Access Journals (Sweden)

    Olena Yu. Balalaieva

    2014-04-01

    Full Text Available The article investigates the current state of development of e-learning content in the Latin language. It is noted that the introduction of ICT in the educational space has expanded the possibility of studying Latin, opened access to digital libraries resources, made it possible to use scientific and educational potential and teaching Latin best practices of world's leading universities. A review of foreign and Ukrainian information resources and electronic editions for the study of Latin is given. Much attention was paid to the didactic potential of local and online multimedia courses of Latin, electronic textbooks, workbooks of interactive tests and exercises, various dictionaries and software translators, databases and digital libraries. Based on analysis of the world market of educational services and products the main trends in the development of information resources and electronic books are examined. It was found that multimedia courses with interactive exercises or workbooks with interactive tests, online dictionaries and translators are the most widely represented and demanded. The noticeable lagging of Ukrainian education and computer linguistics in quantitative and qualitative measures in this industry is established. The obvious drawback of existing Ukrainian resources and electronic editions for the study of Latin is their noninteractive nature. The prospects of e-learning content in Latin in Ukraine are outlined.

  17. Electronic Commerce Resource Centers. An Industry--University Partnership.

    Science.gov (United States)

    Gulledge, Thomas R.; Sommer, Rainer; Tarimcilar, M. Murat

    1999-01-01

    Electronic Commerce Resource Centers focus on transferring emerging technologies to small businesses through university/industry partnerships. Successful implementation hinges on a strategic operating plan, creation of measurable value for customers, investment in customer-targeted training, and measurement of performance outputs. (SK)

  18. Student Satisfaction with Electronic Library Resources at Wayne State University

    Science.gov (United States)

    Holley, Robert P.; Powell, Ronald R.

    2004-01-01

    This paper reports the results of a survey of student satisfaction with electronic library resources other than the online catalog at Wayne State University. Undertaken in Fall Term 2000 as a class project for a marketing course, a student team designed, administered, and analyzed a survey of a random sample of students. Almost 40% of the…

  19. Electronic Commerce Resource Centers. An Industry--University Partnership.

    Science.gov (United States)

    Gulledge, Thomas R.; Sommer, Rainer; Tarimcilar, M. Murat

    1999-01-01

    Electronic Commerce Resource Centers focus on transferring emerging technologies to small businesses through university/industry partnerships. Successful implementation hinges on a strategic operating plan, creation of measurable value for customers, investment in customer-targeted training, and measurement of performance outputs. (SK)

  20. Technical Communicator: A New Model for the Electronic Resources Librarian?

    Science.gov (United States)

    Hulseberg, Anna

    2016-01-01

    This article explores whether technical communicator is a useful model for electronic resources (ER) librarians. The fields of ER librarianship and technical communication (TC) originated and continue to develop in relation to evolving technologies. A review of the literature reveals four common themes for ER librarianship and TC. While the…

  1. Providing Access to Electronic Information Resources in Further Education

    Science.gov (United States)

    Banwell, Linda; Ray, Kathryn; Coulson, Graham; Urquhart, Christine; Lonsdale, Ray; Armstrong, Chris; Thomas, Rhian; Spink, Sin; Yeoman, Alison; Fenton, Roger; Rowley, Jennifer

    2004-01-01

    This article aims to provide a baseline for future studies on the provision and support for the use of digital or electronic information services (EIS) in further education. The analysis presented is based on a multi-level model of access, which encompasses access to and availability of information and communication technology (ICT) resources,…

  2. Evaluating the appropriateness of electronic information resources for learning.

    Science.gov (United States)

    Saparova, Dinara; Nolan, Nathanial S

    2016-01-01

    Current US medical students have begun to rely on electronic information repositories-such as UpToDate, AccessMedicine, and Wikipedia-for their pre-clerkship medical education. However, it is unclear whether these resources are appropriate for this level of learning due to factors involving information quality, level of evidence, and the requisite knowledgebase. This study evaluated appropriateness of electronic information resources from a novel perspective: amount of mental effort learners invest in interactions with these resources and effects of the experienced mental effort on learning. Eighteen first-year medical students read about three unstudied diseases in the above-mentioned resources (a total of fifty-four observations). Their eye movement characteristics (i.e., fixation duration, fixation count, visit duration, and task-evoked pupillary response) were recorded and used as psychophysiological indicators of the experienced mental effort. Post reading, students' learning was assessed with multiple-choice tests. Eye metrics and test results constituted quantitative data analyzed according to the repeated Latin square design. Students' perceptions of interacting with the information resources were also collected. Participants' feedback during semi-structured interviews constituted qualitative data and was reviewed, transcribed, and open coded for emergent themes. Compared to AccessMedicine and Wikipedia, UpToDate was associated with significantly higher values of eye metrics, suggesting learners experienced higher mental effort. No statistically significant difference between the amount of mental effort and learning outcomes was found. More so, descriptive statistical analysis of the knowledge test scores suggested similar levels of learning regardless of the information resource used. Judging by the learning outcomes, all three information resources were found appropriate for learning. UpToDate, however, when used alone, may be less appropriate for first

  3. Crystal structure and electron density distribution in niobium carbide

    Energy Technology Data Exchange (ETDEWEB)

    Will, G.; Platzbecker, R. [Bonn Univ. (Germany). Abt. fuer Mineralogie und Kristallographie

    2001-09-01

    In this paper the bonding properties, e. g. the charge distribution between the atoms and the deformation of niobium carbide densities have been studied. The crystal studied had the composition NbC{sub 0.98}. Careful and redundant data collection (74 unique reflections out of 2087 reflections measured) gave the basis for a detailed study. IAM models (independent atom model), high order and multipole refinements were made resulting in R values of R=0.4% and R=0.07%. In the corresponding deformation density maps electron accumulations between the niobium atoms were detected, but no bonding to the carbon atoms. (orig.)

  4. Electronic properties of hybrid metal-discotic liquid crystal nanostructures

    Science.gov (United States)

    Kelsall, R. W.; Pecchia, A.; Bourlange, A.; Movaghar, B.; Evans, S. D.; Hickey, B. J.; Boden, N.

    2003-04-01

    A new class of hybrid organic/inorganic nanostructures, comprising self-organised discotic liquid crystal layers deposited on ultrathin metal films, has been investigated both experimentally and theoretically. Calculations show that the periodic self-organised molecular layer gives rise to a new, hybrid electronic bandstructure, resulting in modulation of the metal film conductivity. In situ conductivity measurements during deposition of such self-organised layers confirm that the metal film conductivity is altered. Theoretical modeling also shows that the AC conductivity should show structure related to the carrier trapping and one-dimensional transport features of the self-organised layer.

  5. Pressure effects on crystal and electronic structure of bismuth tellurohalides

    Science.gov (United States)

    Rusinov, I. P.; Menshchikova, T. V.; Sklyadneva, I. Yu; Heid, R.; Bohnen, K.-P.; Chulkov, E. V.

    2016-11-01

    We study the possibility of pressure-induced transitions from a normal semiconductor to a topological insulator (TI) in bismuth tellurohalides using density functional theory and tight-binding method. In BiTeI this transition is realized through the formation of an intermediate phase, a Weyl semimetal, that leads to modification of surface state dispersions. In the topologically trivial phase, the surface states exhibit a Bychkov-Rashba type dispersion. The Weyl semimetal phase exists in a narrow pressure interval of 0.2 GPa. After the Weyl semimetal-TI transition occurs, the surface electronic structure is characterized by gapless states with linear dispersion. The peculiarities of the surface states modification under pressure depend on the band-bending effect. We have also calculated the frequencies of Raman active modes for BiTeI in the proposed high-pressure crystal phases in order to compare them with available experimental data. Unlike BiTeI, in BiTeBr and BiTeCl the topological phase transition does not occur. In BiTeBr, the crystal structure changes with pressure but the phase remains a trivial one. However, the transition appears to be possible if the low-pressure crystal structure is retained. In BiTeCl under pressure, the topological phase does not appear up to 18 GPa due to a relatively large band gap width in this compound.

  6. On the electron vortex beam wavefunction within a crystal

    Energy Technology Data Exchange (ETDEWEB)

    Mendis, B.G., E-mail: b.g.mendis@durham.ac.uk

    2015-10-15

    Electron vortex beams are distorted by scattering within a crystal, so that the wavefunction can effectively be decomposed into many vortex components. Using a Bloch wave approach equations are derived for vortex beam decomposition at any given depth and with respect to any frame of reference. In the kinematic limit (small specimen thickness) scattering largely takes place at the neighbouring atom columns with a local phase change of π/2 rad. When viewed along the beam propagation direction only one vortex component is present at the specimen entrance surface (i.e. the ‘free space’ vortex in vacuum), but at larger depths the probe is in a mixed state due to Bragg scattering. Simulations show that there is no direct correlation between vortex components and the pendellösung, i.e. at a given depth probes with relatively constant can be in a more mixed state compared to those with more rapidly varying . This suggests that minimising oscillations in the pendellösung by probe channelling is not the only criterion for generating a strong electron energy loss magnetic circular dichroism (EMCD) signal. - Highlights: • Equations are derived for vortex decomposition due to scattering within a crystal. • There is no direct correlation between vortex decomposition and pendellösung. • Results are also discussed in the context of EMCD measurements.

  7. MODEL OF AN ELECTRONIC EDUCATIONAL RESOURCE OF NEW GENERATION

    Directory of Open Access Journals (Sweden)

    Anatoliy V. Loban

    2016-01-01

    Full Text Available The mathematical structure of the modular architecture of an electronic educational resource (EER of new generation, which allows to decompose the process of studying the subjects of the course at a hierarchically ordered set of data (knowledge and procedures for manipulating them, to determine the roles of participants of process of training of and technology the development and use of EOR in the study procrate.

  8. Influence of electron beam exposure on crystallization of phase-change materials

    NARCIS (Netherlands)

    Pandian, Ramanathaswamy; Kooi, Bart J.; De Hosson, Jeff Th. M.; Pauza, Andrew

    2007-01-01

    Isothermal crystallization of amorphous SbxTe films capped with ZnS-SiO2 or GeCrN layers was performed using in situ heating within a transmission electron microscope. The effect of the electron beam of the microscope on the crystallization process was investigated. It was found that electron irradi

  9. Evaluating increased resource use in fibromyalgia using electronic health records

    Directory of Open Access Journals (Sweden)

    Margolis JM

    2016-11-01

    Full Text Available Jay M Margolis,1 Elizabeth T Masters,2 Joseph C Cappelleri,3 David M Smith,1 Steven Faulkner4 1Truven Health Analytics, Life Sciences, Outcomes Research, Bethesda, MD, 2Pfizer Inc, Outcomes & Evidence, New York, NY, 3Pfizer Inc, Statistics, Groton, CT, 4Pfizer Inc, North American Medical Affairs, Medical Outcomes Specialists, St Louis, MO, USA Objective: The management of fibromyalgia (FM, a chronic musculoskeletal disease, remains challenging, and patients with FM are often characterized by high health care resource utilization. This study sought to explore potential drivers of all-cause health care resource utilization and other factors associated with high resource use, using a large electronic health records (EHR database to explore data from patients diagnosed with FM. Methods: This was a retrospective analysis of de-identified EHR data from the Humedica database. Adults (≥18 years with FM were identified based on ≥2 International Classification of Diseases, Ninth Revision codes for FM (729.1 ≥30 days apart between January 1, 2008 and December 31, 2012 and were required to have evidence of ≥12 months continuous care pre- and post-index; first FM diagnosis was the index event; 12-month pre- and post-index reporting periods. Multivariable analysis evaluated relationships between variables and resource utilization. Results: Patients were predominantly female (81.4%, Caucasian (87.7%, with a mean (standard deviation age of 54.4 (14.8 years. The highest health care resource utilization was observed for the categories of “medication orders” and “physician office visits,” with 12-month post-index means of 21.2 (21.5 drug orders/patient and 15.1 (18.1 office visits/patient; the latter accounted for 73.3% of all health care visits. Opioids were the most common prescription medication, 44.3% of all patients. The chance of high resource use was significantly increased (P<0.001 26% among African-Americans vs Caucasians and for patients

  10. Online Electronic Resources and Slovenian Bibliography: a Case Study

    Directory of Open Access Journals (Sweden)

    Daniela Škerget

    2014-09-01

    Full Text Available AbstractConsidering the fact that the number of publications available online only is growing, the question whether to include online electronic resources into the Slovenian bibliography, and if so, in which way, and what are the requirements for the inclusion, is raised. To answer these questions, the research on the growth of the Slovenian online scientific production in comparison with production in printed form was conducted in the case of original scientific articles. Results showed a rapid growth of the number of original scientific articles available online only, which indicates the necessity to form a separate Slovenian bibliography of online resources. The selection criteria for the Slovenian bibliography of online resources are also presented. This kind of bibliography would, along with the informational value, add to the historical value of intellectual production in a given time frame, enriched with a link to the resource preserved in another location (archive, repository, in case of unavailability of the resource on its original location.

  11. Investigation of molecule properties from electronic absorption spectra of solid and liquid crystals

    Science.gov (United States)

    Klimusheva, G. V.

    2004-12-01

    Among the achievements of 20th century, there is the origin and violent development of the low-temperature technique and low-temperature spectroscopy of molecular crystals in the polarized light. Many obtained results became possible due to the close cooperation between experiment investigators and theorists. This short review traces the evolution of only one trend in the physics of molecular crystals, namely, the investigation of energetic and spatial structure of molecules from the analysis of electronic spectra of molecular crystals. First, for this purpose the possibilities of using the electronic spectra of molecular crystals at low temperatures benzene derivatives and the electronic spectra of liquid ionic crystals are considered. The results of investigations of the electronic absorption spectra for the new class of liquid crystals, namely, ionic metal-organic smectics are presented. Changes in the structure of doping molecules in the ionic liquid crystals under the influence of the dc electric field are analyzed.

  12. Electron transport across metal/discotic liquid crystal interfaces

    Science.gov (United States)

    Boden, N.; Bushby, R. J.; Clements, J.; Movaghar, B.

    1998-03-01

    Electron transport across micron thick films of columnar hexagonal discotic liquid crystal phases homeotropically aligned between metal electrode surfaces has been studied both experimentally and theoretically. These molecules are unique in their combination of charge transport along individual molecular columns with liquidlike self-organization. Typical of organic insulators, a high resistance Ohmic regime is evident at fields of less than 0.05 MV cm-1, due to a low concentration of chemical impurities (nroom temperature. Our results show that triphenylene-based discotics form an excellent class of highly ordered optically transparent insulators. At high temperatures and high fields the current is injection controlled and exhibits typical tunneling and space charge limited, nonlinear I-V characteristics. Dramatic jumps in injection currents are observed at phase transitions. The change at the crystalline to liquid crystalline phase transition is mainly due to more efficient "wetting" of the electrode surface in the liquid crystalline phase, whilst at the liquid crystalline to isotropic phase transition it arises from the enhancement in the molecular mobility. The concepts of semiconducting gaps, band mobilities, and carrier injection rates are extended to these new materials. The experimental observations are interpreted in a framework which takes into account the important role played by liquidlike dynamics in establishing the microscopic structural order in, what is, otherwise a highly anisotropic and weakly bonded "molecular crystal."

  13. Electronic properties of graphene-single crystal diamond heterostructures

    Energy Technology Data Exchange (ETDEWEB)

    Zhao, Fang; Thuong Nguyen, Thuong; Golsharifi, Mohammad; Amakubo, Suguru; Jackman, Richard B., E-mail: r.jackman@ucl.ac.uk [London Centre for Nanotechnology and Department of Electronic and Electrical Engineering, University College London, 17-19 Gordon Street, London WC1H 0AH (United Kingdom); Loh, K. P. [Department of Chemistry, National University of Singapore, 3 Science Drive, Singapore 117543 (Singapore)

    2013-08-07

    Single crystal diamond has been used as a substrate to support single layer graphene grown by chemical vapor deposition methods. It is possible to chemically functionalise the diamond surface, and in the present case H-, F-, O-, and N-group have been purposefully added prior to graphene deposition. The electronic properties of the resultant heterostructures vary strongly; a p-type layer with good mobility and a band gap of ∼0.7 eV is created when H-terminated diamond layers are used, whilst a layer with more metallic-like character (high carrier density and low carrier mobility) arises when N(O)-terminations are introduced. Since it is relatively easy to pattern these functional groups on the diamond surface, this suggests that this approach may offer an exciting route to 2D device structures on single layer graphene sheets.

  14. Potential resource and toxicity impacts from metals in waste electronic devices.

    Science.gov (United States)

    Woo, Seung H; Lee, Dae Sung; Lim, Seong-Rin

    2016-04-01

    As a result of the continuous release of new electronic devices, existing electronic devices are quickly made obsolete and rapidly become electronic waste (e-waste). Because e-waste contains a variety of metals, information about those metals with the potential for substantial environmental impact should be provided to manufacturers, recyclers, and disposers to proactively reduce this impact. This study assesses the resource and toxicity (i.e., cancer, noncancer, and ecotoxicity) potentials of various heavy metals commonly found in e-waste from laptop computers, liquid-crystal display (LCD) monitors, LCD TVs, plasma TVs, color cathode ray tube (CRT) TVs, and cell phones and then evaluates such potentials using life cycle impact-based methods. Resource potentials derive primarily from Cu, Sb, Ag, and Pb. Toxicity potentials derive primarily from Pb, Ni, and Hg for cancer toxicity; from Pb, Hg, Zn, and As for noncancer toxicity; and from Cu, Pb, Hg, and Zn for ecotoxicity. Therefore, managing these heavy metals should be a high priority in the design, recycling, and disposal stages of electronic devices.

  15. Journals, Data and Abstracts Make an Integrated Electronic Resource

    Science.gov (United States)

    Boyce, P.

    1996-12-01

    Astronomy now has an integrated, Web-based information resource for research papers, data and bibliographic information. The major scholarly research journals, a comprehensive abstract service and the astronomical data centers are now linked together to provide an information resource which is not available to most other scientific disciplines. As of January, 1997, the Astrophysical Journal joins the ApJ Letters on the Web. Astronomy and Astrophysics Supplements now has a page image version. Elsevier's electronic journal New Astronomy has recently made its appearance. Over forty percent of the new peer-reviewed, astronomical literature is now available electronically. The main Astronomy and Astrophysics journal, the Astronomical Journal and others will be available by 1998, at which point ninety percent of the literature will be available electronically, a figure not approached by any other scientific discipline. With so many different sources, one of the challenges has been to integrate the on-line, peer-reviewed literature into a resource which serves the astronomical community in a unified and coherent manner. Following the lead of the AAS, the major publishers have chosen to rely upon the NASA-supported Astrophysics Data System (ADS) and the astronomical data centers to provide the means by which the various separate journals can interoperate. The data centers and the ADS have developed unique identification codes for journal articles. By adopting the existing standard "bibcodes" and integrating them into their WWW links, each of the major astronomical journals are able to link to the abstracts of most of the referenced articles. Since the ADS also serves as an on-line repository for page images of the past twenty years of the major astronomical journals, the full text of many of the referenced articles are available, too. The articles in the ADS have recently been linked through their references, both forward and backward in time. With the "bibcode" providing

  16. Analysis of Human Resources Management Strategy in China Electronic Commerce Enterprises

    Science.gov (United States)

    Shao, Fang

    The paper discussed electronic-commerce's influence on enterprise human resources management, proposed and proved the human resources management strategy which electronic commerce enterprise should adopt from recruitment strategy to training strategy, keeping talent strategy and other ways.

  17. Resources

    Science.gov (United States)

    ... resources Alzheimer's - resources Anorexia nervosa - resources Arthritis - resources Asthma and allergy - resources Autism - resources Blindness - resources BPH - resources Breastfeeding - resources Bulimia - resources Burns - resources Cancer - resources Cerebral ...

  18. Discipline, Availability of Electronic Resources and the Use of Finnish National Electronic Library-- FinELib

    Science.gov (United States)

    Törmä, Sanna; Vakkari, Pertti

    2004-01-01

    This study elaborated relations between digital library use by university faculty, users' discipline and the availability of key resources in the Finnish National Electronic Library (FinELib), Finnish national digital library, by using nationwide representative survey data. The results show that the perceived availability of key electronic…

  19. Structural and electronic properties of Diisopropylammonium bromide molecular ferroelectric crystal

    Science.gov (United States)

    Alsaad, A.; Qattan, I. A.; Ahmad, A. A.; Al-Aqtash, N.; Sabirianov, R. F.

    2015-10-01

    We report the results of ab-initio calculations based on Generalized Gradient Approximation (GGA) and hybrid functional (HSE06) of electronic band structure, density of states and partial density of states to get a deep insight into structural and electronic properties of P21 ferroelectric phase of Diisopropylammonium Bromide molecular crystal (DIPAB). We found that the optical band gap of the polar phase of DIPAB is ∼ 5 eV confirming it as a good dielectric. Examination of the density of states and partial density of states reveal that the valence band maximum is mainly composed of bromine 4p orbitals and the conduction band minimum is dominated by carbon 2p, carbon 2s, and nitrogen 2s orbitals. A unique aspect of P21 ferroelectric phase is the permanent dipole within the material. We found that P21 DIPAB has a spontaneous polarization of 22.64 consistent with recent findings which make it good candidate for the creation of ferroelectric tunneling junctions (FTJs) which have the potential to be used as memory devices.

  20. End-of-life resource recovery from emerging electronic products

    DEFF Research Database (Denmark)

    Parajuly, Keshav; Habib, Komal; Cimpan, Ciprian

    2016-01-01

    of emerging electronic product, in order to understand the recovery fate of different materials and its linkage to product design. Ten different brands of RVC were dismantled and their material composition and design profiles were studied. Another 125 RVCs (349 kg) were used for an experimental trial......Integrating product design with appropriate end-of-life (EoL) processing is widely recognized to have huge potentials in improving resource recovery from electronic products. In this study, we investigate both the product characteristics and EoL processing of robotic vacuum cleaner (RVC), as a case...... at a conventional ‘shred-and-separate’ type preprocessing plant in Denmark. A detailed material flow analysis was performed throughout the recycling chain. The results show a mismatch between product design and EoL processing, and the lack of practical implementation of ‘Design for EoL’ thinking. In the best...

  1. Electronic Resources and Mission Creep: Reorganizing the Library for the Twenty-First Century

    Science.gov (United States)

    Stachokas, George

    2009-01-01

    The position of electronic resources librarian was created to serve as a specialist in the negotiation of license agreements for electronic resources, but mission creep has added more functions to the routine work of electronic resources such as cataloging, gathering information for collection development, and technical support. As electronic…

  2. Effects of Electronic Information Resources Skills Training for Lecturers on Pedagogical Practices and Research Productivity

    Science.gov (United States)

    Bhukuvhani, Crispen; Chiparausha, Blessing; Zuvalinyenga, Dorcas

    2012-01-01

    Lecturers use various electronic resources at different frequencies. The university library's information literacy skills workshops and seminars are the main sources of knowledge of accessing electronic resources. The use of electronic resources can be said to have positively affected lecturers' pedagogical practices and their work in general. The…

  3. Electronic Structure of Single-Crystal Monolayer Graphene on Hydrogen-Terminated Germanium Surface

    Science.gov (United States)

    Ahn, Sung Joon; Lee, Jae-Hyun; Ahn, Joung Real; Whang, Dongmok

    2015-03-01

    Graphene, atomically flat 2-Dimensional layered nano material, has a lot of interesting characteristics from its unusual electronic structure. Almost properties of graphene are influenced by its crystallinity, therefore the uniform growth of single crystal graphene and layer control over the wafer scale areas remains a challenge in the fields of electronic, photonic and other devices based on graphene. Here, we report the method to make wafer scale single crystal monolayer graphene on hydrogen terminated germanium(110) surface and properties and electronic band structure of the graphene by using the tool of scanning electron microscopy, transmission electron microscopy, Raman spectroscopy, electron transport measurement, electron diffraction and angle-resolved photoemission spectroscopy.

  4. Polymorph identification and crystal structure determination by a combined crystal structure prediction and transmission electron microscopy approach.

    Science.gov (United States)

    Eddleston, Mark D; Hejczyk, Katarzyna E; Bithell, Erica G; Day, Graeme M; Jones, William

    2013-06-10

    Electron diffraction offers advantages over X-ray based methods for crystal structure determination because it can be applied to sub-micron sized crystallites, and picogram quantities of material. For molecular organic species, however, crystal structure determination with electron diffraction is hindered by rapid crystal deterioration in the electron beam, limiting the amount of diffraction data that can be collected, and by the effect of dynamical scattering on reflection intensities. Automated electron diffraction tomography provides one possible solution. We demonstrate here, however, an alternative approach in which a set of putative crystal structures of the compound of interest is generated by crystal structure prediction methods and electron diffraction is used to determine which of these putative structures is experimentally observed. This approach enables the advantages of electron diffraction to be exploited, while avoiding the need to obtain large amounts of diffraction data or accurate reflection intensities. We demonstrate the application of the methodology to the pharmaceutical compounds paracetamol, scyllo-inositol and theophylline. Copyright © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  5. Electron Cryomicroscopy of Membrane Proteins: Specimen Preparation for Two-Dimensional Crystals and Single Particles

    OpenAIRE

    Schmidt-Krey, Ingeborg; Rubinstein, John L.

    2010-01-01

    Membrane protein structure and function can be studied by two powerful and highly complementary electron cryomicroscopy (cryo-EM) methods: electron crystallography of two-dimensional (2D) crystals and single particle analysis of detergent-solubilized protein complexes. To obtain the highest-possible resolution data from membrane proteins, whether prepared as 2D crystals or single particles, cryo-EM samples must be vitrified with great care. Grid preparation for cryo-EM of 2D crystals is possi...

  6. Resource-saving application of FDTD technique in 3D photonic crystal waveguide calculations

    DEFF Research Database (Denmark)

    Lavrinenko, Andrei; Tromborg, Bjarne

    2002-01-01

    This paper presents an algorithm based on the well-known FDTD numerical method which is adapted for 3D problems of transmission and reflection of photonic crystal waveguides, and which effectively saves memory and computing resources. Specific examples showing its validity and effectiveness...

  7. Electronic Document Management: A Human Resource Management Case Study

    Directory of Open Access Journals (Sweden)

    Thomas Groenewald

    2004-11-01

    Full Text Available This case study serve as exemplar regarding what can go wrong with the implementation of an electronic document management system. Knowledge agility and knowledge as capital, is outlined against the backdrop of the information society and knowledge economy. The importance of electronic document management and control is sketched thereafter. The literature review is concluded with the impact of human resource management on knowledge agility, which includes references to the learning organisation and complexity theory. The intervention methodology, comprising three phases, follows next. The results of the three phases are presented thereafter. Partial success has been achieved with improving the human efficacy of electronic document management, however the client opted to discontinue the system in use. Opsomming Die gevalle studie dien as voorbeeld van wat kan verkeerd loop met die implementering van ’n elektroniese dokumentbestuur sisteem. Teen die agtergrond van die inligtingsgemeenskap en kennishuishouding word kennissoepelheid en kennis as kapitaal bespreek. Die literatuurstudie word afgesluit met die inpak van menslikehulpbronbestuur op kennissoepelheid, wat ook die verwysings na die leerorganisasie en kompleksietydsteorie insluit. Die metodologie van die intervensie, wat uit drie fases bestaan, volg daarna. Die resultate van die drie fases word vervolgens aangebied. Slegs gedeelte welslae is behaal met die verbetering van die menslike doeltreffendheid ten opsigte van elektroniese dokumentbestuur. Die klient besluit egter om nie voort te gaan om die huidige sisteem te gebruik nie.

  8. Transmission electron microscopy for the evaluation and optimization of crystal growth

    Energy Technology Data Exchange (ETDEWEB)

    Stevenson, Hilary P.; Lin, Guowu; Barnes, Christopher O.; Sutkeviciute, Ieva; Krzysiak, Troy; Weiss, Simon C.; Reynolds, Shelley; Wu, Ying; Nagarajan, Veeranagu; Makhov, Alexander M.; Lawrence, Robert; Lamm, Emily; Clark, Lisa; Gardella, Timothy J.; Hogue, Brenda G.; Ogata, Craig M.; Ahn, Jinwoo; Gronenborn, Angela M.; Conway, James F.; Vilardaga, Jean-Pierre; Cohen, Aina E.; Calero, Guillermo

    2016-04-26

    The crystallization of protein samples remains the most significant challenge in structure determination by X-ray crystallography. Here, the effectiveness of transmission electron microscopy (TEM) analysis to aid in the crystallization of biological macromolecules is demonstrated. It was found that the presence of well ordered lattices with higher order Bragg spots, revealed by Fourier analysis of TEM images, is a good predictor of diffraction-quality crystals. Moreover, the use of TEM allowed (i) comparison of lattice quality among crystals from different conditions in crystallization screens; (ii) the detection of crystal pathologies that could contribute to poor X-ray diffraction, including crystal lattice defects, anisotropic diffraction and crystal contamination by heavy protein aggregates and nanocrystal nuclei; (iii) the qualitative estimation of crystal solvent content to explore the effect of lattice dehydration on diffraction and (iv) the selection of high-quality crystal fragments for microseeding experiments to generate reproducibly larger sized crystals. Applications to X-ray free-electron laser (XFEL) and micro-electron diffraction (microED) experiments are also discussed.

  9. Pyroelectric electron emissions and domain inversion of LiNbO{sub 3} single crystals

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Dong-Wook [Samsung Advanced Institute of Technology, U-Team, P.O. Box 111, Suwon, Kyongki 440-600 (Korea, Republic of)]. E-mail: Peterkim@ucsd.edu; Bourim, E.M. [Samsung Advanced Institute of Technology, U-Team, P.O. Box 111, Suwon, Kyongki 440-600 (Korea, Republic of); Jeong, Soo-Hwan [Samsung Advanced Institute of Technology, U-Team, P.O. Box 111, Suwon, Kyongki 440-600 (Korea, Republic of); Yoo, In K. [Samsung Advanced Institute of Technology, U-Team, P.O. Box 111, Suwon, Kyongki 440-600, Korea (Korea)

    2004-10-30

    We investigated the electron emissions from a congruent LiNbO{sub 3} single crystal with variation in temperature. When there was a small gap between the crystal and detector (<2 mm), we observed abrupt drops in the emission current and polarization domain inversion of the crystal. The current burst was distributed in tree-like patterns that suggested plasma generation. A sufficient gap and a crystal with a high coercive field appear to be factors that allow reproducible electron emissions from pyroelectric materials.

  10. First-Principles Study on Electronic Structures and Optical Properties of Doped Ag Crystal

    Institute of Scientific and Technical Information of China (English)

    CAO Can; CHEN Ling-Na; JIA Shu-Ting; ZHANG Dan; XU Hui

    2012-01-01

    By using the first-principles calculation based on density functional theory,we investigate the electronic structures and optical properties of Cl-doped Ag crystal. The results show that the electronic structure of Cl-doped Ag crystal depends on the doped concentration and the site of impurity defect.Interestingly,the calculated adsorption spectra of Cl-doped Ag crystal show isotropy or anisotropy coincide with the symmetry of Ag crystal. These features are discussed to provide guidance to experimental efforts for Ag-based nanoeletronic devices.

  11. Electronic properties of AlN crystal doped with Cr, Mn and Fe Author(s:

    Directory of Open Access Journals (Sweden)

    S.V. Syrotyuk

    2013-03-01

    Full Text Available The spin-resolved electronic energy band spectra, as well as partial and total density of electronic states of the crystal AlN, doped with Cr, Mn and Fe, have been evaluated within the projector augmented waves (PAW approach by means of the ABINIT code. The Hartree-Fock exchange for correlated electrons is used to describe the correlated orbitals in the PAW framework. The calculated one-electron energies for electrons of spin up and down are very different. We have found that all the considered crystals are ferromagnetic.

  12. Channeling, Volume Reection and Gamma Emission Using 14GeV Electrons in Bent Silicon Crystals

    Energy Technology Data Exchange (ETDEWEB)

    Benson, Brandon [SLAC National Accelerator Lab., Menlo Park, CA (United States)

    2015-08-14

    High energy electrons can be deflected with very tight bending radius using a bent silicon crystal. This produces gamma radiation. As these crystals can be thin, a series of bent silicon crystals with alternating direction has the potential to produce coherent gamma radiation with reasonable energy of the driving electron beam. Such an electron crystal undulator offers the prospect for higher energy radiation at lower cost than current methods. Permanent magnetic undulators like LCLS at SLAC National Accelerator Laboratory are expensive and very large (about 100 m in case of the LCLS undulator). Silicon crystals are inexpensive and compact when compared to the large magnetic undulators. Additionally, such a high energy coherent light source could be used for probing through materials currently impenetrable by x-rays. In this work we present the experimental data and analysis of experiment T523 conducted at SLAC National Accelerator Laboratory. We collected the spectrum of gamma ray emission from 14 GeV electrons on a bent silicon crystal counting single photons. We also investigated the dynamics of electron motion in the crystal i.e. processes of channeling and volume reflection at 14 GeV, extending and building off previous work. Our single photon spectrum for the amorphous crystal orientation is consistent with bremsstrahlung radiation and the volume reflection crystal orientation shows a trend consistent with synchrotron radiation at a critical energy of 740 MeV. We observe that in these two cases the data are consistent, but we make no further claims because of statistical limitations. We also extended the known energy range of electron crystal dechanneling length and channeling efficiency to 14 GeV.

  13. Scintillation of lead tungstate crystal studied with single-electron beam from KUFEL

    Energy Technology Data Exchange (ETDEWEB)

    Rizwan, Mohamad, E-mail: rizwan@nucl.kyushu-u.ac.jp; Uozumi, Yusuke; Matsuo, Kazuki [Department of Applied Quantum Physics and Nuclear Engineering, Kyushu University, Fukuoka (Japan); Ohgaki, Hideaki; Kii, Toshiteru; Zen, Heishun [Institute of Advanced Energy, Kyoto University, Gokasho, Uji, Kyoto (Japan); Tsamalaidze, Zviadi; Evtoukhovitch, Petr; Valentin, Samoilov [Joint Institute for Nuclear Research, JINR, Joliot-Curie Str.6, Dubna (Russian Federation)

    2015-04-29

    Lead tungstate (PWO) crystal has a very fast response, high atomic density and high radiation hardness. Therefore, they are suitable to be used for high-energy nuclear data measurements under high-background circumstances. Although a good electron-ion separation with a pulse shape analysis technique is essential, scintillation pulse shapes have not been observed with electron beams of a wide energy range. A single-electron beam technique has been developed at Kyoto University Free Electron Laser (KUFEL), and electron beams of 4-38 MeV are available. During the experiments, single electron beams bombarded a PWO crystal. By using oscilloscope we observed scintillation pulses of a PWO crystal coupled with a photomultiplier tube. Measured spectra were compared with the simulation code of EGS5 to analyze scattering effects. As the result, the pulse amplitudes show good linearity and the pulse shapes are almost constant in the observed energy range.

  14. Quantum-trajectory Monte Carlo method for study of electron-crystal interaction in STEM.

    Science.gov (United States)

    Ruan, Z; Zeng, R G; Ming, Y; Zhang, M; Da, B; Mao, S F; Ding, Z J

    2015-07-21

    In this paper, a novel quantum-trajectory Monte Carlo simulation method is developed to study electron beam interaction with a crystalline solid for application to electron microscopy and spectroscopy. The method combines the Bohmian quantum trajectory method, which treats electron elastic scattering and diffraction in a crystal, with a Monte Carlo sampling of electron inelastic scattering events along quantum trajectory paths. We study in this work the electron scattering and secondary electron generation process in crystals for a focused incident electron beam, leading to understanding of the imaging mechanism behind the atomic resolution secondary electron image that has been recently achieved in experiment with a scanning transmission electron microscope. According to this method, the Bohmian quantum trajectories have been calculated at first through a wave function obtained via a numerical solution of the time-dependent Schrödinger equation with a multislice method. The impact parameter-dependent inner-shell excitation cross section then enables the Monte Carlo sampling of ionization events produced by incident electron trajectories travelling along atom columns for excitation of high energy knock-on secondary electrons. Following cascade production, transportation and emission processes of true secondary electrons of very low energies are traced by a conventional Monte Carlo simulation method to present image signals. Comparison of the simulated image for a Si(110) crystal with the experimental image indicates that the dominant mechanism of atomic resolution of secondary electron image is the inner-shell ionization events generated by a high-energy electron beam.

  15. Electronic excitation energies in crystals of PETN, RDX and HMX

    Science.gov (United States)

    Mukhanov, A. E.

    2014-05-01

    The key role in the model of detonation based on metallization of an explosive plays a fundamental band gap of a molecular crystal. For determining it in a shocked crystal prerequisite calculation for perfect PETN, RDX, and HMX is performed at 0K. Densities of states for these explosives are obtained and fundamental gaps are determined. Calculations are done within the framework of the Density Functional Theory and its planewave and pseudopotential implementation in the ABINIT package.

  16. The radiation defect accumulation in scintillative crystals of caesium halides under intense electron beam irradiation

    CERN Document Server

    Galiy, P V

    1999-01-01

    The characteristics of defect accumulation and radiolysis at CsI crystals under mean energies of electron irradiation at wide dose rates and ranges of doses have been investigated by such methods: thermostimulated exoelectron emission (TSEE), Auger electron spectroscopy (AES) and optical absorption spectroscopy (OAS). The limit dose rates and absorbed doses of electron irradiation that lead to defects accumulation at room temperature in crystals volume and also surface stoichiometry violation have been evaluated. The doses of electron irradiation that lead to CsI radiolysis, with caesium coagulation in metallic phase have been determined. Some quasi periodic connection of such process with irradiation dose was observed.

  17. Electronic Safety Resource Tools -- Supporting Hydrogen and Fuel Cell Commercialization

    Energy Technology Data Exchange (ETDEWEB)

    Barilo, Nick F.

    2014-09-29

    The Pacific Northwest National Laboratory (PNNL) Hydrogen Safety Program conducted a planning session in Los Angeles, CA on April 1, 2014 to consider what electronic safety tools would benefit the next phase of hydrogen and fuel cell commercialization. A diverse, 20-person team led by an experienced facilitator considered the question as it applied to the eight most relevant user groups. The results and subsequent evaluation activities revealed several possible resource tools that could greatly benefit users. The tool identified as having the greatest potential for impact is a hydrogen safety portal, which can be the central location for integrating and disseminating safety information (including most of the tools identified in this report). Such a tool can provide credible and reliable information from a trustworthy source. Other impactful tools identified include a codes and standards wizard to guide users through a series of questions relating to application and specific features of the requirements; a scenario-based virtual reality training for first responders; peer networking tools to bring users from focused groups together to discuss and collaborate on hydrogen safety issues; and a focused tool for training inspectors. Table ES.1 provides results of the planning session, including proposed new tools and changes to existing tools.

  18. Electron-scattering mechanisms in single-crystal K sub 3 C sub 60

    Energy Technology Data Exchange (ETDEWEB)

    Crespi, V.H.; Hou, J.G.; Xiang, X.; Cohen, M.L.; Zettl, A. (Department of Physics, University of California at Berkeley, Berkeley, California 94720 (United States) Materials Sciences Division, Lawrence Berkeley Laboratory, Berkeley, California 94720 (United States))

    1992-11-01

    The temperature-dependent resistivity of single-crystal K{sub 3}C{sub 60} is studied from the point of view of electron-electron and electron-phonon scattering. The electron-phonon analysis suggests that conventional electron-phonon coupling would be sufficient to account for the superconductivity, with contributions to the coupling from both high-frequency intraball and low-frequency interball modes. The resistivity was also compared to a quadratic temperature dependence, suggestive of electron-electron scattering at anomalously high temperatures.

  19. Controlling user access to electronic resources without password

    Science.gov (United States)

    Smith, Fred Hewitt

    2015-06-16

    Described herein are devices and techniques for remotely controlling user access to a restricted computer resource. The process includes pre-determining an association of the restricted computer resource and computer-resource-proximal environmental information. Indicia of user-proximal environmental information are received from a user requesting access to the restricted computer resource. Received indicia of user-proximal environmental information are compared to associated computer-resource-proximal environmental information. User access to the restricted computer resource is selectively granted responsive to a favorable comparison in which the user-proximal environmental information is sufficiently similar to the computer-resource proximal environmental information. In at least some embodiments, the process further includes comparing user-supplied biometric measure and comparing it with a predetermined association of at least one biometric measure of an authorized user. Access to the restricted computer resource is granted in response to a favorable comparison.

  20. Applications of geothermal resources in the evaporation and crystallization industry. Final report, September 1976--October 1977

    Energy Technology Data Exchange (ETDEWEB)

    May, S.C.; Basuino, D.J.; Doyle, P.T.; Rogers, A.N.

    1977-10-01

    The objective in this study was to determine the technical and economic feasibility of using low-temperature geothermal energy (hot brines) in place of steam from conventional sources in the evaporation and crystallization industry. A survey of major industries was carried out in order to choose three industries that were significant users of energy, could utilize geothermal brine, and demonstrate the broad range of industrial evaporation and crystallization operations. The selected industries were the preserved fruit and vegetable, sugar and confectionary products, and chemical industries. From among each of the selected industries, an example case was chosen for technical and economic evaluation. This evaluation included use of the ''feed-and-bleed'' process for energy extraction from the low-temperature geothermal brine. This process was chosen as the best process to use because it provides one of the most efficient means of utilizing geothermal brine in evaporation/crystallization operations. This study concludes that, under certain conditions, geothermal energy could be used economically in the evaporation and crystallization industry. The factors that would most affect cost include geothermal resource characteristics (well flow, temperature, and distance of transportation); the energy extraction process chosen (the feed-and-bleed process uses the least amount of brine); and the duration of the evaporation/crystallization process. A program to aid in implementing the use of geothermal energy is included.

  1. Electronic states in crystals of finite size quantum confinement of bloch waves

    CERN Document Server

    Ren, Shang Yuan

    2017-01-01

    This book presents an analytical theory of the electronic states in ideal low dimensional systems and finite crystals based on a differential equation theory approach. It provides precise and fundamental understandings on the electronic states in ideal low-dimensional systems and finite crystals, and offers new insights into some of the basic problems in low-dimensional systems, such as the surface states and quantum confinement effects, etc., some of which are quite different from what is traditionally believed in the solid state physics community. Many previous predictions have been confirmed in subsequent investigations by other authors on various relevant problems. In this new edition, the theory is further extended to one-dimensional photonic crystals and phononic crystals, and a general theoretical formalism for investigating the existence and properties of surface states/modes in semi-infinite one-dimensional crystals is developed. In addition, there are various revisions and improvements, including us...

  2. The Internet School of Medicine: use of electronic resources by medical trainees and the reliability of those resources.

    Science.gov (United States)

    Egle, Jonathan P; Smeenge, David M; Kassem, Kamal M; Mittal, Vijay K

    2015-01-01

    Electronic sources of medical information are plentiful, and numerous studies have demonstrated the use of the Internet by patients and the variable reliability of these sources. Studies have investigated neither the use of web-based resources by residents, nor the reliability of the information available on these websites. A web-based survey was distributed to surgical residents in Michigan and third- and fourth-year medical students at an American allopathic and osteopathic medical school and a Caribbean allopathic school regarding their preferred sources of medical information in various situations. A set of 254 queries simulating those faced by medical trainees on rounds, on a written examination, or during patient care was developed. The top 5 electronic resources cited by the trainees were evaluated for their ability to answer these questions accurately, using standard textbooks as the point of reference. The respondents reported a wide variety of overall preferred resources. Most of the 73 responding medical trainees favored textbooks or board review books for prolonged studying, but electronic resources are frequently used for quick studying, clinical decision-making questions, and medication queries. The most commonly used electronic resources were UpToDate, Google, Medscape, Wikipedia, and Epocrates. UpToDate and Epocrates had the highest percentage of correct answers (47%) and Wikipedia had the lowest (26%). Epocrates also had the highest percentage of wrong answers (30%), whereas Google had the lowest percentage (18%). All resources had a significant number of questions that they were unable to answer. Though hardcopy books have not been completely replaced by electronic resources, more than half of medical students and nearly half of residents prefer web-based sources of information. For quick questions and studying, both groups prefer Internet sources. However, the most commonly used electronic resources fail to answer clinical queries more than half

  3. Developing Humanities Collections in the Digital Age: Exploring Humanities Faculty Engagement with Electronic and Print Resources

    Science.gov (United States)

    Kachaluba, Sarah Buck; Brady, Jessica Evans; Critten, Jessica

    2014-01-01

    This article is based on quantitative and qualitative research examining humanities scholars' understandings of the advantages and disadvantages of print versus electronic information resources. It explores how humanities' faculty members at Florida State University (FSU) use print and electronic resources, as well as how they perceive these…

  4. Developing Humanities Collections in the Digital Age: Exploring Humanities Faculty Engagement with Electronic and Print Resources

    Science.gov (United States)

    Kachaluba, Sarah Buck; Brady, Jessica Evans; Critten, Jessica

    2014-01-01

    This article is based on quantitative and qualitative research examining humanities scholars' understandings of the advantages and disadvantages of print versus electronic information resources. It explores how humanities' faculty members at Florida State University (FSU) use print and electronic resources, as well as how they perceive these…

  5. Evolution of electronic structure and spectral evaluation in single-crystal Mn3O4 nanorods

    Science.gov (United States)

    Chen, Zhiwen; Lai, Joseph K. L.; Shek, Chan-Hung

    2006-05-01

    Single-crystal Mn3O4 nanorods with tetragonal structure have been successfully prepared by a chemical reaction route. Transmission electron microscopy (TEM) and high-resolution TEM studies prove that the single-crystal Mn3O4 nanorod is smooth and straight, and that the geometrical shape is structurally perfect. We investigated the electronic characteristics of Mn3O4 nanorods by various spectral evaluations. The present study confirms that the hybridization between oxygen 2p and manganese 3d orbits plays an important role when considering electronic structures of Mn3O4 nanorods.

  6. Electronic resource management practical perspectives in a new technical services model

    CERN Document Server

    Elguindi, Anne

    2012-01-01

    A significant shift is taking place in libraries, with the purchase of e-resources accounting for the bulk of materials spending. Electronic Resource Management makes the case that technical services workflows need to make a corresponding shift toward e-centric models and highlights the increasing variety of e-formats that are forcing new developments in the field.Six chapters cover key topics, including: technical services models, both past and emerging; staffing and workflow in electronic resource management; implementation and transformation of electronic resource management systems; the ro

  7. Possible Explanation For Multiple Electron Emission From Pyroelectric Crystals In Dilute Gases

    Science.gov (United States)

    Shafroth, Stephen; Kaleko, David; Brownridge, James

    2009-05-01

    Pyroelectric crystals such as LiNbO3 when cut perpendicular to their z axes and when heated or cooled produce strong electric fields at their surfaces. If a 4 mm dia x 10 mm crystal is immersed in a dilute gas it acts as an accelerator of electrons when the surface is negative and positive ions when the surface is positive. In both cases a focused beam results but in the electron case multiple electron peaks are observed if they are detected through a pin hole with a surface barrier detector(1). In this poster we give evidence for an explanation of this effect. (1) Brownridge, J. D., Shafroth, S. M., Trott, D. W., Stoner, B. R., and Hooke, W. M., Observation of multiple nearly monoenergetic electron production by heated pyroelectric crystals in ambient gas, Appl. Phys. Lett., 78, 1158 (2001)

  8. Optical vibration modes and electron-phonon interaction in ternary mixed crystals of polar semiconductors

    Institute of Scientific and Technical Information of China (English)

    Liang Xi-Xia; Ban Shi-Liang

    2004-01-01

    @@ Optical vibrations of the lattice and the electron-phonon interaction in polar ternary mixed crystals are studied in the framework of the continuum model of Born and Huang and the random-element-isodisplacement model. A normal-coordinate system to describe the optical vibration in ternary mixed crystals is correctly adopted to derive a new Frohlich-like Hamiltonian for the electron-phonon interaction including the unit-cell volume variation influence.The numerical results for the phonon modes, the electron-phonon coupling constants and the polaronic energies for several typical materials are obtained. It is verified that the nonlinearity of the electron-phonon coupling effects with the composition is essential and the unit-cell volume effects cannot be neglected for most ternary mixed crystals.

  9. Strategic Planning for Electronic Resources Management: A Case Study at Gustavus Adolphus College

    Science.gov (United States)

    Hulseberg, Anna; Monson, Sarah

    2009-01-01

    Electronic resources, the tools we use to manage them, and the needs and expectations of our users are constantly evolving; at the same time, the roles, responsibilities, and workflow of the library staff who manage e-resources are also in flux. Recognizing a need to be more intentional and proactive about how we manage e-resources, the…

  10. Strategic Planning for Electronic Resources Management: A Case Study at Gustavus Adolphus College

    Science.gov (United States)

    Hulseberg, Anna; Monson, Sarah

    2009-01-01

    Electronic resources, the tools we use to manage them, and the needs and expectations of our users are constantly evolving; at the same time, the roles, responsibilities, and workflow of the library staff who manage e-resources are also in flux. Recognizing a need to be more intentional and proactive about how we manage e-resources, the…

  11. The Relevancy of Graduate Curriculum to Human Resource Professionals' Electronic Communication.

    Science.gov (United States)

    Hoell, Robert C.; Henry, Gordon O.

    2003-01-01

    Electronic communications of human resource professionals and the content of 23 university human resource management courses were categorized using the Human Resource Certification Institute's body of knowledge. Differences between proportion of topics discussed and topics covered in curricula suggest some topics are over- or undertaught.…

  12. Electronic and crystal structures of thermoelectric CaMgSi intermetallic compound

    Energy Technology Data Exchange (ETDEWEB)

    Miyazaki, Hidetoshi, E-mail: miyazaki@nitech.ac.jp [Department of Frontier Materials, Nagoya Institute of Technology, Nagoya 466-8555 (Japan); Inukai, Manabu [Department of Frontier Materials, Nagoya Institute of Technology, Nagoya 466-8555 (Japan); Soda, Kazuo [Department of Quantum Engineering, Graduate School of Engineering, Nagoya University, Nagoya 464-8603 (Japan); Miyazaki, Nobufumi; Adachi, Nozomu; Todaka, Yoshikazu [Department of Mechanical Engineering, Toyohashi University of Technology, Toyohashi 441-8580 (Japan); Nishino, Yoichi [Department of Frontier Materials, Nagoya Institute of Technology, Nagoya 466-8555 (Japan)

    2016-01-15

    Highlights: • We report the electronic and crystal structures of the TiNiSi-type CaMgSi compound. • CaMgSi has a semiconductor-like electronic structure with a small band gap. • CaMgSi is a Mott-type insulator owing to strongly correlated electrons effect. - Abstract: We investigated the electronic and crystal structures of a new thermoelectric material, CaMgSi compound, by using synchrotron radiation photoemission spectroscopy (SR-PES), synchrotron radiation X-ray powder diffraction (SR-XRD) measurements, and electronic band structure calculation to understand the way leading to improvement in the thermoelectric properties of this material. Electronic band structure calculation of the CaMgSi compound using the crystal structure determined from SR-XRD measurement showed a semi-metallic electronic structure with a pseudo-gap at the Fermi level. In contrast to the predicted semi-metallic electronic structure, the SR-PES results showed a small semiconductor-like gap at the Fermi level. This result revealed that the CaMgSi compound is a Mott-type insulator owing to strongly correlated electrons effect in the Ca 3d and Mg 3p states being well hybridized with those in the Si 3p states. The observed electronic structure of the CaMgSi compound suggests that an optimal carrier doping exists to best control the n- and p-type thermoelectric properties and enhance the power factors.

  13. Colloquium: Electronic transport in single-crystal organic transistors

    NARCIS (Netherlands)

    Gershenson, M.E.; Podzorov, V.; Morpurgo, A.F.

    2006-01-01

    Small-molecule organic semiconductors, together with polymers, form the basis for the emerging field of organic electronics. Despite the rapid technological progress in this area, our understanding of fundamental electronic properties of these materials remains limited. Recently developed organic fi

  14. Results on the Coherent Interaction of High Energy Electrons and Photons in Oriented Single Crystals

    CERN Document Server

    Apyan, A; Badelek, B; Ballestrero, S; Biino, C; Birol, I; Cenci, P; Connell, S H; Eichblatt, S; Fonseca, T; Freund, A; Gorini, B; Groess, R; Ispirian, K; Ketel, T; Kononets, Y V; López, A; Mangiarotti, A; Van Rens, B; Sellschop, J P Friedel; Shieh, M; Sona, P; Strakhovenko, V M; Uggerhøj, Erik; Uggerhøj, U; Ünel, G; Velasco, M; Vilakazi, Z Z; Wessely, O; Kononets, Yu.V.

    2005-01-01

    The CERN-NA-59 experiment examined a wide range of electromagnetic processes for multi-GeV electrons and photons interacting with oriented single crystals. The various types of crystals and their orientations were used for producing photon beams and for converting and measuring their polarisation. The radiation emitted by 178 GeV unpolarised electrons incident on a 1.5 cm thick Si crystal oriented in the Coherent Bremsstrahlung (CB) and the String-of-Strings (SOS) modes was used to obtain multi-GeV linearly polarised photon beams. A new crystal polarimetry technique was established for measuring the linear polarisation of the photon beam. The polarimeter is based on the dependence of the Coherent Pair Production (CPP) cross section in oriented single crystals on the direction of the photon polarisation with respect to the crystal plane. Both a 1 mm thick single crystal of Germanium and a 4 mm thick multi-tile set of synthetic Diamond crystals were used as analyzers of the linear polarisation. A birefringence ...

  15. Electron imaging of calcium oxalate crystals in beagle dogs’ urine

    Directory of Open Access Journals (Sweden)

    Walaa I. Mohamaden

    2014-06-01

    Full Text Available Calcium oxalate crystalluria appears to be a common problem in most of small animal clinics. This current study aimed at inducing a condition of oxalate crystalluria in beagles and record the primary changes in canine blood and urine on response to oxalates injection. 15 dogs were divided into two groups; those in the treatment group were injected intravenously with 0.5 M potassium oxalate and the dogs of control group were injected with physiological saline for five successive days. Urine test revealed a significant decrease in urinary creatinine and urinary urea nitrogen levels. The ultrastructural examination of urine sediment showed typical and atypical phases of calcium oxalate crystals and the X-ray defractionation of these crystals showed high content of calcium in addition to other minerals. Therefore potassium oxalate injection may provide an example of calcium oxalate crystalluria which may answer some question around the pathogenesis of this problem in dogs.

  16. 3D electron tomography of biological photonic crystals

    Energy Technology Data Exchange (ETDEWEB)

    Butz, Benjamin; Winter, Benjamin; Vieweg, Benito; Knoke, Isabel; Spallek, Stefanie; Spiecker, Erdmann [CENEM, Universitaet Erlangen-Nuernberg (Germany); Schroeder-Turk, Gerd; Mecke, Klaus [Theoretische Physik I, Universitaet Erlangen-Nuernberg (Germany)

    2011-07-01

    Photonic crystals, i.e. periodical nanostructures of materials with different dielectric constants, are highly interesting for applications in optics, optoelectronics, and sensing. By tailoring the geometrical parameters radically different and improved optical properties (e.g., optical band-gap structure, extreme refractive indices, or high anisotropy) can be achieved. Naturally occurring photonic crystals, like butterfly scales, exoskeletons of insects (chitin), or seashells (nacre), can serve as model systems for understanding the relationship between structure and optical properties. Butterfly scales are studied by TEM using a FEI Titan{sup 3} 80-300 instrument. An optimized FIB technique or ultramicrotome sectioning were used to prepare the sensitive specimens with desired thickness. Since the periodical structures have dimensions on the sub-{mu}m scale, HAADF-STEM tomography was employed for obtaining extended tilt series under conditions of atomic-number sensitive imaging. Since the solid crystal consists of chemically homogeneous chitin while the pores are unfilled, the distinct contrast in the images can easily be interpreted in terms of the local projected mass density allowing to reconstruct the chitin distribution within the optical unit cell of the scales with high 3D resolution.

  17. Preparation of 2D crystals of membrane proteins for high-resolution electron crystallography data collection.

    Science.gov (United States)

    Abeyrathne, Priyanka D; Chami, Mohamed; Pantelic, Radosav S; Goldie, Kenneth N; Stahlberg, Henning

    2010-01-01

    Electron crystallography is a powerful technique for the structure determination of membrane proteins as well as soluble proteins. Sample preparation for 2D membrane protein crystals is a crucial step, as proteins have to be prepared for electron microscopy at close to native conditions. In this review, we discuss the factors of sample preparation that are key to elucidating the atomic structure of membrane proteins using electron crystallography.

  18. Electron crystallography of ultrathin 3D protein crystals: atomic model with charges.

    Science.gov (United States)

    Yonekura, Koji; Kato, Kazuyuki; Ogasawara, Mitsuo; Tomita, Masahiro; Toyoshima, Chikashi

    2015-03-17

    Membrane proteins and macromolecular complexes often yield crystals too small or too thin for even the modern synchrotron X-ray beam. Electron crystallography could provide a powerful means for structure determination with such undersized crystals, as protein atoms diffract electrons four to five orders of magnitude more strongly than they do X-rays. Furthermore, as electron crystallography yields Coulomb potential maps rather than electron density maps, it could provide a unique method to visualize the charged states of amino acid residues and metals. Here we describe an attempt to develop a methodology for electron crystallography of ultrathin (only a few layers thick) 3D protein crystals and present the Coulomb potential maps at 3.4-Å and 3.2-Å resolution, respectively, obtained from Ca(2+)-ATPase and catalase crystals. These maps demonstrate that it is indeed possible to build atomic models from such crystals and even to determine the charged states of amino acid residues in the Ca(2+)-binding sites of Ca(2+)-ATPase and that of the iron atom in the heme in catalase.

  19. Electronic microscopy analysis of HAP single crystals prepared by hydrothermal method

    Institute of Scientific and Technical Information of China (English)

    王友法; 闫玉华; 李美娟; 张宏泉

    2003-01-01

    H ydroxyapatite(HAP, Ca10 (PO4)6 (OH)2) is one of the quite important bone implant materials. Thehydroxyapatite crystals were synthesized under hydrothermal condition. The specimen was verified to be HAP crys-tal by the X-ray powder diffractometry(XRD). Then the specimen was distinguished single crystal from polycrystalby the use of the transmission electron microscope(TEM). The diffraction pattern of the specimen is neatly arrangeddiffraction spots, that verified the crystals were single crystals. The interplanar distance d calculated from diffrac-tion spot is coincided with that of HAP's JCPDS card. Moreover, crystal face angles calculated from crystal face in-dex are coincided with the values by measuring on the pattern. The HAP crystals are needle-like in shape with about3 μm in diameter and 180 μm in length. Most of the crystals are separate whiskers. Their length/diameter ratio ran-ges from 40 to 100. The average ratio is about 60.

  20. Mapping fullerene crystallization in a photovoltaic blend: an electron tomography study

    Science.gov (United States)

    Bäcke, Olof; Lindqvist, Camilla; Diaz de Zerio Mendaza, Amaia; Gustafsson, Stefan; Wang, Ergang; Andersson, Mats R.; Müller, Christian; Olsson, Eva

    2015-04-01

    The formation of fullerene crystals represents a major degradation pathway of polymer/fullerene bulk-heterojunction thin films that inexorably deteriorates their photovoltaic performance. Currently no tools exist that reveal the origin of fullerene crystal formation vertically through the film. Here, we show that electron tomography can be used to study nucleation and growth of fullerene crystals. A model bulk-heterojunction blend based on a thiophene-quinoxaline copolymer and a fullerene derivative is examined after controlled annealing above the glass transition temperature. We image a number of fullerene nanocrystals, ranging in size from 70 to 400 nanometers, and observe that their center is located close to the free-surface of spin-coated films. The results show that the nucleation of fullerene crystals predominately occurs in the upper part of the films. Moreover, electron tomography reveals that the nucleation is preceded by more pronounced phase separation of the blend components.

  1. Quantum and classical theories of scattering of relativistic electrons in ultrathin crystals

    CERN Document Server

    Shulga, N F

    2016-01-01

    Quantum and classical theories are proposed of scattering of high energy electrons in ultrathin crystals. The quantum theory is based upon a special representation of the scattering amplitude in the form of the integral over the surface surrounding the crystal, and on the spectral method of determination of the wave function. The classical theory is based upon the solution of the equation of motion by numerical methods. The comparison is performed of quantum and classical differential cross-sections of scattering in the transitional range of crystal thicknesses, from those at which the channeling phenomenon is not developed up to those at which it is realized. It is shown that in this range of crystal thicknesses substantial difference of quantum and classical scattering cross-sections takes place for the electrons with the energy up to tens of MeV. With the energy increase such difference decreases but some quantum effects in scattering still remain.

  2. Crystal and electronic structure study of Mn doped wurtzite ZnO nanoparticles

    Institute of Scientific and Technical Information of China (English)

    O.M. Ozkendir; S. Yildirimcan; A. Yuzer; K. Ocakoglu

    2016-01-01

    The change in the crystal and electronic structure properties of wurtzite ZnO nanoparticles was studied according to Mn doping in the powder samples. The investigations were conducted by X-ray Absorption Fine Structure Spectroscopy (XAFS) technique for the samples prepared with different heating and doping processes. Electronic analysis was carried out by the collected data from the X-ray Absorption Near-Edge Structure Spectroscopy (XANES) measurements. Additional crystal structure properties were studied by Extended-XAFS (EXAFS) analysis. Longer heating periods for the undoped wurtzite ZnO samples were determined to own stable crystal geometries. However, for some doped samples, the distortions in the crystal were observed as a result of the low doping amounts of Mn which was treated as an impurity. Besides, the changes in oxygen locations were determined to create defects and distor-tions in the samples.

  3. Crystal and electronic structure study of Mn doped wurtzite ZnO nanoparticles

    Directory of Open Access Journals (Sweden)

    O.M. Ozkendir

    2016-08-01

    Full Text Available The change in the crystal and electronic structure properties of wurtzite ZnO nanoparticles was studied according to Mn doping in the powder samples. The investigations were conducted by X-ray Absorption Fine Structure Spectroscopy (XAFS technique for the samples prepared with different heating and doping processes. Electronic analysis was carried out by the collected data from the X-ray Absorption Near-Edge Structure Spectroscopy (XANES measurements. Additional crystal structure properties were studied by Extended-XAFS (EXAFS analysis. Longer heating periods for the undoped wurtzite ZnO samples were determined to own stable crystal geometries. However, for some doped samples, the distortions in the crystal were observed as a result of the low doping amounts of Mn which was treated as an impurity. Besides, the changes in oxygen locations were determined to create defects and distortions in the samples.

  4. Performance of the x-ray free-electron laser oscillator with crystal cavity

    Directory of Open Access Journals (Sweden)

    R. R. Lindberg

    2011-01-01

    Full Text Available Simulations of the x-ray free-electron laser (FEL oscillator are presented that include the frequency-dependent Bragg crystal reflectivity and the transverse diffraction and focusing using the two-dimensional FEL code GINGER. A review of the physics of Bragg crystal reflectors and the x-ray FEL oscillator is made, followed by a discussion of its numerical implementation in GINGER. The simulation results for a two-crystal cavity and realistic FEL parameters indicate ∼10^{9} photons in a nearly Fourier-limited, ps pulse. Compressing the electron beam to 100 A and 100 fs results in comparable x-ray characteristics for relaxed beam emittance, energy spread, and/or undulator parameters, albeit in a larger radiation bandwidth. Finally, preliminary simulation results indicate that the four-crystal FEL cavity can be tuned in energy over a range of a few percent.

  5. Crystal structure prediction and electronic properties of Li-based ternary compounds

    Energy Technology Data Exchange (ETDEWEB)

    Vergniory, Maia G.; Sanna, Antonio; Ernst, Arthur; Romero, Aldo H.; Gross, Eberhard K.U. [Max Planck Institute of Microstructure Physics, 06120 Halle (Germany); Marques, Miguel A.L.; Botti, Silvana; Valencia, Irais [Universite de Lyon, F-69000 Lyon, France and LPMCN, CNRS, UMR 5586, Universite Lyon 1, F-69622 Villeurbanne (France); Amsler, Max; Goedecker, Stefan [Department of Physics, Universitaet Basel, Klingelbergstr. 82, 4056 Basel (Switzerland); Chulkov, Evgueni V. [Donostia International Physics Center, 20018 Donostia-San Sebastian (Spain)

    2013-07-01

    On the basis of ab initio first principles and using the Minimal Hopping Algorithm we predict the crystal structure of non synthesized LiYZ (Y=Au,Ag, Z=Te,Se) based ternary compounds. We find that, as distinct from expectation, the crystal structure depends strongly on the composition, thus every compound belongs to a different symmetry group and has complexly different electronic properties. We analyze the fundamental physics below these features considering the calculated ground state structure.

  6. 2015 Utilization of Electronic Information Resources in Ramat ...

    African Journals Online (AJOL)

    intensely powerful and has permeated all segments and ... Web (WWW) and the internet to make information more accessible. On the other ... access points on the campus and computer literacy is till .... resources are often faster to consult than.

  7. Characteristics of the fast electron emission produced during the cleavage of crystals

    Indian Academy of Sciences (India)

    B P Chandra; N L Patel; S S Rahangdale; R P Patel; V K Patle

    2003-01-01

    The present paper reports the fast electron emission produced during the cleavage of alkali halide crystals and models the dynamics of the process. The mechano-emission arises as a result of the ionization of surface traps at the expense of the energy which is released in the annihilation of the defects which are formed during cleavage. The slow electrons which appear upon the ionization of surface traps are subsequently accelerated in the field of negatively charged segment of the freshly cleaved surface. Considering the basic mechanism of fast electron emission, expressions are derived which are able to explain satisfactorily the temporal, thermal, charge, surface, coloration, water adsorption and other characteristics of the fast electron emission produced during the cleavage of crystals. The decay time of the charges on the newly created surfaces, and the velocity of cracks can be determined from the measurements of fast electron emission produced during the cleavage of crystals. It is shown that two types of diffusing centres are responsible for the charge relaxation and thereby for the emission of fast electrons produced during the cleavage of alkali halide crystals.

  8. Remote Electronic Resources and the OPAC: Illustrated by the Unisa Library Experience.

    Science.gov (United States)

    Van der Merwe, Ina; Van Eeden, Welna; Hartzer, Sandra

    This paper describes the Unisa (University of South Africa) Library's experience with cataloging remote electronic resources, including electronic journals, electronic text files, online databases, digital images, Unisa campus Web sites, and mailing list discussions. The first section discusses the decision to add bibliographic references for…

  9. Quantum electron plasma in one-dimensional metallic-dielectric photonic crystal

    Science.gov (United States)

    Zverev, N. V.; Yushkanov, A. A.

    2017-02-01

    The interaction of the electromagnetic radiation with one-dimensional photonic crystal consisting of metal and transparent dielectric medium is studied numerically. Dielectric permeabilities of the electron plasma in the metal are considered both in the quantum Mermin and in the classical Drude-Lorentz approaches. It is shown that the reflection, transmission and absorption-frequency zones of electromagnetic radiation appear in the photonic crystal. In addition, the reflectance, transmittance and absorptance optical coefficients for such photonic crystal in the quantum approach differ from those coefficients in the Drude-Lorentz approach.

  10. Batch crystallization of rhodopsin for structural dynamics using an X-ray free-electron laser

    Energy Technology Data Exchange (ETDEWEB)

    Wu, Wenting; Nogly, Przemyslaw; Rheinberger, Jan; Kick, Leonhard M.; Gati, Cornelius; Nelson, Garrett; Deupi, Xavier; Standfuss, Jörg; Schertler, Gebhard; Panneels, Valérie, E-mail: valerie.panneels@psi.ch [Paul Scherrer Institute, OFLC/103, 5232 Villigen-PSI (Switzerland)

    2015-06-27

    A new batch preparation method is presented for high-density micrometre-sized crystals of the G protein-coupled receptor rhodopsin for use in time-resolved serial femtosecond crystallography at an X-ray free-electron laser using a liquid jet. Rhodopsin is a membrane protein from the G protein-coupled receptor family. Together with its ligand retinal, it forms the visual pigment responsible for night vision. In order to perform ultrafast dynamics studies, a time-resolved serial femtosecond crystallography method is required owing to the nonreversible activation of rhodopsin. In such an approach, microcrystals in suspension are delivered into the X-ray pulses of an X-ray free-electron laser (XFEL) after a precise photoactivation delay. Here, a millilitre batch production of high-density microcrystals was developed by four methodical conversion steps starting from known vapour-diffusion crystallization protocols: (i) screening the low-salt crystallization conditions preferred for serial crystallography by vapour diffusion, (ii) optimization of batch crystallization, (iii) testing the crystal size and quality using second-harmonic generation (SHG) imaging and X-ray powder diffraction and (iv) production of millilitres of rhodopsin crystal suspension in batches for serial crystallography tests; these crystals diffracted at an XFEL at the Linac Coherent Light Source using a liquid-jet setup.

  11. Metallic Na formation in NaCl crystals with irradiation of electron or vacuum ultraviolet photon

    Energy Technology Data Exchange (ETDEWEB)

    Owaki, Shigehiro [Osaka Prefecture Univ., Sakai, Osaka (Japan). Coll. of Integrated Arts and Sciences; Koyama, Shigeko; Takahashi, Masao; Kamada, Masao; Suzuki, Ryouichi

    1997-03-01

    Metallic Na was formed in NaCl single crystals with irradiation of a variety of radiation sources and analyzed the physical states with several methods. In the case of irradiation of 21 MeV electron pulses to the crystal blocks, the optical absorption and lifetime measurement of positron annihilation indicated appearance of Na clusters inside. Radiation effects of electron beam of 30 keV to the crystals in vacuum showed the appearance of not only metallic Na but atomic one during irradiation with Auger electron spectroscopy. Intense photon fluxes in vacuum ultraviolet region of synchrotron radiation were used as another source and an analyzing method of ultraviolet photoelectron spectroscopy. The results showed the metallic Na layered so thick that bulk plasmon can exist. (author)

  12. NATO Advanced Study Institute on Electronic Structure of Polymers and Molecular Crystals

    CERN Document Server

    Ladik, János

    1975-01-01

    The NATO Advanced Study Institute on "Electronic Structure of Polymers and Molecular Crystals" was held at the Facultes Universi­ taires de Namur (F.U.N.) from September 1st till September 14th, 1974. We wish to express our appreciation to the NATO Scientific Affairs Division whose generous support made this Institute possible and to the Facultes Universitaires de Namur and the Societe Chimique de Belgique which provided fellowships and travel grants to a number of students. This volume contains the main lectures about the basic principles of the field and about different recent developments of the theory of the electronic structure of polymers and molecular crystals. The school started with the presentation of the basic SCF-LCAO theory of the electronic structure of periodic polymers and molecular crystals (contributions by Ladik, Andre & Delhalle) showing how a combination of quantum chemical and solid state physical methods can provide band structures for these systems. The numerical aspects of these ...

  13. Scalable Fabrication of 2D Semiconducting Crystals for Future Electronics

    Directory of Open Access Journals (Sweden)

    Jiantong Li

    2015-12-01

    Full Text Available Two-dimensional (2D layered materials are anticipated to be promising for future electronics. However, their electronic applications are severely restricted by the availability of such materials with high quality and at a large scale. In this review, we introduce systematically versatile scalable synthesis techniques in the literature for high-crystallinity large-area 2D semiconducting materials, especially transition metal dichalcogenides, and 2D material-based advanced structures, such as 2D alloys, 2D heterostructures and 2D material devices engineered at the wafer scale. Systematic comparison among different techniques is conducted with respect to device performance. The present status and the perspective for future electronics are discussed.

  14. First Principles Study on Electronic Structures of Mn2+:CdMoO4 Crystals

    Institute of Scientific and Technical Information of China (English)

    WANG Xi-En; LIU Ting-Yu; ZHANG Qi-Ren; ZHANG Hai-Yan; SONG Min; GUO Xiao-Feng; YIN Ji-Gang

    2008-01-01

    @@ Electronic structures of the Mn2+:CdMoO4 crystal are studied within the framework of the fully relativistic self-consistent Dirac-Slater theory,using a numerically discrete variation (DV-Xα)method.The calculated results indicate that the 3d states of Mn have donor energy level in the forbidden band of CdMoO4 crystal.The transition energy of O 2p→Mn 3d is 3.12 eV under excitation corresponding electronic transition being O2-+Mn2+ hvex=3.12 eV→ O-+Mn+hvem→O2+Mn2+.

  15. Electronic properties of crystalline fluorides of a cubic crystal system

    Science.gov (United States)

    Eremin, I. E.; Eremin, E. L.; Demchuk, V. A.; Moiseenko, V. G.

    2014-01-01

    The possibility of effective mathematical modeling of polarization characteristics of crystalline dielectrics is considered. It is shown that the generation of frequency dielectric spectra of the substances under consideration, which equivalent to their physically measured properties, gives the objective possibility of mediated visualization of their electron-atomic structure.

  16. Automated determination of crystal orientations from electron backscattering patterns

    DEFF Research Database (Denmark)

    Lassen, Niels Christian Krieger

    1994-01-01

    determination of crystallographic orientations from EBSPs is accurate knowledge of three calibration parameters which describe the position of the point from which the patterns are emitted relative to the phosphor screen on which they are recorded. This thesis will describe a novel method by which...... of the position of the bands or the zone axes of EBSPs have existed for several years now. Until recently, however, the localization of either the bands or the zone axes of EBSPs has required the valuable time and attention of a human operator, thus obviously limiting the amounts of orientation data that can...... these calibration parameters can be estimated with high precision. The quality of EBSPs provides important information about the reliability of the measured crystal orientations and about the perfection of the lattice in which the pattern is generated. A measure which allows the quality of EBSPs to be evaluated...

  17. Studies on Crystal Growth, Vibrational, Electronic Properties of Nonlinear Optical Crystal: Triglycine Phosphate

    Science.gov (United States)

    Meera, M. R.; Dipuna Das, C. N.; Bena Jothy, V.; Rayar, S. L.

    2016-10-01

    Nonlinear optics is a topic of much current interest that exhibits a great diversity. This is due to the technological potentials of certain nonlinear optical effects for photonic based technologies. Many NLO crystals grown by mixing amino acids with various organic and inorganic acids have been reported in the literature. Hence, glycine mixed semi-organic material will be of special interest as a fundamental building block to develop many complex crystals with improved NLO properties. In this context, the present work it is attempted to grow NLO active Triglycine phosphate [(NH2CH2COOH)3H3PO4](TGP) crystal from aqueous solution at room temperature by slow evaporation method. The geometry, intermolecular hydrogen bonding and harmonic vibrational wavenumbers of TGP was investigated with the help of B3LYP density functional theory (DFT) methods. Natural Bond Orbital (NBO) analysis confirms the occurrence of strong intermolecular N-H...O hydrogen bond. Second harmonic frequency generation was examined by Kurtz and Perry powder test. Theoretical first order hyperpolarizability value was calculated.

  18. Controlling user access to electronic resources without password

    Energy Technology Data Exchange (ETDEWEB)

    Smith, Fred Hewitt

    2017-08-22

    Described herein are devices and techniques for remotely controlling user access to a restricted computer resource. The process includes obtaining an image from a communication device of a user. An individual and a landmark are identified within the image. Determinations are made that the individual is the user and that the landmark is a predetermined landmark. Access to a restricted computing resource is granted based on the determining that the individual is the user and that the landmark is the predetermined landmark. Other embodiments are disclosed.

  19. Investigation of pyroelectric electron emission from monodomain lithium niobate single crystals

    Energy Technology Data Exchange (ETDEWEB)

    Bourim, El Mostafa [Samsung Advanced Institute of Technology, U-Team, P.O. Box 111, Suwon, Kyongki 440-600 (Korea, Republic of)]. E-mail: em.bourim@samsung.com; Moon, Chang-Wook [Samsung Advanced Institute of Technology, U-Team, P.O. Box 111, Suwon, Kyongki 440-600 (Korea, Republic of); Lee, Seung-Woon [Samsung Advanced Institute of Technology, U-Team, P.O. Box 111, Suwon, Kyongki 440-600 (Korea, Republic of); Kyeong Yoo, In [Samsung Advanced Institute of Technology, U-Team, P.O. Box 111, Suwon, Kyongki 440-600 (Korea, Republic of)

    2006-09-01

    The behaviors of thermally stimulated electron emission from pyroelectric monodomain lithium niobate single crystal (LiNbO{sub 3}) were investigated by utilizing a Si p-n junction photodiode as electron detector and a receptive electron beam resist (E-beam resist) as electron collector. In high vacuum (10{sup -6} Torr), the pyroelectric electron emission (PEE) was found to depend on the exposed emitting polar crystal surface (+Z face or -Z face) and was significantly influenced by the emitter-electron receiver gap distances. Thus, the PEE from +Z face was detected during heating and was activated, in small gaps (<2 mm), by field emission effect on which was superposed an intense field ionization effect that primed intermittent runway ionizations (plasma breakdown into a glow discharge). In large gaps (>2 mm) the emission was simply mastered by field emission effect. Whereas, The PEE from -Z face was detected during cooling and was solely due to the field ionization effect. Therewith, for small gaps (<2 mm) the emission was governed by intermittent runway ionization ignitions resulting from a high ionization degree leading to dense plasma formation, and for large gaps (>2 mm) PEE was governed by field ionization generating a soft and continuous plasma ambient atmosphere. Significant decrease of electron emission current was observed from +Z face after successive thermal cycles. A fast and fully emission recovery was established after a brief exposure of crystal to a poor air vacuum of 10{sup -1} Torr.

  20. Electronic relaxations of radiative defects of the anion sublattice in cesium bromide crystals and exoemission of electrons

    CERN Document Server

    Galyij, P V

    2002-01-01

    The paper presents the results of investigations of thermostimulated exoelectron emission (TSEE) from CsBr crystal, excited by moderate doses (D <= 10 sup 4 Gy) of ultraviolet (h nu <= 7 eV) that selectively creates anion excitons and radiative defects in the anion sublattice. Having used the previously established connection between thermoactivated processes such as thermostimulated exoemission, electroconductivity, and luminescence in the irradiated crystal lattice, the concentrations of exoemission-active centers (EAC) and kinetics parameters of TSEE are calculated. The EAC concentration calculated on a base of the bulk, thermoactivated-recombinational, and band-gap Auger-like exoemission mechanisms, are in satisfactory agreement with the concentration of electron color centers in the irradiated crystals.

  1. Radiation of high-energy electrons near crystallographic axes and planes of a diamond crystal

    Energy Technology Data Exchange (ETDEWEB)

    Avakyan, R.O.; Avakyan, E.O.; Avetisyan, A.E.

    1986-05-01

    The paper is devoted to the experimental study of high-energy electrons interaction with diamond crystals of different thicknesses at small incident angles with respect to crystallographic axes and planes. The effect of the so-called channeling phenomenon on the process of electron radiation in a crystal is studied. Results of the measurements of 4.5. GeV electrons radiation spectra at incident angles approximately O are given. For comparison, we have also presented the spectrum of the radiation on an amorphous target /sup 12/C of similar thickness. Results indicate that the low-energy part of spectra greatly surpass the amorphous spectrum with a pronounced peak structure, with peak widths being noticeably wider in the case of axial channeling than in the planar case. Spectra are measured by a No.I(Tl) total absorption detector. The experiment is performed on the Yerevan electron synchrotron beam with small angular divergence.

  2. Coherent X-ray radiation excited by a diverging relativistic electron beam in a single crystal

    Energy Technology Data Exchange (ETDEWEB)

    Blazhevich, S. V., E-mail: noskovbupk@mail.ru; Noskov, A. V. [Belgorod State National Research University (Russian Federation)

    2015-05-15

    We develop a dynamic theory of coherent X-rays generated in a single-crystal wafer by a diverging relativistic electron beam. The dependence of the spectral-angular density of coherent X-ray radiation on the angle of divergence is analyzed for the case when the angular spread can be described by the 2D Gaussian distribution. The theory constructed here makes it possible to analyze coherent radiation for an arbitrary angular distribution of electrons in the beam as well.

  3. Dark-field transmission electron microscopy of cortical bone reveals details of extrafibrillar crystals.

    Science.gov (United States)

    Schwarcz, Henry P; McNally, Elizabeth A; Botton, Gianluigi A

    2014-12-01

    In a previous study we showed that most of the mineral in bone is present in the form of "mineral structures", 5-6nm-thick, elongated plates which surround and are oriented parallel to collagen fibrils. Using dark-field transmission electron microscopy, we viewed mineral structures in ion-milled sections of cortical human bone cut parallel to the collagen fibrils. Within the mineral structures we observe single crystals of apatite averaging 5.8±2.7nm in width and 28±19nm in length, their long axes oriented parallel to the fibril axis. Some appear to be composite, co-aligned crystals as thin as 2nm. From their similarity to TEM images of crystals liberated from deproteinated bone we infer that we are viewing sections through platy crystals of apatite that are assembled together to form the mineral structures.

  4. Development of the timing branch electronics for the crystal barrel calorimeter

    Energy Technology Data Exchange (ETDEWEB)

    Klassen, Peter [Helmholtz-Institut fuer Strahlen- und Kernphysik, Nussallee 14-16, 53115 Bonn (Germany); Collaboration: CBELSA/TAPS-Collaboration

    2015-07-01

    The excitation spectrum of baryons consists of many resonances which contribute selectively to distinct decay channels. To be able to measure purely neutral reactions on a polarized neutron target with high efficiency, the Crystal Barrel Detector which consists of 1320 CsI(Tl) crystals has to be integrated into the first level trigger. This requires an exchange of the existing PIN photo diode by a new avalanche photo diode (APD) crystal readout. The APD readout electronics will provide a fast trigger signal down to 10 MeV energy deposit per crystal. The processing of these trigger signals requires an introduction of a previously not existent timing branch to the readout chain of the main calorimeter. The final concept and current development status of the timing back-end are presented. It utilizes FPGA based boards for rise time compensation, time to digital conversion and the cluster finding.

  5. Carbon-nanotube electron-beam (C-beam) crystallization technique for silicon TFTs

    Science.gov (United States)

    Lee, Su Woong; Kang, Jung Su; Park, Kyu Chang

    2016-02-01

    We introduced a carbon-nanotube (CNT) electron beam (C-beam) for thin film crystallization and thin film transistor (TFT) applications. As a source of electron emission, a CNT emitter which had been grown on a silicon wafer with a resist-assisted patterning (RAP) process was used. By using the C-beam exposure, we successfully crystallized a silicon thin film that had nano-sized crystalline grains. The distribution of crystalline grain size was about 10 ˜ 30 nm. This nanocrystalline silicon thin film definitely had three crystalline directions which are (111), (220) and (311), respectively. The silicon TFTs crystallized by using a C-beam exposure showed a field effect mobility of 20 cm2/Vs and an on/off ratio of more than 107. The C-beam exposure can modify the bonding network of amorphous silicon with its proper energy.

  6. Two-dimensional crystallization of integral membrane proteins for electron crystallography.

    Science.gov (United States)

    Stokes, David L; Rice, William J; Hu, Minghui; Kim, Changki; Ubarretxena-Belandia, Iban

    2010-01-01

    Although membrane proteins make up 30% of the proteome and are a common target for therapeutic drugs, determination of their atomic structure remains a technical challenge. Electron crystallography represents an alternative to the conventional methods of X-ray diffraction and NMR and relies on the formation of two-dimensional crystals. These crystals are produced by reconstituting purified, detergent-solubilized membrane proteins back into the native environment of a lipid bilayer. This chapter reviews methods for producing two-dimensional crystals and for screening them by negative stain electron microscopy. In addition, we show examples of the different morphologies that are commonly obtained and describe basic image analysis procedures that can be used to evaluate their promise for structure determination by cryoelectron microscopy.

  7. Direct observation of defect structure in protein crystals by atomic force and transmission electron microscopy

    Energy Technology Data Exchange (ETDEWEB)

    Devaud, G. (Department of Physics, University of Colorado, Boulder, Colorado 80309 (United States)); Furcinitti, P.S. (Department of Molecular, Cellular and Developmental Biology, University of Colorado, Boulder, Colorado 80309 (United States)); Fleming, J.C.; Lyon, M.K.; Douglas, K. (Department of Physics, University of Colorado, Boulder, Colorado 80309 (United States))

    1992-09-01

    We have examined the structure of S-layers isolated from {ital Sulfolobus} {ital acidocaldarius} using atomic force microscopy (AFM) and transmission electron microscopy (TEM). From the AFM images, we were able to directly observe individual dimers of the crystal, defects in the crystal structure, and twin boundaries. We have identified two types of boundaries, one defined by a mirror plane and the other by a glide plane. This work shows that twin boundaries are highly structured regions that are directly related to the organization of units within each crystal domain. Projection maps from TEM images have shown that there are significant differences in the final average maps, depending on which side of the sample is adsorbed to the carbon support film. Comparison of AFM images to TEM projection maps has allowed us to relate high magnification views obtained by AFM to the relatively high resolution information obtained by electron microscopy and image processing.

  8. Study of macro- and micro-segregation of iridium in molybdenum single crystals after electron beam zone melting

    Energy Technology Data Exchange (ETDEWEB)

    Drapala, Jaromir; Skotnicova, Katerina [VSB-Technical University of Ostrava (Czech Republic). Dept. of Non-ferrous Metals, Refining and Recycling

    2013-01-15

    The aim of the work was to study the creation of micro- and macro-segregation of iridium in low-alloyed molybdenum single crystals after electron beam zone melting (floating zone technique) depending on various conditions of crystallization. In order to evaluate relations between the chemical inhomogeneity and structural defects and their influence on properties of single crystals, the dependence of concentration and character of distribution of admixtures under various crystallization conditions on the origin of concentration undercooling and dislocation substructure of molybdenum single crystals prepared by electron beam floating zone melting was experimentally investigated.

  9. Calculation of inelastic scattering processes of relativistic electrons in oriented crystals

    Energy Technology Data Exchange (ETDEWEB)

    Hinderks, Dieter; Kohl, Helmut

    2015-04-15

    The inelastic scattering of electrons in oriented crystals has been used to determine the positions of atoms within a crystal, to obtain site-dependent electron energy loss spectra and, more recently, to obtain an energy loss signal corresponding to the circular dichroism in X-ray absorption spectroscopy. The theoretical approaches currently used for the description of these processes are based on the nonrelativistic Schrödinger equation. Nowadays many experiments, however, are conducted with incident energies of 200 or 300 keV. Therefore it is indispensable to use a relativistic description for such processes based on the Dirac equation. Using the Coulomb gauge it is shown, that the fully relativistic cross sections for plane wave scattering are given by the modulus square of a sum of two terms: one describing the electrostatic interactions similar to the nonrelativistic theory plus one additional term describing the interaction of the specimen with the magnetic field produced by the incident electron. In crystals both terms can interfere leading to large deviations from nonrelativistic theory. - Highlights: • Inelastic scattering of relativistic electrons in oriented crystals is described. • We have derived equations for relativistic Bloch waves. • Strong deviations from nonrelativistic theory have been demonstrated.

  10. Crystal and electronic structure of a new metallic modification of (ET)2[KHg(SCN)4].

    Science.gov (United States)

    Kazheva, Olga N; Canadell, Enric; Aleksandrov, Grigorii G; Kushch, Nataliya D; Dyachenko, Oleg A

    2002-06-01

    A new room-temperature metallic modification of the well known radical cation salt (ET)(2)[KHg(SCN)(4)] has been prepared by electrochemical oxidation of ET. Its crystal and electronic structure have been examined at 110 K. The salt has a layered structure in which the conducting layers are characterized by the delta-type packing.

  11. Crystal growth and electronic structure of low-temperature phase SrMgF{sub 4}

    Energy Technology Data Exchange (ETDEWEB)

    Atuchin, Victor V. [Laboratory of Optical Materials and Structures, Institute of Semiconductor Physics, SB RAS, Novosibirsk 630090 (Russian Federation); Functional Electronics Laboratory, Tomsk State University, Tomsk 634050 (Russian Federation); Laboratory of Semiconductor and Dielectric Materials, Novosibirsk State University, Novosibirsk 630090 (Russian Federation); Goloshumova, Alina A. [Laboratory of Crystal Growth, Institute of Geology and Mineralogy, SB RAS, Novosibirsk 630090 (Russian Federation); Isaenko, Ludmila I. [Laboratory of Semiconductor and Dielectric Materials, Novosibirsk State University, Novosibirsk 630090 (Russian Federation); Laboratory of Crystal Growth, Institute of Geology and Mineralogy, SB RAS, Novosibirsk 630090 (Russian Federation); Jiang, Xingxing [BCCRD, Key Laboratory of Functional Crystals and Laser Technology, Technical Institute of Physics and Chemistry, Chinese Academy of Sciences, Beijing 100190 (China); University of Chinese Academy of Sciences, Beijing 100049 (China); Lobanov, Sergey I. [Laboratory of Crystal Growth, Institute of Geology and Mineralogy, SB RAS, Novosibirsk 630090 (Russian Federation); Zhang, Zhaoming [Australian Nuclear Science & Technology Organisation, Lucas Heights, NSW 2234 (Australia); Lin, Zheshuai, E-mail: zslin@mail.ipc.ac.cn [BCCRD, Key Laboratory of Functional Crystals and Laser Technology, Technical Institute of Physics and Chemistry, Chinese Academy of Sciences, Beijing 100190 (China)

    2016-04-15

    Using the vertical Bridgman method, the single crystal of low temperature phase SrMgF{sub 4} is obtained. The crystal is in a very good optical quality with the size of 10×7×5 mm{sup 3}. Detailed photoemission spectra of the element core levels are determined by a monochromatic AlKa (1486.6 eV) X-ray source. Moreover, the first-principles calculations are performed to investigate the electronic structure of SrMgF{sub 4}. A good agreement between experimental and calculated results is achieved. It is demonstrated that almost all the electronic orbitals are strongly localized and the hybridization with the others is very small, but the Mg–F bonds covalency is relatively stronger than that of Sr–F bonds. - Graphical abstract: Large size of low-temperature phase SrMgF{sub 4} crystal was obtained (right) and its electronic structure was investigated by X-ray photoelectron spectroscopy and first-principles calculation (left). - Highlights: • Large size single crystal of low-temperature phase SrMgF{sub 4} is obtained. • Electronic structure of SrMgF{sub 4} is measured by X-ray photoelectron spectroscopy. • Partial densities of states are determined by first-principles calculation. • Good agreement between experimental and calculated results is achieved. • Strong ionic characteristics of chemical bonds are exhibited in SrMgF{sub 4}.

  12. Interface Engineering for Organic Electronics; Manufacturing of Hybrid Inorganic-Organic Molecular Crystal Devices

    NARCIS (Netherlands)

    de Veen, P.J.

    2011-01-01

    Organic semiconductors are at the basis of Organic Electronics. Objective of this dissertation is “to fabricate high-quality organic molecular single-crystal devices”, to explore the intrinsic properties of organic semiconductors. To achieve this, the in situ fabrication of complete field-effect

  13. Characterization of calcium crystals in Abelia using x-ray diffraction and electron microscopes

    Science.gov (United States)

    Localization, chemical composition, and morphology of calcium crystals in leaves and stems of Abelia mosanensis and A. ×grandiflora were analyzed with a variable pressure scanning electron microscope (VP-SEM) equipped with an X-ray diffraction system, low temperature SEM (LT-SEM) and a transmission ...

  14. An Evaluation of Electronic Product Design Education Using Hypermedia-Resourced Learning Environments

    Science.gov (United States)

    Page, Tom; Thorsteinsson, Gisli

    2006-01-01

    The work outlined here provides a comprehensive report and formative observations of the development and implementation of hypermedia resources for learning and teaching used in conjunction with a managed learning environment (MLE). These resources are used to enhance teaching and learning of an electronics module in product design at final year…

  15. A Study on Developing Evaluation Criteria for Electronic Resources in Evaluation Indicators of Libraries

    Science.gov (United States)

    Noh, Younghee

    2010-01-01

    This study aimed to improve the current state of electronic resource evaluation in libraries. While the use of Web DB, e-book, e-journal, and other e-resources such as CD-ROM, DVD, and micro materials is increasing in libraries, their use is not comprehensively factored into the general evaluation of libraries and may diminish the reliability of…

  16. Managing Selection for Electronic Resources: Kent State University Develops a New System to Automate Selection

    Science.gov (United States)

    Downey, Kay

    2012-01-01

    Kent State University has developed a centralized system that manages the communication and work related to the review and selection of commercially available electronic resources. It is an automated system that tracks the review process, provides selectors with price and trial information, and compiles reviewers' feedback about the resource. It…

  17. Ab-initio crystal structure analysis and refinement approaches of oligo p-benzamides based on electron diffraction data

    DEFF Research Database (Denmark)

    Gorelik, Tatiana E; van de Streek, Jacco; Kilbinger, Andreas F M

    2012-01-01

    Ab-initio crystal structure analysis of organic materials from electron diffraction data is presented. The data were collected using the automated electron diffraction tomography (ADT) technique. The structure solution and refinement route is first validated on the basis of the known crystal stru...

  18. Where Do Electronic Books Fit in the College Research Arsenal of Resources?

    Science.gov (United States)

    Barbier, Patricia

    2007-01-01

    Student use of electronic books has become an accepted supplement to traditional resources. Student use and satisfaction was monitored through an online course discussion board. Increased use of electronic books indicate this service is an accepted supplement to the print book collection.

  19. Where Do Electronic Books Fit in the College Research Arsenal of Resources?

    Science.gov (United States)

    Barbier, Patricia

    2007-01-01

    Student use of electronic books has become an accepted supplement to traditional resources. Student use and satisfaction was monitored through an online course discussion board. Increased use of electronic books indicate this service is an accepted supplement to the print book collection.

  20. Pyrolysis mechanism for recycle renewable resource from polarizing film of waste liquid crystal display panels.

    Science.gov (United States)

    Wang, Ruixue; Xu, Zhenming

    2014-08-15

    Liquid crystal display (LCD) panels mainly consist of polarizing film, liquid crystal and glass substrates. In this study, a novel pyrolysis model and a pyrolysis mechanism to recover the reusable resource from polarizing film of waste LCD panels was proposed. Polarizing film and its major components, such as cellulose triacetate (TAC) and polyvinyl alcohol (PVA) were pyrolyzed, respectively, to model the pyrolysis process. The pyrolysis process mainly generated a large ratio of oil, a few gases and a little residue. Acetic acid was the main oil product and could be easily recycled. The pyrolysis mechanism could be summarized as follows: (i) TAC, the main component of polarizing film, was heated and generated active TAC with a low polymerization, and then decomposed into triacetyl-d-glucose. (ii) Some triacetyl-d-glucose generated triacetyl-d-mannosan and its isomers through an intramolecular dehydration, while most triacetyl-d-glucose generated the main oil product, namely acetic acid, through a six-member cyclic transition state. (iii) Meanwhile, other products formed through a series of bond cleavage, dehydration, dehydrogenation, interesterification and Diels-Alder cycloaddition. This study could contribute significantly to understanding the polarizing film pyrolysis performance and serve as guidance for the future technological parameters control of the pyrolysis process.

  1. Batch crystallization of rhodopsin for structural dynamics using an X-ray free-electron laser.

    Science.gov (United States)

    Wu, Wenting; Nogly, Przemyslaw; Rheinberger, Jan; Kick, Leonhard M; Gati, Cornelius; Nelson, Garrett; Deupi, Xavier; Standfuss, Jörg; Schertler, Gebhard; Panneels, Valérie

    2015-07-01

    Rhodopsin is a membrane protein from the G protein-coupled receptor family. Together with its ligand retinal, it forms the visual pigment responsible for night vision. In order to perform ultrafast dynamics studies, a time-resolved serial femtosecond crystallography method is required owing to the nonreversible activation of rhodopsin. In such an approach, microcrystals in suspension are delivered into the X-ray pulses of an X-ray free-electron laser (XFEL) after a precise photoactivation delay. Here, a millilitre batch production of high-density microcrystals was developed by four methodical conversion steps starting from known vapour-diffusion crystallization protocols: (i) screening the low-salt crystallization conditions preferred for serial crystallography by vapour diffusion, (ii) optimization of batch crystallization, (iii) testing the crystal size and quality using second-harmonic generation (SHG) imaging and X-ray powder diffraction and (iv) production of millilitres of rhodopsin crystal suspension in batches for serial crystallography tests; these crystals diffracted at an XFEL at the Linac Coherent Light Source using a liquid-jet setup.

  2. Tl10Hg3Cl16: Single crystal growth, electronic structure and piezoelectric properties

    Science.gov (United States)

    Khyzhun, O. Y.; Piasecki, M.; Kityk, I. V.; Luzhnyi, I.; Fedorchuk, A. O.; Fochuk, P. M.; Levkovets, S. I.; Karpets, M. V.; Parasyuk, O. V.

    2016-10-01

    Single crystal of the ternary halide Tl10Hg3Cl16 was grown using Bridgman-Stockbarger method. For the Tl10Hg3Cl16 crystal, we have measured X-ray photoelectron spectra for both pristine and Ar+ ion-bombarded surfaces and additionally investigated photoinduced piezoelectricity. Our data indicate that the Tl10Hg3Cl16 single crystal surface is very sensitive with respect to Ar+ ion-bombardment. In particular, Ar+ ion-bombardment with energy of 3.0 keV over 5 min at an ion current density of 14 μA/cm2 causes significant changes of the elemental stoichiometry of the Tl10Hg3Cl16 surface resulting in an abrupt decrease of the mercury content in the top surface layers of the studied single crystal. As a result of the treatment, the mercury content becomes nil in the top surface layers. In addition, the present XPS measurements allow for concluding about very low hygroscopicity of the Tl10Hg3Cl16 single crystal surface. The property is extremely important for the crystal handling in optoelectronic or nano-electronic devices working at ambient conditions. The photoinduced piezoelectricity has been explored for Tl10Hg3Cl16 depending on nitrogen (λ=371 nm) laser power density and temperature.

  3. Dynamical scattering and electron diffraction from thin polymer lamellar crystals - poly(tert-butylethylene sulfide).

    Science.gov (United States)

    Dorset; Dumas; Cartier; Lotz

    1999-09-01

    Strong violations of Friedel symmetry are observed in hk0 electron diffraction patterns from lamellar crystals of poly(tert-butylethylene sulfide) obtained at 120 kV. These deviations are largely explained by a multislice dynamical scattering calculation based on the crystal structure model. Further improvement is found when a secondary scattering component is added, in keeping with a perfect crystallite thickness less than that of the lamellar thickness. Despite the multiple-scattering perturbations, the frustrated chain packing can still be determined by direct methods followed by Fourier refinement. However, the Friedel-related intensities must be averaged before calculation of normalized structure factors.

  4. Bismuth zinc vanadate, BiZn2VO6 : new crystal structure type and electronic structure.

    OpenAIRE

    Nunes, Sayonara Eliziario; Wang, Chun-Hai; So, Karwei; Evans, John S. O.; Evans, Ivana Radosavljevic

    2015-01-01

    We report a combined experimental and computational study of the crystal structure and electronic properties of bismuth zinc vanadate, BiZn2VO6, known for its visible light photocatalytic activity. The crystal structure has been solved from laboratory powder X-ray diffraction data using the repeated minimisations from random starting values method. BiZn2VO6 adopts a new structure type, based on the following building blocks: corner- and edge-sharing ZnO4 tetrahedra, ZnO6 octahedra and VO4 tet...

  5. Electronic structure and first hyperpolarizability of poly(2-L-alanine-3-sodium nitrate (I)) crystals

    Indian Academy of Sciences (India)

    A Duarte Moller

    2014-10-01

    Poly(2-L-alanine-3-sodium nitrate (I)), -LASN, crystals have been grown by slow evaporation at room temperature. The nominal size of the crystals obtained by the method was of 500 nm. The UV–Vis spectrum shows a wide range, where absorption is lacking around 532 nm, which is required in order to have the second harmonic emission, when an incident radiation of 1064 nm strikes on the crystal. This guarantees the possible use of the crystal in visible light applications. The transparent nature of the crystal in the visible and infrared regions within the transmission spectrum confirms the nonlinear optical properties of the crystal. Additionally, Fourier transform infrared spectroscopy displays its functional groups which correspond to the poly(2-L-alanine-3-sodium nitrate (I)), where the presence of nitrates in the lattice generally can be identified by their characteristic signature within the 1660–1625, 1300–1255, 870–833 and 763–690 cm-1 range. Single crystal diffraction was carried out in order to determine atomic structure and lattice parameter. Structural parameters were = 5.388(9) Å, = 9.315(15) Å and = 13.63(2) Å. The structure of poly(2-Lalanine-3-sodium nitrate (I)) shown by single crystal diffraction shows an asymmetric unit consisting of one sodium and one nitrate ion and one L-alanine molecule. The coordination geometry around the sodium atom was trigonal bipyramidal, with three bidentate nitrate anions coordinating through their oxygen atoms and two L-alanine molecules, each coordinating through one carboxyl oxygen atom. Electronic structure was obtained by using the Becke–Lee–Yang–Part and Hartree–Fock approximations with hybrid exchangecorrelation three-parameter functional and G-311**G() basis set. Theoretical and experimental results were compared and discussed as having an excellent agreement among them.

  6. Fabrication of size-controllable hexagonal non-close-packed colloidal crystals and binary colloidal crystals by pyrolysis combined with plasma-electron coirradiation of polystyrene colloidal monolayer.

    Science.gov (United States)

    Kim, Jae Joon; Li, Yue; Lee, Eun Je; Cho, Sung Oh

    2011-03-15

    We present an unprecedented and systematic route to controllably fabricate hexagonal non-close-packed (hncp) monolayer colloidal crystals and binary colloidal crystals (BCCs) based on plasma-electron coirradiation of polystyrene colloidal monolayers followed by thermal decomposition. Hncp colloidal crystals with tunable particle sizes and periods could be fabricated by changing the pristine colloidal particle size and the thermal decomposition time. In addition, BCCs and trimodal colloidal crystals that are composed of different-sized colloidal particles can also be fabricated by adding small particles on the prepared hncp colloidal crystals. Both the particle size ratio and the volume fraction of the BCCs can be widely tuned. These hncp colloidal crystals and BCCs have various potential applications as optical and photonic materials as well as in catalysis and sensors.

  7. Synthesis, crystal structure and electronic structure of the binary phase Rh2Cd5

    Science.gov (United States)

    Koley, Biplab; Chatterjee, S.; Jana, Partha P.

    2017-02-01

    A new phase in the Rh-Cd binary system - Rh2Cd5 has been identified and characterized by single crystal X-ray diffraction and Energy dispersive X-ray analysis. The stoichiometric compound Rh2Cd5 crystallizes with a unit cell containing 14 atoms, in the orthorhombic space group Pbam (55). The crystal structure of Rh2Cd5 can be described as a defect form of the In3Pd5 structure with ordered vacancies, formed of two 2D atomic layers with the stacking sequence: ABAB. The A type layers consist of (3.6.3.6)-Kagomé nets of Cd atoms while the B type layers consist of (35) (37)- nets of both Cd and Rh atoms. The stability of this line phase is investigated by first principle electronic structure calculations on the model of ordered Rh2Cd5.

  8. Radiation from multi-GeV electrons and positrons in periodically bent silicon crystal

    CERN Document Server

    Bezchastnov, Victor G; Solovyov, Andrey V

    2015-01-01

    A periodically bent Si crystal is shown to efficiently serve for producing highly monochromatic radiation in a gamma-ray energy spectral range. A short-period small-amplitude bending yields narrow undulator-type spectral peaks in radiation from multi-GeV electrons and positrons channeling through the crystal. Benchmark theoretical results on the undulator are obtained by simulations of the channeling with a full atomistic approach to the projectile-crystal interactions over the macroscopic propagation distances. The simulations are facilitated by employing the MBN Explorer package for molecular dynamics calculations on the meso- bio- and nano-scales. The radiation from the ultra-relativistic channeling projectiles is computed within the quasi-classical formalism. The effects due to the quantum recoil are shown to be significantly prominent in the gamma-ray undulator radiation.

  9. MULER: Building an Electronic Resource Management (ERM Solution at York University

    Directory of Open Access Journals (Sweden)

    Aaron August Lupton

    2012-01-01

    Full Text Available Many university libraries now utilize an Electronic Resource Management (ERM system to assist with operations related to electronic resources. An ERM is a relational database containing information such as suppliers, costs, holdings, and renewal dates for electronic resources, both at the database and title levels. While commercial ERM products are widely available, some institutions are custom building their own ERM in- house. This article describes how York University in Toronto, Canada, did just that by building a system called Managing University Library Electronic Resources (MULER. The article details the background and history of how electronic resources were managed pre-MULER; why a new ERM was needed; the planning process; the current and innovative functions of MULER, including integration of MULER data into York University Libraries search and discovery layer, Vufind; subject tagging in MULER; new functions to be added; and lessons learned from the project. Positive and negative implications of choosing an in-house project over paying for a commercial product are also discussed.

  10. Electronic Coupling Dependence of Ultrafast Interfacial Electron Transfer on Nanocrystalline Thin Films and Single Crystal

    Energy Technology Data Exchange (ETDEWEB)

    Lian, Tianquan

    2014-04-22

    The long-term goal of the proposed research is to understand electron transfer dynamics in nanoparticle/liquid interface. This knowledge is essential to many semiconductor nanoparticle based devices, including photocatalytic waste degradation and dye sensitized solar cells.

  11. The National Site Licensing of Electronic Resources: An Institutional Perspective

    Directory of Open Access Journals (Sweden)

    Xiaohua Zhu

    2011-06-01

    Full Text Available While academic libraries in most countries are struggling to negotiate with publishers and vendors individually or collaboratively via consortia, a few countries have experimented with a different model, national site licensing (NSL. Because NSL often involves government and large-scale collaboration, it has the potential to solve many problems in the complex licensing world. However, not many nations have adopted it. This study uses historical research approach and the comparative case study research method to explore the seemingly low level of adoption. The cases include the Canadian National Site Licensing Project (CNSLP, the United Kingdom’s National Electronic Site Licensing Initiative (NESLI, and the United States, which has not adopted NSL. The theoretical framework guiding the research design and data collection is W. Richard Scott’s institutional theory, which utilizes three supporting pillars—regulative, normative, and cultural-cognitive—to analyze institutional processes. In this study, the regulative pillar and the normative pillar of NSL adoption— an institutional construction and change—are examined. Data were collected from monographs, research articles, government documents, and relevant websites. Based on the analysis of these cases, a preliminary model is proposed for the adoption of NSL. The factors that support a country’s adoption of NSL include the need for new institutions, a centralized educational policy-making system and funding system, supportive political trends, and the tradition of cooperation. The factors that may prevent a country from adopting NSL include decentralized educational policy and funding, diversity and the large number of institutions, the concern for the “Big Deal,” and the concern for monopoly.

  12. Crystal field splitting of the 4f 5d electronic configuration of Pr 3+ ions in wide band gap fluoride dielectric crystals

    Science.gov (United States)

    Sarantopoulou, E.; Kollia, Z.; Cefalas, A. C.; Semashko, V. V.; Yu. Abdulsabirov, R.; Naumov, A. K.; Korableva, S. L.; Szczurek, T.; Kobe, S.; McGuiness, P. J.

    2002-07-01

    The absorption and the laser-induced fluorescence spectra of Pr 3+ ion in YF 3, LaF 3, KY 3 F 10 and LiLuF 4, single crystal hosts were obtained in the vacuum ultraviolet region of the spectrum. The energy position and the spacing of the levels of the 4f 5d electronic configuration depend on the host matrix. In addition, strong vacuum ultraviolet emission bands were observed, following crystal excitation at 157 nm with the molecular fluorine laser. The emission bands were due to the interconfigurational 4 f 5 d→4 f2 dipole-allowed transitions in Pr 3+ ions, and they were assigned to the transitions between the edge of the lowest Stark component of the 4f 5d electronic configuration and the levels of the 4f 2 electronic configuration. The VUV spectra can be interpreted by applying the crystal field model, and taking into consideration that lanthanide contraction of the 4f n-1 5d electronic configurations of the rare earth ions, and shielding of the positive ion charge from the electrons in the 4f n electronic configuration is taking place. Finally, a new method for monitoring the concentration of the rare earth ions in wide band gap fluoride dielectric crystals in a non-destructive way, by measuring magnetic dipole moments with the vibrating sample magnetometer (VSM) method, is presented for the first time to our knowledge for this type of crystals.

  13. Study of Unexplained Hard Photon Production by Electrons Channelled in a Crystal

    CERN Multimedia

    2002-01-01

    Our preceding experiment (NA33) designed to study the pair creation process in the interaction of high energy @g with a crystal in alignment conditions had revealed the existence of an unexpected peak in the radiation of 150~GeV~e|-~beam for E&s'@g./E^e^- @= 0.85 incident along the $$ axis of a 185~@mm. Ge~crystal and the photon multiplicity for the peak events has been measured to be M @= 5.7.\\\\ \\\\ In NA42, in a 76~@mm crystal of the same crystallographic quality, the peak nearly disappears, and the photon multiplicity at x = 0.85 is only M~@=~2.0. \\\\ \\\\ The thickness dependence of the effect shows that the extrapolated multiplicity in the peak in a very thin crystal tends to unity. The high energy radition peak emitted by axially channelled electrons in a thick crystal is then interpreted by the radiation cooling mechanism. \\\\ \\\\ The extrapolation to zero thickness of these results will allow us to extract from the data the single @g radiation spectrum. The comparison of this spectrum with the constant ...

  14. Two-Dimensional Crystallization of the Ca(2+)-ATPase for Electron Crystallography.

    Science.gov (United States)

    Glaves, John Paul; Primeau, Joseph O; Young, Howard S

    2016-01-01

    Electron crystallography of two-dimensional crystalline arrays is a powerful alternative for the structure determination of membrane proteins. The advantages offered by this technique include a native membrane environment and the ability to closely correlate function and dynamics with crystalline preparations and structural data. Herein, we provide a detailed protocol for the reconstitution and two-dimensional crystallization of the sarcoplasmic reticulum calcium pump (also known as Ca(2+)-ATPase or SERCA) and its regulatory subunits phospholamban and sarcolipin.

  15. Enhancement of electromagnetic showers initiated by ultrarelativistic electrons in aligned thick germanium crystals

    Science.gov (United States)

    Baurichter, A.; Mikkelsen, U.; Kirsebom, K.; Medenwaldt, R.; Møller, S.; Uggerhøj, E.; Worm, T.; Elsener, K.; Ballestrero, S.; Sona, P.; Romano, J.; Biino, C.; Moore, R.; Vilakazi, Z. Z.

    1996-10-01

    The distribution of the energy deposited in thin silicon detectors placed on the downstream side of a thick germanium single crystal bombarded with a 70, 150 and 250 GeV electron beam along directions close to the axis or {110} and {100} planes has been measured. The enhancement of the shower with respect to random incidence, as reflected in the higher value of the centroid of the distribution, is studied as a function of the incidence angle to the axis or plane.

  16. Crack tip dislocations revealed by electron tomography in silicon single crystal

    Energy Technology Data Exchange (ETDEWEB)

    Tanaka, Masaki [Department of Materials Science and Engineering, Kyushu University, 744 Motooka, Nishi-ku, Fukuoka 819-0395 (Japan)], E-mail: masaki@zaiko.kyushu-u.ac.jp; Higashida, Kenji [Department of Materials Science and Engineering, Kyushu University, 744 Motooka, Nishi-ku, Fukuoka 819-0395 (Japan); Kaneko, Kenji [Department of Materials Science and Engineering, Kyushu University, 744 Motooka, Nishi-ku, Fukuoka 819-0395 (Japan); JST-CREST, 744 Motooka, Nishi-ku, Fukuoka 819-0395 (Japan); Hata, Satoshi; Mitsuhara, Masatoshi [Department of Engineering Sciences for Electronics and Materials, Kyushu University, 6-1 Kasuga koen, Kasuga, Fukuoka 816-8580 (Japan)

    2008-10-15

    Crack tip dislocations in silicon single crystals have been observed by a combination of annular dark-field scanning transmission electron microscopy and computed tomography. A series of images was acquired by maintaining the diffraction vector parallel to that of crack propagation to achieve sharp images of the dislocations. The observed dislocations were reconstructed by a filtered back-projection, and exhibited three-dimensional configurations of overlaid dislocations around the crack tip.

  17. High-quality single-crystal growth and unique electronic states in cerium and uranium compounds

    Science.gov (United States)

    Onuki, Yoshichika; Settai, Rikio; Sugiyama, Kiyohiro; Inada, Yoshihiko; Takeuchi, Tetsuya; Haga, Yoshinori; Yamamoto, Etsuji; Harima, Hisatomo; Yamagami, Hiroshi

    2007-03-01

    We have grown many kinds of high-quality single crystals of cerium and uranium compounds and studied the Fermi surface properties via the de Haas-van Alphen experiments and energy band calculations. The quasi-two-dimensional electronic states are clarified in some compounds such as USb2, CeCoIn5, UPtGa5 and most likely UIr. In a ferromagnet CeRh3B2, we have found unique electronic states with quasi-one-dimensional character.

  18. Wave Propagation From Electrons to Photonic Crystals and Left-Handed Materials

    CERN Document Server

    Markos, Peter

    2010-01-01

    This textbook offers the first unified treatment of wave propagation in electronic and electromagnetic systems and introduces readers to the essentials of the transfer matrix method, a powerful analytical tool that can be used to model and study an array of problems pertaining to wave propagation in electrons and photons. It is aimed at graduate and advanced undergraduate students in physics, materials science, electrical and computer engineering, and mathematics, and is ideal for researchers in photonic crystals, negative index materials, left-handed materials, plasmonics, nonlinear effects,

  19. ESR and optical absorption studies of gamma- and electron-irradiated sugar crystals

    Energy Technology Data Exchange (ETDEWEB)

    Flores, J.C.; Cabrera, B.E.; Calderon, T.; Munoz, P.E.; Adem, E.; Hernandez, A.J.; Boldu, J.L.; Ovalle M.P.; Murrieta, S.H. E-mail: murrieta@fenix.ifisicacu.unam.mx

    2000-05-15

    Electron spin resonance (ESR) studies of the free radicals induced in gamma- or electron-irradiated sugar crystals were performed. The number of radicals increases linearly, pointing out that this material can be used as a dosimeter. The optical absorption studies show the presence of several distinctive bands in the infrared and UV region, whose intensity changes with the irradiation dose. An interpretation of these results in terms of the formation of free radicals and possible crosslinking along the sugar molecular chains is presented.

  20. Experimental Study of Electronic Quantum Interference, Photonic Crystal Cavity, Photonic Band Edge Effects for Optical Amplification

    Science.gov (United States)

    2016-01-26

    performed. 2.0 INTRODUCTION Three dimensional (3D) photonic crystals and their optical properties have attracted a lot of attention in the past decade... physical phenomena. The band gap frequency of this system can be varied to tailor to the electronic transition levels of a gain medium such as InAs...quantum dot or an InGaAs quantum well. The band gap can be varied in addition to include either one or two electronic levels of a multi-level system

  1. Electron Beam Etching of CaO Crystals Observed Atom by Atom.

    Science.gov (United States)

    Shen, Yuting; Xu, Tao; Tan, Xiaodong; Sun, Jun; He, Longbing; Yin, Kuibo; Zhou, Yilong; Banhart, Florian; Sun, Litao

    2017-08-09

    With the rapid development of nanoscale structuring technology, the precision in the etching reaches the sub-10 nm scale today. However, with the ongoing development of nanofabrication the etching mechanisms with atomic precision still have to be understood in detail and improved. Here we observe, atom by atom, how preferential facets form in CaO crystals that are etched by an electron beam in an in situ high-resolution transmission electron microscope (HRTEM). An etching mechanism under electron beam irradiation is observed that is surprisingly similar to chemical etching and results in the formation of nanofacets. The observations also explain the dynamics of surface roughening. Our findings show how electron beam etching technology can be developed to ultimately realize tailoring of the facets of various crystalline materials with atomic precision.

  2. Orbital angular momentum in electron diffraction and its use to determine chiral crystal symmetries

    Science.gov (United States)

    Juchtmans, Roeland; Verbeeck, Jo

    2015-10-01

    In this work we present an alternative way to look at electron diffraction in a transmission electron microscope. Instead of writing the scattering amplitude in Fourier space as a set of plane waves, we use the cylindrical Fourier transform to describe the scattering amplitude in a basis of orbital angular momentum (OAM) eigenstates. We show how working in this framework can be very convenient when investigating, e.g., rotation and screw-axis symmetries. For the latter we find selection rules on the OAM coefficients that unambiguously reveal the handedness of the screw axis. Detecting the OAM coefficients of the scattering amplitude thus offers the possibility to detect the handedness of crystals without the need for dynamical simulations, the thickness of the sample, nor the exact crystal structure. We propose an experimental setup to measure the OAM components where an image of the crystal is taken after inserting a spiral phase plate in the diffraction plane and perform multislice simulations on α quartz to demonstrate how the method indeed reveals the chirality. The experimental feasibility of the technique is discussed together with its main advantages with respect to chirality determination of screw axes. The method shows how the use of a spiral phase plate can be extended from a simple phase imaging technique to a tool to measure the local OAM decomposition of an electron wave, widening the field of interest well beyond chiral space group determination.

  3. Analytical Study of Usage of Electronic Information Resources at Pharmacopoeial Libraries in India

    Directory of Open Access Journals (Sweden)

    Sunil Tyagi

    2014-02-01

    Full Text Available The objective of this study is to know the rate and purpose of the use of e-resource by the scientists at pharmacopoeial libraries in India. Among other things, this study examined the preferences of the scientists toward printed books and journals, electronic information resources, and pattern of using e-resources. Non-probability sampling specially accidental and purposive technique was applied in the collection of primary data through administration of user questionnaire. The sample respondents chosen for the study consists of principle scientific officer, senior scientific officer, scientific officer, and scientific assistant of different division of the laboratories, namely, research and development, pharmaceutical chemistry, pharmacovigilance, pharmacology, pharmacogonosy, and microbiology. The findings of the study reveal the personal experiences and perceptions they have had on practice and research activity using e-resource. The major findings indicate that of the total anticipated participants, 78% indicated that they perceived the ability to use computer for electronic information resources. The data analysis shows that all the scientists belonging to the pharmacopoeial libraries used electronic information resources to address issues relating to drug indexes and compendia, monographs, drugs obtained through online databases, e-journals, and the Internet sources—especially polices by regulatory agencies, contacts, drug promotional literature, and standards.

  4. Connecting knowledge resources to the veterinary electronic health record: opportunities for learning at point of care.

    Science.gov (United States)

    Alpi, Kristine M; Burnett, Heidi A; Bryant, Sheila J; Anderson, Katherine M

    2011-01-01

    Electronic health records (EHRs) provide clinical learning opportunities through quick and contextual linkage of patient signalment, symptom, and diagnosis data with knowledge resources covering tests, drugs, conditions, procedures, and client instructions. This paper introduces the EHR standards for linkage and the partners-practitioners, content publishers, and software developers-necessary to leverage this possibility in veterinary medicine. The efforts of the American Animal Hospital Association (AAHA) Electronic Health Records Task Force to partner with veterinary practice management systems to improve the use of controlled vocabulary is a first step in the development of standards for sharing knowledge at the point of care. The Veterinary Medical Libraries Section (VMLS) of the Medical Library Association's Task Force on Connecting the Veterinary Health Record to Information Resources compiled a list of resources of potential use at point of care. Resource details were drawn from product Web sites and organized by a metric used to evaluate medical point-of-care resources. Additional information was gathered from questions sent by e-mail and follow-up interviews with two practitioners, a hospital network, two software developers, and three publishers. Veterinarians with electronic records use a variety of information resources that are not linked to their software. Systems lack the infrastructure to use the Infobutton standard that has been gaining popularity in human EHRs. While some veterinary knowledge resources are digital, publisher sites and responses do not indicate a Web-based linkage of veterinary resources with EHRs. In order to facilitate lifelong learning and evidence-based practice, veterinarians and educators of future practitioners must demonstrate to veterinary practice software developers and publishers a clinically-based need to connect knowledge resources to veterinary EHRs.

  5. Improving access to information – defining core electronic resources for research and wellbeing

    Directory of Open Access Journals (Sweden)

    Kristiina Hormia-Poutanen

    2007-11-01

    Full Text Available Research and innovation are listed as the key success factors for the future development of Finnish prosperity and the Finnish economy. The Finnish libraries have developed a scenario to support this vision. University, polytechnic and research institute libraries as well as public libraries have defined the core electronic resources necessary to improve access to information in Finland. The primary aim of this work has been to provide information and justification for central funding for electronic resources to support the national goals. The secondary aim is to help with the reallocation of existing central funds to better support access to information.

  6. Guided Modes in a Two-Dimensional Photonic Crystal Waveguide Consisting of Nearly-Free-Electron Metals

    Institute of Scientific and Technical Information of China (English)

    XIAO San-Shui; HE Sai-Ling; ZHUANG Fei

    2001-01-01

    Guided modes in a two-dimensional photonic crystal consisting of nearly-free-electron metals are considered. To avoid time-consuming convolution, modified time-stepping formulae are used in a finite-difference time-domain approach. The guided modes in the metallic photonic crystal waveguide are related to those in a conventional metallic waveguide. A cut-off frequency exists, and consequently a mode gap at low frequencies exists in the photonic crystal metallic waveguide.

  7. Study on the waste liquid crystal display treatment: focus on the resource recovery.

    Science.gov (United States)

    Wang, Xinying; Lu, Xuebin; Zhang, Shuting

    2013-01-15

    A process combined pyrolysis and acid immersion was proposed in this study to dispose the hazardous liquid crystal display (LCD) waste for recovering valuable resources. The thermogravimetric (TG) analysis and fixed bed pyrolysis were investigated for the polarizing film that was separated from LCD. The results suggested the liquid product mainly contained acids, esters and aromatics should be upgraded such as hydrotreating process before used as industrial feedstock or fuel source. The gaseous product mainly consisted of H(2), CO, CO(2) and CH(4) can be used as a valuable fuel. The sulfuric acid immersion experiments were studied for recovering indium from the LCD glass after stripping the polarizing film. Central composite design (CCD) under response surface methodology (RSM) was used to optimize the acid immersion process and the results indicated the indium recovery can be fitted based on the actual value to a polynomial quadratic equation and the temperature was more essential factor than time and acid concentration in the studied ranges. The optimum processing condition was obtained with time 42.2 min, temperature 65.6 °C and acid concentration 0.6 mol/L. Under the optimal conditions, the indium recovery was close to 100%.

  8. Elektronik Bilgi Kaynaklarının Seçimi / Selection of Electronic Information Resources

    Directory of Open Access Journals (Sweden)

    Pınar Al

    2003-04-01

    Full Text Available For many years, library users have used only from the printed media in order to get the information that they have needed. Today with the widespread use of the Web and the addition of electronic information resources to library collections, the use of information in the electronic environment as well as in printed media is started to be used. In time, such types of information resources as, electronic journals, electronic books, electronic encyclopedias, electronic dictionaries and electronic theses have been added to library collections. In this study, selection criteria that can be used for electronic information resources are discussed and suggestions are provided for libraries that try to select electronic information resources for their collections.

  9. Channeling, volume reflection and gamma emission using 14GeV electrons in bent silicon crystals - Oral presentation

    Energy Technology Data Exchange (ETDEWEB)

    Benson, Brandon [SLAC National Accelerator Lab., Menlo Park, CA (United States)

    2015-08-23

    High energy electrons can be deflected with very tight bending radius using a bent silicon crystal. This produces gamma radiation. As these crystals can be thin, a series of bent silicon crystals with alternating direction has the potential to produce coherent gamma radiation with reasonable energy of the driving electron beam. Such an electron crystal undulator offers the prospect for higher energy radiation at lower cost than current methods. Permanent magnetic undulators like LCLS at SLAC National Accelerator Laboratory are expensive and very large (about 100 m in case of the LCLS undulator). Silicon crystals are inexpensive and compact when compared to the large magnetic undulators. Additionally, such a high energy coherent light source could be used for probing through materials currently impenetrable by x-rays. In this work we present the experimental data and analysis of experiment T523 conducted at SLAC National Accelerator Laboratory. We collected the spectrum of gamma ray emission from 14 GeV electrons on a bent silicon crystal counting single photons. We also investigated the dynamics of electron motion in the crystal i.e. processes of channeling and volume reflection at 14 GeV, extending and building off previous work. Our single photon spectrum for the amorphous crystal orientation is consistent with bremsstrahlung radiation and the volume reflection crystal orientation shows a trend consistent with synchrotron radiation at a critical energy of 740 MeV. We observe that in these two cases the data are consistent, but we make no further claims because of statistical limitations. We also extended the known energy range of electron crystal dechanneling length and channeling efficiency to 14 GeV.

  10. Imaging the oblique propagation of electrons in germanium crystals at low temperature and low electric field

    Energy Technology Data Exchange (ETDEWEB)

    Moffatt, R. A., E-mail: rmoffatt@stanford.edu; Cabrera, B.; Corcoran, B. M.; Kreikebaum, J. M.; Redl, P.; Shank, B.; Yen, J. J. [Department of Physics, Stanford University, Stanford, California 94305 (United States); Young, B. A. [Department of Physics, Stanford University, Stanford, California 94305 (United States); Department of Physics, Santa Clara University, Santa Clara, California 95053 (United States); Brink, P. L.; Cherry, M.; Tomada, A. [SLAC National Accelerator Facility, Menlo Park, California 94025 (United States); Phipps, A.; Sadoulet, B.; Sundqvist, K. M. [Department of Physics, University of California, Berkeley, California 94720 (United States)

    2016-01-11

    Excited electrons in the conduction band of germanium collect into four energy minima, or valleys, in momentum space. These local minima have highly anisotropic mass tensors which cause the electrons to travel in directions which are oblique to an applied electric field at sub-Kelvin temperatures and low electric fields, in contrast to the more isotropic behavior of the holes. This experiment produces a full two-dimensional image of the oblique electron and hole propagation and the quantum transitions of electrons between valleys for electric fields oriented along the [0,0,1] direction. Charge carriers are excited with a focused laser pulse on one face of a germanium crystal and then drifted through the crystal by a uniform electric field of strength between 0.5 and 6 V/cm. The pattern of charge density arriving on the opposite face is used to reconstruct the trajectories of the carriers. Measurements of the two-dimensional pattern of charge density are compared in detail with Monte Carlo simulations developed for the Cryogenic Dark Matter Search (SuperCDMS) to model the transport of charge carriers in high-purity germanium detectors.

  11. ARCHITECTURE OF PEROXISOMAL ALCOHOL OXIDASE CRYSTALS FROM THE METHYLOTROPHIC YEAST HANSENULA-POLYMORPHA AS DEDUCED BY ELECTRON-MICROSCOPY

    NARCIS (Netherlands)

    VONCK, J; VANBRUGGEN, EFJ

    1992-01-01

    The architecture of alcohol oxidase crystalloids occurring in vivo in the peroxisomes of methylotrophic yeasts was deduced from electron micrographs of similar crystals of the Hansenula polymorpha enzyme grown in vitro. Three characteristic views of the crystal are observed, as well as single layers

  12. Single crystal growth and electronic structure of TlPbI{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Khyzhun, O.Y., E-mail: khyzhun@ipms.kiev.ua [Frantsevych Institute for Problems of Materials Science, National Academy of Sciences of Ukraine, 3 Krzhyzhanivsky Street, 03142 Kyiv (Ukraine); Fochuk, P.M. [Yuriy Fedkovich Chernivtsi National University, 2 Kotsyubynskogo Street, 58012 Chernivtsi (Ukraine); Kityk, I.V. [Faculty of Electrical Engineering, Czestochowa University of Technology, Armii Krajowej 17, PL-42-217 Czestochowa (Poland); Piasecki, M. [Institute of Physics, J.Dlugosz University Częstochowa, Armii Krajowej 13/15, Częstochowa (Poland); Levkovets, S.I. [Department of Inorganic and Physical Chemistry, Eastern European National University, 13 Voli Avenue, 43025 Lutsk (Ukraine); Fedorchuk, A.O. [Department of Inorganic and Organic Chemistry, Lviv National University of Veterinary Medicine and Biotechnologies, 50 Pekarska Street, 79010 Lviv (Ukraine); Parasyuk, O.V. [Department of Inorganic and Physical Chemistry, Eastern European National University, 13 Voli Avenue, 43025 Lutsk (Ukraine)

    2016-04-01

    High-quality inclusion-free TlPbI{sub 3} single crystals have been grown using Bridgman–Stockbarger method. The electronic structure of TlPbI{sub 3} is studied by using the possibilities of X-ray photoelectron spectroscopy (XPS). For the TlPbI{sub 3} crystal, XPS core-level and valence-band spectra for both pristine and Ar{sup +} ion-bombarded surfaces are recorded. The present XPS data indicate that the TlPbI{sub 3} single crystal surface is somewhat sensitive with respect to Ar{sup +} ion-bombardment. In particular, the XPS measurements reveal that thallium and lead atoms are in the formal valence +1 and +2, respectively, on the pristine TlPbI{sub 3} single crystal surface. Further, the 3.0 keV Ar{sup +} ion-bombardment of the surface induces partial transformation of lead ions to lower valence state, namely Pb{sup 0}; however, no partial loss of iodine atoms belonging to TlI{sub 8} polyhedra occurs due to the Ar{sup +} ion-bombardment of the TlPbI{sub 3} surface because after such a treatment thallium remains exclusively in the formal valence +1. The present XPS results indicate that low hygroscopicity is characteristic of the TlPbI{sub 3} single crystal surface. Photoinduced birefringence profiles in TlPbI{sub 3} are explored. - Highlights: • High-quality TlPbI{sub 3} single crystals have been grown by Bridgman–Stockbarger method. • Electronic structure of TlPbI{sub 3} is studied by the XPS method. • XPS data reveal low hygroscopicity of TlPbI{sub 3} surface. • TlPbI{sub 3} single crystal surface is sensitive with respect to Ar{sup +} ion-bombardment. • Photoinduced birefringence profiles in TlPbI{sub 3} are explored.

  13. Orbital angular momentum in electron diffraction and its use to determine chiral crystal symmetries

    CERN Document Server

    Juchtmans, Roeland

    2015-01-01

    In this work we present an alternative way to look at electron diffraction in a transmission electron microscope. In stead of writing the scattering amplitude in Fourier space as a set of plane waves, we use the cylindrical Fourier transform to describe the scattering amplitude in a basis of orbital angular momentum (OAM) eigenstates. We show how working in this framework can be very convenient when investigating e.g. rotation and screw axis symmetries. For the latter we find selection rules on the OAM-coefficients that unambiguously reveal the handedness of the screw axis. Detecting the OAM-coefficients of the scattering amplitude thus offers the possibility to detect the handedness of crystals without the need for dynamical simulations, the thickness of the sample nor the exact crystal structure. We propose an experimental setup to measure the OAM-components where an image of the crystal is taken after inserting a spiral phase plate in the diffraction plane and perform mulsti-slice simulations on $\\alpha$-q...

  14. Electronic liquid crystal state in a strongly underdoped high-temperature superconductor

    Energy Technology Data Exchange (ETDEWEB)

    Hinkov, V.; Haug, D.; Lin, C.T.; Keimer, B. [MPI-FKF, Stuttgart (Germany); Fauque, B.; Sidis, Y.; Bourges, P. [LLB, Saclay (France); Ivanov, A. [ILL, Grenoble (France); Bernhard, C. [Univ. of Fribourg (Switzerland)

    2008-07-01

    Liquid crystals are states of matter without static crystalline order that break the rotational symmetry of free space while at least partially preserving its translational symmetry. Highly correlated electronic phases with symmetry properties analogous to those of conventional liquid crystals have been theoretically predicted (Kivelson et al., Nature 393, 550) and recently discovered in the layered bulk transition metal oxide Sr{sub 3}Ru{sub 2}O{sub 7} (Borzi et al., Science 315, 214). In both cases, however, these phases are stable only at milli-Kelvin temperatures and in high magnetic fields, and have thus far only been probed by transport measurements. After briefly summarizing our work on YBCO{sub 6.6} (Hinkov et al., Nature Physics 3, 780), we report the spontaneous onset of a strong one-dimensional, incommensurate modulation of the spin system in the underdoped high-temperature superconductor YBa{sub 2}Cu{sub 3}O{sub 6.45} upon cooling below 150 K, while muon-spin-relaxation experiments on the same sample demonstrate that static magnetic order is absent down to temperatures of at least 2 K. The symmetry properties of the spin system thus match those of a nematic liquid crystal over a wide temperature range. Soft spin fluctuations are thus a microscopic route towards the formation of electronic nematic phases, which can coexist with high-T{sub c} superconductivity.

  15. Snow crystal imaging using scanning electron microscopy: III. Glacier ice, snow and biota

    Science.gov (United States)

    Rango, A.; Wergin, W.P.; Erbe, E.F.; Josberger, E.G.

    2000-01-01

    Low-temperature scanning electron microscopy (SEM) was used to observe metamorphosed snow, glacial firn, and glacial ice obtained from South Cascade Glacier in Washington State, USA. Biotic samples consisting of algae (Chlamydomonas nivalis) and ice worms (a species of oligochaetes) were also collected and imaged. In the field, the snow and biological samples were mounted on copper plates, cooled in liquid nitrogen, and stored in dry shipping containers which maintain a temperature of -196??C. The firn and glacier ice samples were obtained by extracting horizontal ice cores, 8 mm in diameter, at different levels from larger standard glaciological (vertical) ice cores 7.5 cm in diameter. These samples were cooled in liquid nitrogen and placed in cryotubes, were stored in the same dry shipping container, and sent to the SEM facility. In the laboratory, the samples were sputter coated with platinum and imaged by a low-temperature SEM. To image the firn and glacier ice samples, the cores were fractured in liquid nitrogen, attached to a specimen holder, and then imaged. While light microscope images of snow and ice are difficult to interpret because of internal reflection and refraction, the SEM images provide a clear and unique view of the surface of the samples because they are generated from electrons emitted or reflected only from the surface of the sample. In addition, the SEM has a great depth of field with a wide range of magnifying capabilities. The resulting images clearly show the individual grains of the seasonal snowpack and the bonding between the snow grains. Images of firn show individual ice crystals, the bonding between the crystals, and connected air spaces. Images of glacier ice show a crystal structure on a scale of 1-2 mm which is considerably smaller than the expected crystal size. Microscopic air bubbles, less than 15 ??m in diameter, clearly marked the boundaries between these crystal-like features. The life forms associated with the glacier were

  16. Using Electronic Information Resources Centers by Faculty Members at University Education: Competencies, Needs and Challenges

    Science.gov (United States)

    Abouelenein, Yousri

    2017-01-01

    This study aimed at investigating the factual situation of electronic information resources centers to faculty members at university education. Competencies that faculty members should possess regarding this issue were determined. Also their needs for (scientific research skills and teaching) were assessed. In addition, problems that hinder their…

  17. Localising versus standardising electronic human resource management: complexities and tensions between HRM and IT departments

    NARCIS (Netherlands)

    Tate, Mary; Furtmueller, E.; Wilderom, C.P.M.

    2013-01-01

    In this paper, we provide an analysis of the complexities involved during global e-HRM (Electronic Human Resource Management) implementation. We present findings from a case study on the challenge of global integration versus local responsiveness of e-HRM systems. We take a local site lens, analysin

  18. Use of Electronic Information Resources among Research Scholars in the Islamia University of Bahawalpur, Pakistan

    Science.gov (United States)

    Amjad, Anam; Ahmed, Shamshad; Bin Naeem, Salman

    2013-01-01

    This study examined the use of electronic resources among academic scholars of The Islamia University of Bahawalpur (IUB), Punjab, Pakistan. A quantitative survey was found most convenient and useful for this study. The total population of the study was 169 research students in IUB. The response rate was 79% and 133 utilizable responses were coded…

  19. The Acquisition and Management of Electronic Resources: Can Use Justify Cost?

    Science.gov (United States)

    Koehn, Shona L.; Hawamdeh, Suliman

    2010-01-01

    As library collections increasingly become digital, libraries are faced with many challenges regarding the acquisition and management of electronic resources. Some of these challenges include copyright and fair use, the first-sale doctrine, licensing versus ownership, digital preservation, long-term archiving, and, most important, the issue of…

  20. On the size of the secondary electron cloud in crystals irradiated by hard X-ray photons

    Science.gov (United States)

    Grum-Grzhimailo, Alexei N.; Pikuz, Tatiana; Faenov, Anatoly; Matsuoka, Takeshi; Ozaki, Norimasa; Albertazzi, Bruno; Pikuz, Sergei; Inubushi, Yuichi; Yabashi, Makina; Tono, Kensuke; Yumoto, Hirokatsu; Ohashi, Haruhiko; Ishikawa, Tetsuya; Kodama, Ryosuke

    2017-03-01

    A simple theoretical recipe is proposed to estimate the size of the secondary electron cloud, generated in matter by incoming hard X-ray photons. An exclusive response of the LiF crystal to deposited X-ray doses by proportional generation of secondary electrons, which cause creation of color centers density inside the crystal, provides a unique possibility to validate the theoretical predictions for the size of the electron cloud with submicron resolution. The radius of the electron cloud measured for 10.1 keV photons is in agreement with the theoretical predictions.

  1. 电子资源的编目策略%Cataloging Strategies of Electronic Resources

    Institute of Scientific and Technical Information of China (English)

    王亚林

    2012-01-01

    Compared with traditional paper resources, electronic resources have following characteristics which determine different cataloging strategies from paper resources. These characteristics are huge quantity, updating rapidly, coexistence of a variety of manifestations. The source data of electronic resources is usually provided by the database agent. The cataloging of electronic resources is based on the Chapter IX of Anglo-American Cataloging Rules, Library of Congress Rule Interpretations and rules of Cooperative Online Serials. There are two major cataloging methods for electronic resources abroad, they are single record approach and separate record approach. Peking University Library chooses the latter method and batches cataloging automatically using the source data.%电子资源吲传统纸质资源相比,具有数量大、更新快、多种载体表现并行等特点,且大部分出版机构能够提供数据源数据。这些特点决定了.电子资源应采取与纸质文献不同的编目策略。电子资源编日的主要依据是《英美编日条例》的第9章、美国《国会图书馆条例解释》及全美期刊合作编目计划的规定。对于电子资源的编目,国外有单一记录编目法和分散记录编目法。北京大学图书馆采用后者,同时利用数据源数据批舒自动编目。

  2. High quality single crystal Ge nano-membranes for opto-electronic integrated circuitry

    Energy Technology Data Exchange (ETDEWEB)

    Shah, V. A., E-mail: vishal.shah@warwick.ac.uk; Gammon, P. M. [Department of Engineering, The University of Warwick, Coventry CV4 7AL (United Kingdom); Department of Physics, The University of Warwick, Coventry CV4 7AL (United Kingdom); Rhead, S. D.; Halpin, J. E.; Trushkevych, O.; Wilson, N. R.; Myronov, M.; Edwards, R. S.; Patchett, D. H.; Allred, P. S.; Prest, M. J.; Whall, T. E.; Parker, E. H. C.; Leadley, D. R. [Department of Physics, The University of Warwick, Coventry CV4 7AL (United Kingdom); Chávez-Ángel, E. [ICN2-Institut Catala de Nanociencia i Nanotecnologia, Campus UAB, 08193 Bellaterra (Barcelona) (Spain); Department of Physics, UAB, 08193 Bellaterra (Barcelona) (Spain); Shchepetov, A.; Prunnila, M. [VTT Technical Research Centre of Finland, P.O. Box 1000, FI-02044 VTT, Espoo (Finland); Kachkanov, V.; Dolbnya, I. P. [Diamond Light Source, Harwell Science and Innovation Campus, Didcot, Oxfordshire OX11 0DE (United Kingdom); Reparaz, J. S. [ICN2-Institut Catala de Nanociencia i Nanotecnologia, Campus UAB, 08193 Bellaterra (Barcelona) (Spain); and others

    2014-04-14

    A thin, flat, and single crystal germanium membrane would be an ideal platform on which to mount sensors or integrate photonic and electronic devices, using standard silicon processing technology. We present a fabrication technique compatible with integrated-circuit wafer scale processing to produce membranes of thickness between 60 nm and 800 nm, with large areas of up to 3.5 mm{sup 2}. We show how the optical properties change with thickness, including appearance of Fabry-Pérot type interference in thin membranes. The membranes have low Q-factors, which allow the platforms to counteract distortion during agitation and movement. Finally, we report on the physical characteristics showing sub-nm roughness and a homogenous strain profile throughout the freestanding layer, making the single crystal Ge membrane an excellent platform for further epitaxial growth or deposition of materials.

  3. INFLUENCE OF ELECTRON BEAM TREATMENT ON THE CRYSTALLIZATION AND THERMAL STABILITY OF LDPE/EPDM BLENDS

    Directory of Open Access Journals (Sweden)

    Bhuwanesh Kumar Sharma

    2014-01-01

    Full Text Available The effect of blend composition and Electron Beam (EB irradiation on the crystallization and thermal behavior of Low Density Polyethylene (LDPE/Ethylene-Propylene-Diene elastomer (EPDM blends had been studied. Melting temperatures were found to remain unchanged upon variation of blend composition as well as irradiation dose. But the degree of crystallinity and Tc (crystallization temperature were decreased with increase in EPDM content and EB dose. On the other hand, thermal stability (in terms of onset temperature and degradation temperature and activation energy were increased with increase in EPDM content and irradiation dose. But the speed of degradation slowed down with increasing EPDM content and EB dose. Interestingly, once Trimethylolpropane Triacrylate (TMPTA and Triallyl Cynuerate (TAC were incorporated into the blends, the degrees of change of these properties were more in same direction upon irradiation. At higher irradiation dose properties were demoted due to chain scission.

  4. Electron-phonon interaction in three-, two- and one-dimensional ternary mixed crystals

    Science.gov (United States)

    Hou, Junhua; Fan, Yunpeng

    2016-05-01

    The electron-phonon (e-p) interaction in three-dimensional (3D), two-dimensional (2D) and one-dimensional (1D) ternary mixed crystals is studied. The e-p interaction Hamiltonians including the unit cell volume variation in ternary mixed crystals are obtained by using the modified random-element-isodisplacement model and Born-Huang method. The polaronic self-trapping energy and renormalized effective mass of GaAsxSb1-x, GaPxAs1-x and GaPxSb1-x compounds are numerically calculated. It is confirmed theoretically that the nonlinear variation of the self-trapping energy and effective mass with the composition is essential and the unit cell volume effects cannot be neglected except the weak e-p coupling. The dimensional effect cannot also be ignored.

  5. Electronic Structures of PbWO4 Crystals Containing F-Type Colour Centres

    Institute of Scientific and Technical Information of China (English)

    YI Zhi-Jun; LIU Ting-Yu; ZHANG Qi-Ren; SUN Yuan-Yuan

    2005-01-01

    @@ Electronic structures of PbWO4 crystals containing F-type colour centres with the lattice structure optimized are studied within the framework of the fully relativistic selF-consistent Dirac-Slater theory, using a numerically discrete variational (DV-Xα) method. The calculated results show that F and F+ centres have donor energy levels in the forbidden bands. Their optical transition energies are 1.84 eV and 2.21 eV, respectively, which correspond to the 680nm and 550nm absorption bands. It is predicted that the 680nm and 550nm absorption banas originate from the F and F+ centres in PbWO4 crystals.

  6. Electronic Structures of PbMoO4 Crystals with F-Type Colour Centres

    Institute of Scientific and Technical Information of China (English)

    CHEN Jian-Yu; ZHANG Qi-Ren; LIU Ting-Yu; SHAO Ze-Xu; PU Chun-Ying

    2007-01-01

    Electronic structures of PbMo04 crystals containing F-type colour centres with the lattice structure optimized are studied within the framework of the fully relativistic self-consistent Dirac-SIater theory, using a numerically discrete variational (DV-Xα) method. The calculated results show that F and F+ centres have donor energy levels in the forbidden band. The optical transition energies are 2.166eV and 2.197eV, respectively, corresponding to the 580 nm absorption bands in PbMoO4 crystal. The 580 nm absorption band in PbMoO4 is originated from the F-type colour centres.

  7. High-voltage electron-microscopical observation of crack-tip dislocations in silicon crystals

    Energy Technology Data Exchange (ETDEWEB)

    Tanaka, Masaki [Department of Materials Science and Engineering, Kyushu University, 6-10-1 Higashi-ku Fukuoka 812-8581 (Japan)]. E-mail: masaki@dera.zaiko.kyushu-u.ac.jp; Higashida, Kenji [Department of Materials Science and Engineering, Kyushu University, 6-10-1 Higashi-ku Fukuoka 812-8581 (Japan)

    2005-07-25

    Crack-tip dislocations in silicon single crystals were observed by high-voltage electron microscopy. Cracks were introduced into silicon wafers at room temperature by a Vickers indenter. The indented specimens were annealed at 823 K in order to activate dislocation emission from the crack tip under the residual stress due to the indentation. In the specimen without annealing, no dislocations were observed around the crack. On the other hand, in the specimen after the annealing, the aspect of the early stage of dislocation emission was observed, where dislocations were emitted not as a perfect dislocation but as a partial dislocation in the hinge-type plastic zone. Prominent dislocation arrays that were emitted from a crack tip were also observed, and they were found to be of shielding type, which increases the fracture toughness of those crystals.

  8. Coherent Terahertz Radiation from Multiple Electron Beams Excitation within a Plasmonic Crystal-like structure

    Science.gov (United States)

    Zhang, Yaxin; Zhou, Yucong; Gang, Yin; Jiang, Guili; Yang, Ziqiang

    2017-01-01

    Coherent terahertz radiation from multiple electron beams excitation within a plasmonic crystal-like structure (a three-dimensional holes array) which is composed of multiple stacked layers with 3 × 3 subwavelength holes array has been proposed in this paper. It has been found that in the structure the electromagnetic fields in each hole can be coupled with one another to construct a composite mode with strong field intensity. Therefore, the multiple electron beams injection can excite and efficiently interact with such mode. Meanwhile, the coupling among the electron beams is taken place during the interaction so that a very strong coherent terahertz radiation with high electron conversion efficiency can be generated. Furthermore, due to the coupling, the starting current density of this mechanism is much lower than that of traditional electron beam-driven terahertz sources. This multi-beam radiation system may provide a favorable way to combine photonics structure with electronics excitation to generate middle, high power terahertz radiation.

  9. Power resource management and low-power remote wireless RF electronics

    Science.gov (United States)

    Jannson, Tomasz; Forrester, Thomas; Degrood, Kevin; Lee, Kang; Gans, Eric; Walter, Kevin

    2009-05-01

    Battery power resource management becomes a critical issue in the case of self-powered remote wireless RF electronics, where the basic parameter is time of system operation before battery recharging or battery replacement. In such cases, very often related to physical protection against antitampering (AT), proper theoretical modeling of a battery driven power supply in the context of a given digital electronic system is of utmost importance. Such modeling should include various types of batteries (primary and secondary), various self-discharge processes in different temperatures, and even energy harvesting, the latter to supply power for long-term content, low-power electronic subsystems. In this paper we analyze simple modeling of resource power management, including variations of all of these parameters and energy harvesting.

  10. Phase behaviors of binary mixtures composed of electron-rich and electron-poor triphenylene discotic liquid crystals

    Science.gov (United States)

    An, Lingling; Jing, Min; Xiao, Bo; Bai, Xiao-Yan; Zeng, Qing-Dao; Zhao, Ke-Qing

    2016-09-01

    Disk-like liquid crystals (DLCs) can self-assemble to ordered columnar mesophases and are intriguing one-dimensional organic semiconductors with high charge carrier mobility. To improve their applicable property of mesomorphic temperature ranges, we exploit the binary mixtures of electronic donor-acceptor DLC materials. The electron-rich 2,3,6,7,10,11-hexakis(alkoxy)triphenylenes (C4, C6, C8, C10, C12) and an electron-deficient tetrapentyl triphenylene-2,3,6,10-tetracarboxylate have been prepared and their binary mixtures have been investigated. The mesomorphism of the 1:1 (molar ratio) mixtures has been characterized by polarizing optical microscopy (POM), differential scanning calorimetry (DSC), and small angel x-ray scattering (SAXS). The self-assembled monolayer structure of a discogen on a solid-liquid interface has been imaged by the high resolution scanning tunneling microscopy (STM). The match of peripheral chain length has important influence on the mesomorphism of the binary mixtures. Project supported by the National Natural Science Foundation of China (Grant Nos. 51273133 and 51443004).

  11. The Influence of Reduced Gravity on the Crystal Growth of Electronic Materials

    Science.gov (United States)

    Su, Ching-Hua; Gillies, D. C.; Szofran, F. R.; Watring, D. A.; Lehoczky, S. L.

    1996-01-01

    The imperfections in the grown crystals of electronic materials, such as compositional nonuniformity, dopant segregation and crystalline structural defects, are detrimental to the performance of the opto-electronic devices. Some of these imperfections can be attributed to effects caused by Earth gravity during crystal growth process and four areas have been identified as the uniqueness of material processing in reduced gravity environment. The significant results of early flight experiments, i.e. prior to space shuttle era, are briefly reviewed followed by an elaborated review on the recent flight experiments conducted on shuttle missions. The results are presented for two major growth methods of electronic materials: melt and vapor growth. The use of an applied magnetic field in the melt growth of electrically conductive melts on Earth to simulate the conditions of reduced gravity has been investigated and it is believed that the superimposed effect of moderate magnetic fields and the reduced gravity environment of space can result in reduction of convective intensities to the extent unreachable by the exclusive use of magnet on Earth or space processing. In the Discussions section each of the significant results of the flight experiments is attributed to one of the four effects of reduced gravity and the unresolved problems on the measured mass fluxes in some of the vapor transport flight experiments are discussed.

  12. Switching processes in TGS crystals irradiated by high-current electron beam

    CERN Document Server

    Efimov, V V; Klevtsova, E A; Tyutyunnikov, S I

    2002-01-01

    The relaxation processes study of the dielectric permittivity epsilon during commutation of the external electric field in triglycine sulphate (NH sub 2 CH sub 2 COOH) sub 3 centre dot H sub 2 SO sub 4 (TGS) single crystal plates before and after irradiation by a high-current pulsed electron beam with different doses at various temperatures is presented. The parameters of the electron beam produced by the accelerator facility as a source were: energy E = 250 keV, current density I = 1000 A/cm sup 2 , fluence F = 15 J/cm sup 2 , pulse duration tau = 300 ns, beam density 5 centre dot sup 1 5 electrons/cm sup 2 per pulse. It was shown that the dependences of epsilon (t) are described by the Kohlrausch law: epsilon (t) approx exp (-t/tau) supalpha, where alpha is the average relaxation time of the all volume samples, 0 < alpha <1. Besides, it was found that switching processes in the irradiated crystals were much more intensive than those in the non-irradiated ones. The relaxation times decrease with rising...

  13. Identifying and evaluating electronic learning resources for use in adult-gerontology nurse practitioner education.

    Science.gov (United States)

    Thompson, Hilaire J; Belza, Basia; Baker, Margaret; Christianson, Phyllis; Doorenbos, Ardith; Nguyen, Huong

    2014-01-01

    Enhancing existing curricula to meet newly published adult-gerontology advanced practice registered nurse (APRN) competencies in an efficient manner presents a challenge to nurse educators. Incorporating shared, published electronic learning resources (ELRs) in existing or new courses may be appropriate in order to assist students in achieving competencies. The purposes of this project were to (a) identify relevant available ELR for use in enhancing geriatric APRN education and (b) to evaluate the educational utility of identified ELRs based on established criteria. A multilevel search strategy was used. Two independent team members reviewed identified ELR against established criteria to ensure utility. Only resources meeting all criteria were retained. Resources were found for each of the competency areas and included formats such as podcasts, Web casts, case studies, and teaching videos. In many cases, resources were identified using supplemental strategies and not through traditional search or search of existing geriatric repositories. Resources identified have been useful to advanced practice educators in improving lecture and seminar content in a particular topic area and providing students and preceptors with additional self-learning resources. Addressing sustainability within geriatric APRN education is critical for sharing of best practices among educators and for sustainability of teaching and related resources. © 2014.

  14. Hopping Time Scales and the Phonon-Liquid Electron-Crystal Picture in Thermoelectric Copper Selenide

    Science.gov (United States)

    Voneshen, D. J.; Walker, H. C.; Refson, K.; Goff, J. P.

    2017-04-01

    The suppression of transverse phonons by liquidlike diffusion in superionic conductors has been proposed as a means to dramatically reduce thermal conductivity in thermoelectric materials [H. Lui et al. Nat. Mater. 11, 422 (2012), 10.1038/nmat3273]. We have measured the ion transport and lattice dynamics in the original phonon-liquid electron-crystal Cu2Se using neutron spectroscopy. We show that hopping time scales are too slow to significantly affect lattice vibrations and that the transverse phonons persist at all temperatures. Substantial changes to the phonon spectrum occur well below the transition to the superionic phase, and the ultralow thermal conductivity is instead attributed to anharmonicity.

  15. Light quasiparticles dominate electronic transport in molecular crystal field-effect transistors

    Energy Technology Data Exchange (ETDEWEB)

    Li, Z. Q.; Podzorov, V.; Sai, N.; Martin, Michael C.; Gershenson, M. E.; Di Ventra, M.; Basov, D. N.

    2007-03-01

    We report on an infrared spectroscopy study of mobile holes in the accumulation layer of organic field-effect transistors based on rubrene single crystals. Our data indicate that both transport and infrared properties of these transistors at room temperature are governed by light quasiparticles in molecular orbital bands with the effective masses m[small star, filled]comparable to free electron mass. Furthermore, the m[small star, filled]values inferred from our experiments are in agreement with those determined from band structure calculations. These findings reveal no evidence for prominent polaronic effects, which is at variance with the common beliefs of polaron formation in molecular solids.

  16. Environmental scanning electron microscope (ESEM) evaluation of crystal and plaque formation associated with biocorrosion.

    Science.gov (United States)

    Geiger, S L; Ross, T J; Barton, L L

    1993-08-01

    The biofilm attributed to Desulfovibrio vulgaris growing in the presence of ferrous metals was examined with an environmental scanning electron microscope. This novel microscope produced images of iron sulfide colloids and other iron containing structures that had not been reported previously. A plaque composed of iron sulfide enveloped the surface of the corroding metal while crystals containing magnesium, iron, sulfur, and phosphorus were present in the culture where corrosion was in progress. A structure resembling the tubercule found in aerobic corrosion was observed on stainless steel undergoing biocorrosion and the elements present in this structure included sulfur, iron, chloride, calcium, potassium, and chromium.

  17. Electron microscopic investigation of crystal lattice bending-torsion and internal stresses in deformed polycrystalline alloys

    Energy Technology Data Exchange (ETDEWEB)

    Koneva, N. A., E-mail: koneva@tsuab.ru; Kozlov, E. V. [Tomsk State University of Architecture and Building, 634003, Tomsk, Solyanaya Sq., 2 (Russian Federation)

    2016-01-15

    Generalization of the results of electron microscopy investigations of the crystal lattice bending-torsion (χ) and the internal stresses (IS) was conducted. The deformed polycrystalline alloys and steels were investigated. The sources of χ and IS origin were established. The regularities of their change with the distance from the sources and the evolution with deformation were revealed. The contribution of IS into the deformation resistance was determined. The nature of formation of two sequences of dislocation substructure transformations during deformation of alloys was established.

  18. Studies of the surface structures of molecular crystals and of adsorbed molecular monolayers on the (111) crystal faces of platinum and silver by low-energy electron diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Firment, L.E.

    1977-01-01

    The structures of molecular crystal surfaces were investigated for the first time by the use of low-energy electron diffraction (LEED). The experimental results from a variety of molecular crystals were examined and compared as a first step towards understanding the properties of these surfaces on a microscopic level. The method of sample preparation employed, vapor deposition onto metal single-crystal substrates at low temperatures in ultrahigh vacuum, allowed concurrent study of the structures of adsorbed monolayers on metal surfaces and of the growth processes of molecular films on metal substrates. The systems investigated were ice, ammonia, naphthalene, benzene, the n-paraffins (C/sub 3/ to C/sub 8/), cyclohexane, trioxane, acetic acid, propionic acid, methanol, and methylamine adsorbed and condensed on both Pt(111) and Ag(111) surfaces. Electron-beam-induced damage of the molecular surfaces was observed after electron exposures of 10/sup -4/ A sec cm/sup -2/ at 20 eV. Aromatic molecular crystal samples were more resistant to damage than samples of saturated molecules. The quality and orientation of the grown molecular crystal films were influenced by substrate preparation and growth conditions. Forty ordered monolayer structures were observed. 110 figures, 22 tables, 162 references.

  19. Dimers of nineteen-electron sandwich compounds: Crystal and electronic structures, and comparison of reducing strengths

    KAUST Repository

    Mohapatra, Swagat Kumar

    2014-10-03

    The dimers of some Group 8 metal cyclopentadienyl/ arene complexes and Group 9 metallocenes can be handled in air, yet are strongly reducing, making them useful n-dopants in organic electronics. In this work, the Xray molecular structures are shown to resemble those of Group 8 metal cyclopentadienyl/pentadienyl or Group 9 metal cyclopentadienyl/diene model compounds. Compared to those of the model compounds, the DFT HOMOs of the dimers are significantly destabilized by interactions between the metal and the central C-C σ-bonding orbital, accounting for the facile oxidation of the dimers. The lengths of these C-C bonds (X-ray or DFT) do not correlate with DFT dissociation energies, the latter depending strongly on the monomer stabilities. Ru and Ir monomers are more reducing than their Fe and Rh analogues, but the corresponding dimers also exhibit much higher dissociation energies, so the estimated monomer cation/neutral dimer potentials are, with the exception of that of [RhCp2]2, rather similar (-1.97 to-2.15 V vs. FeCp2 +/0 in THF). The consequences of the variations in bond strength and redox potentials for the reactivity of the dimers are discussed.

  20. Single-crystal nanowires grown via electron-beam-induced deposition

    Science.gov (United States)

    Klein, K. L.; Randolph, S. J.; Fowlkes, J. D.; Allard, L. F.; Meyer, H. M., III; Simpson, M. L.; Rack, P. D.

    2008-08-01

    Electron-beam-induced deposition (EBID) is a useful technique for direct-writing of three-dimensional dielectric, semiconductor, and metallic materials with nanoscale precision and resolution. The EBID process, however, has been limited in many cases because precursor byproducts (typically from organic precursors like W(CO)6) are incorporated into the deposited material resulting in contaminated and amorphous structures. In this work, we have investigated the structure and composition of EBID tungsten nanostructures as-deposited from a tungsten hexafluoride (WF6) precursor. High resolution transmission electron microscopy, electron diffraction and electron spectroscopy were employed to determine the effects that the electron beam scanning conditions have on the deposit characteristics. The results show that slow, one-dimensional lateral scanning produces textured β-tungsten nanowire cores surrounded by an oxide secondary layer, while stationary vertical growth leads to single-crystal [100]-oriented W3O nanowires. Furthermore we correlate how the growth kinetics affect the resultant nanowire structure and composition.

  1. Single-crystal nanowires grown via electron-beam-induced deposition

    Energy Technology Data Exchange (ETDEWEB)

    Klein, K L; Randolph, S J; Simpson, M L; Rack, P D [Materials Science and Engineering Department, University of Tennessee, 434 Dougherty Hall, Knoxville, TN 37996 (United States); Fowlkes, J D [Center for Nanophase Materials Sciences Division, Oak Ridge National Laboratory, PO Box 2008, Oak Ridge, TN 37831 (United States); Allard, L F; III, H M Meyer [Materials Science and Technology Division, Oak Ridge National Laboratory, PO Box 2008, Oak Ridge, TN 37831 (United States)], E-mail: prack@utk.edu

    2008-08-27

    Electron-beam-induced deposition (EBID) is a useful technique for direct-writing of three-dimensional dielectric, semiconductor, and metallic materials with nanoscale precision and resolution. The EBID process, however, has been limited in many cases because precursor byproducts (typically from organic precursors like W(CO){sub 6}) are incorporated into the deposited material resulting in contaminated and amorphous structures. In this work, we have investigated the structure and composition of EBID tungsten nanostructures as-deposited from a tungsten hexafluoride (WF{sub 6}) precursor. High resolution transmission electron microscopy, electron diffraction and electron spectroscopy were employed to determine the effects that the electron beam scanning conditions have on the deposit characteristics. The results show that slow, one-dimensional lateral scanning produces textured {beta}-tungsten nanowire cores surrounded by an oxide secondary layer, while stationary vertical growth leads to single-crystal [100]-oriented W{sub 3}O nanowires. Furthermore we correlate how the growth kinetics affect the resultant nanowire structure and composition.

  2. Nonlocal electron-phonon coupling in the pentacene crystal: Beyond the Γ-point approximation

    KAUST Repository

    Yi, Yuanping

    2012-01-01

    There is currently increasing interest in understanding the impact of the nonlocal (Peierls-type) electron-phonon mechanism on charge transport in organic molecular semiconductors. Most estimates of the non-local coupling constants reported in the literature are based on the Γ-point phonon modes. Here, the influence of phonon modes spanning the entire Brillouin zone (phonon dispersion) on the nonlocal electron-phonon couplings is investigated for the pentacene crystal. The phonon modes are obtained by using a supercell approach. The results underline that the overall nonlocal couplings are substantially underestimated by calculations taking sole account of the phonons at the Γ point of the unit cell. The variance of the transfer integrals based on Γ-point normal-mode calculations at room temperature is underestimated in some cases by 40% for herringbone-type dimers and by over 80% for cofacial dimers. Our calculations show that the overall coupling is somewhat larger for holes than for electrons. The results also suggest that the interactions of charge carriers (both electrons and holes) with acoustic and optical phonons are comparable. Therefore, an adequate description of the charge-transport properties in pentacene and similar systems requires that these two electron-phonon coupling mechanisms be treated on the same footing. © 2012 American Institute of Physics.

  3. Library Electronic Resource Sharing Among Liberal Arts Colleges: ACS Palladian Alliance Project

    Directory of Open Access Journals (Sweden)

    Wenxian Zhang

    1997-03-01

    Full Text Available 無Effective electronic resource sharing is critical to library information services of the 1990s. Explosion of data and increased cost of information force libraries to work together, and technological advancements present the library service profession a platform for resource sharing. The Palladian Alliance Project of the Associated Colleges of the South is designed to provides ACS member institutions an effective means to enhance information access for their faculty and students, and achieve significant cost containment in the years to come.

  4. Availability, Level of Use and Constraints to Use of Electronic Resources by Law Lecturers in Public Universities in Nigeria

    Science.gov (United States)

    Amusa, Oyintola Isiaka; Atinmo, Morayo

    2016-01-01

    (Purpose) This study surveyed the level of availability, use and constraints to use of electronic resources among law lecturers in Nigeria. (Methodology) Five hundred and fifty-two law lecturers were surveyed and four hundred and forty-two responded. (Results) Data analysis revealed that the level of availability of electronic resources for the…

  5. First studies of 500-nm Cherenkov radiation from 255-MeV electrons in a diamond crystal

    Energy Technology Data Exchange (ETDEWEB)

    Takabayashi, Y., E-mail: takabayashi@saga-ls.jp [SAGA Light Source, 8-7 Yayoigaoka, Tosu, Saga 841-0005 (Japan); Fiks, E.I. [National Research Tomsk Polytechnic University, 634050 Tomsk (Russian Federation); Pivovarov, Yu.L. [National Research Tomsk Polytechnic University, 634050 Tomsk (Russian Federation); National Research Tomsk State University, 634050 Tomsk (Russian Federation)

    2015-06-12

    The first experiment on Cherenkov light from 255-MeV electrons passing through a 50-μm-thick diamond crystal in a special geometry allowing extraction of 500-nm Cherenkov light at a right angle with respect to the electron beam direction has been performed at the injector linac of SAGA Light Source accelerator facility. The dependence of 500-nm Cherenkov light intensity (separated by a band-pass filter) on the crystal rotation angle was measured by a CCD detector. The experimentally obtained rocking curve with an intense maximum is theoretically explained as the projector effect of Cherenkov light deflected by the exit surface of the crystal. The width of the rocking curve is explained by the convolution of the standard Tamm–Frank angular distribution of Cherenkov radiation with chromatic aberration, the multiple scattering of electrons in a crystal, and initial electron beam angular divergence. In addition, it is found that the Cherenkov light intensity did not change under the (220) planar channeling condition, which is consistent with a recent theory. - Highlights: • Cherenkov light from 255-MeV electrons in a diamond crystal has been investigated. • The Cherenkov light from channeled electrons has been observed for the first time. • The experimental results are in good agreement with theory.

  6. Comment on 'Electronic Properties of Red P-Type T12S5 Single Crystals'

    Institute of Scientific and Technical Information of China (English)

    M. Cankurtaran; H. (C)elik

    2007-01-01

    Recently, Gamal et al. [Chin. Phys. Lett. 22 (2005) 1530] reported the results of electrical conductivity, Hall effect and thermoelectric measurements on p-type Th2S5 single crystals. From the experimental data for the temperature dependence of differential thermoelectric power, Gamal et al. determined the values of 2.66 × 10-41 kg and 2.50 × 10-41 kg, respectively, for the effective masses of electrons and holes in p-type Tl2S5, which are about ten orders of magnitude smaller than the free electron mass (9.11 × 10-31 kg). We argue that the anomalously small values obtained for the effective mass of charge carriers in Tl2S5 have no physical significance.

  7. Crystal and electronic structures of substituted halide perovskites based on density functional calculation and molecular dynamics

    Science.gov (United States)

    Takaba, Hiromitsu; Kimura, Shou; Alam, Md. Khorshed

    2017-03-01

    Durability of organo-lead halide perovskite are important issue for its practical application in a solar cells. In this study, using density functional theory (DFT) and molecular dynamics, we theoretically investigated a crystal structure, electronic structure, and ionic diffusivity of the partially substituted cubic MA0.5X0.5PbI3 (MA = CH3NH3+, X = NH4+ or (NH2)2CH+ or Cs+). Our calculation results indicate that a partial substitution of MA induces a lattice distortion, resulting in preventing MA or X from the diffusion between A sites in the perovskite. DFT calculations show that electronic structures of the investigated partially substituted perovskites were similar with that of MAPbI3, while their bandgaps slightly decrease compared to that of MAPbI3. Our results mean that partial substitution in halide perovskite is effective technique to suppress diffusion of intrinsic ions and tune the band gap.

  8. Mott Electrons in an Artificial Graphenelike Crystal of Rare-Earth Nickelate S.

    Energy Technology Data Exchange (ETDEWEB)

    Middey, Srimanta; Meyers, Derek J.; Doennig, D.; Kareev, M; Liu, Xiaoran; Cao, Yanwei; Yang, Zhenzhong; Shi, Jinan; Gu, Lin; Ryan, Philip J.; Freeland, J. W.; Pentcheva, R.; Chakhalian, J.

    2016-02-05

    Deterministic control over the periodic geometrical arrangement of the constituent atoms is the backbone of the material properties, which, along with the interactions, define the electronic and magnetic ground state. Following this notion, a bilayer of a prototypical rare-earth nickelate, NdNiO3, combined with a dielectric spacer, LaAlO3, has been layered along the pseudocubic [111] direction. The resulting artificial graphenelike Mott crystal with magnetic 3d electrons has antiferromagnetic correlations. In addition, a combination of resonant X-ray linear dichroism measurements and ab initio calculations reveal the presence of an ordered orbital pattern, which is unattainable in either bulk nickelates or nickelate based heterostructures grown along the [001] direction. These findings highlight another promising venue towards designing new quantum many-body states by virtue of geometrical engineering.

  9. Real-time observation of interfering crystal electrons in high-harmonic generation

    CERN Document Server

    Hohenleutner, M; Schubert, O; Knorr, M; Huttner, U; Koch, S W; Kira, M; Huber, R

    2016-01-01

    Accelerating and colliding particles has been a key strategy to explore the texture of matter. Strong lightwaves can control and recollide electronic wavepackets, generating high-harmonic (HH) radiation which encodes the structure and dynamics of atoms and molecules and lays the foundations of attosecond science. The recent discovery of HH generation in bulk solids combines the idea of ultrafast acceleration with complex condensed matter systems and sparks hope for compact solid-state attosecond sources and electronics at optical frequencies. Yet the underlying quantum motion has not been observable in real time. Here, we study HH generation in a bulk solid directly in the time-domain, revealing a new quality of strong-field excitations in the crystal. Unlike established atomic sources, our solid emits HH radiation as a sequence of subcycle bursts which coincide temporally with the field crests of one polarity of the driving terahertz waveform. We show that these features hallmark a novel non-perturbative qua...

  10. Electronic structure modification of the KTaO3 single-crystal surface by Ar+ bombardment

    Science.gov (United States)

    Wadehra, Neha; Tomar, Ruchi; Halder, Soumyadip; Sharma, Minaxi; Singh, Inderjit; Jena, Nityasagar; Prakash, Bhanu; De Sarkar, Abir; Bera, Chandan; Venkatesan, Ananth; Chakraverty, S.

    2017-09-01

    Oxygen vacancies play an important role in controlling the physical properties of a perovskite oxide. We report alterations in the electronic properties of a cubic perovskite oxide, namely, KTaO3, as a function of oxygen vacancies. The conducting surface of the KTaO3 single-crystal substrate has been realized via Ar+ irradiation. The band gap changes as a function of conductivity which is controlled by irradiation time, indicating the formation of defect states. Kelvin probe force microscopy suggests a sharp increase in the work function upon Ar+ irradiation for a short period of time followed by a monotonic decrease, as we increase the irradiation time. Our experimental findings along with theoretical simulations suggest a significant surface dipole contribution and an unusual change in the electronic band line-up of KTaO3 due to oxygen vacancies.

  11. Simulation of Ultra-Relativistic Electrons and Positrons Channeling in Crystals with MBN Explorer

    CERN Document Server

    Sushko, Gennady B; Solov'yov, Ilia A; Korol, Andrei V; Greiner, Walter; Solov'yov, Andrey V

    2013-01-01

    A newly developed code, implemented as a part of the \\MBNExplorer package \\cite{MBN_ExplorerPaper,MBN_ExplorerSite} to simulate trajectories of an ultra-relativistic projectile in a crystalline medium, is presented. The motion of a projectile is treated classically by integrating the relativistic equations of motion with account for the interaction between the projectile and crystal atoms. The probabilistic element is introduced by a random choice of transverse coordinates and velocities of the projectile at the crystal entrance as well as by accounting for the random positions of the atoms due to thermal vibrations. The simulated trajectories are used for numerical analysis of the emitted radiation. Initial approbation and verification of the code have been carried out by simulating the trajectories and calculating the radiation emitted by $\\E=6.7$ GeV and $\\E=855$ MeV electrons and positrons in oriented Si(110) crystal and in amorphous silicon. The calculated spectra are compared with the experimental data ...

  12. Simulation of ultra-relativistic electrons and positrons channeling in crystals with MBN EXPLORER

    Science.gov (United States)

    Sushko, Gennady B.; Bezchastnov, Victor G.; Solov'yov, Ilia A.; Korol, Andrei V.; Greiner, Walter; Solov'yov, Andrey V.

    2013-11-01

    A newly developed code, implemented as a part of the MBN EXPLORER package (Solov'yov et al., 2012; http://www.mbnexplorer.com/, 2012) [1,2] to simulate trajectories of an ultra-relativistic projectile in a crystalline medium, is presented. The motion of a projectile is treated classically by integrating the relativistic equations of motion with account for the interaction between the projectile and crystal atoms. The probabilistic element is introduced by a random choice of transverse coordinates and velocities of the projectile at the crystal entrance as well as by accounting for the random positions of the atoms due to thermal vibrations. The simulated trajectories are used for numerical analysis of the emitted radiation. Initial approbation and verification of the code have been carried out by simulating the trajectories and calculating the radiation emitted by ε=6.7 GeV and ε=855 MeV electrons and positrons in oriented Si(110) crystal and in amorphous silicon. The calculated spectra are compared with the experimental data and with predictions of the Bethe-Heitler theory for the amorphous environment.

  13. Theoretical Studies on the Electronic Structures and Properties of Complex Ceramic Crystals and Novel Materials

    Energy Technology Data Exchange (ETDEWEB)

    Ching, Wai-Yim

    2012-01-14

    This project is a continuation of a long program supported by the Office of Basic Energy Science in the Office of Science of DOE for many years. The final three-year continuation started on November 1, 2005 with additional 1 year extension to October 30, 2009. The project was then granted a two-year No Cost Extension which officially ended on October 30, 2011. This report covers the activities within this six year period with emphasis on the work completed within the last 3 years. A total of 44 papers with acknowledgement to this grant were published or submitted. The overall objectives of this project are as follows. These objectives have been evolved over the six year period: (1) To use the state-of-the-art computational methods to investigate the electronic structures of complex ceramics and other novel crystals. (2) To further investigate the defects, surfaces/interfaces and microstructures in complex materials using large scale modeling. (3) To extend the study on ceramic materials to more complex bioceramic crystals. (4) To initiate the study on soft condensed matters including water and biomolecules. (5) To focus on the spectroscopic studies of different materials especially on the ELNES and XANES spectral calculations and their applications related to experimental techniques. (6) To develop and refine computational methods to be effectively executed on DOE supercomputers. (7) To evaluate mechanical properties of different crystals and those containing defects and relate them to the fundamental electronic structures. (8) To promote and publicize the first-principles OLCAO method developed by the PI (under DOE support for many years) for applications to large complex material systems. (9) To train a new generation of graduate students and postdoctoral fellows in modern computational materials science and condensed matter physics. (10) To establish effective international and domestic collaborations with both experimentalists and theorists in materials

  14. Mesoporous SnO₂ single crystals as an effective electron collector for perovskite solar cells.

    Science.gov (United States)

    Zhu, Zonglong; Zheng, Xiaoli; Bai, Yang; Zhang, Teng; Wang, Zilong; Xiao, Shuang; Yang, Shihe

    2015-07-28

    Mesoporous single crystals are prized for their fast electron transport and high surface area. Here we report the first synthesis of mesoporous SnO2 single crystals (SnO2 MSCs) by a simple silica-templated hydrothermal method, and its application in solution-processed perovskite solar cells (PSCs). A relatively low efficiency (3.76%) was obtained due to the strong charge recombination at the SnO2/perovskite interface. However, by coating a thin TiO2 barrier layer on SnO2via TiCl4 treatment, we were able to achieve an 8.54% power conversion efficiency (PCE). A dynamics study using impedance spectroscopy revealed a much lower transport resistance for the SnO2 MSC-based solar cells than for the TiO2 nanocrystal PSCs, but a stronger recombination. Significantly, the thin TiO2 coating layer on SnO2 considerably reduced the recombination while largely maintaining the superior electron-transport properties.

  15. Oblique propagation of electrons in crystals of germanium and silicon at sub-Kelvin temperature in low electric fields

    CERN Document Server

    Cabrera, B; Moffatt, R; Sundqvist, K; Sadoulet, B

    2010-01-01

    We show that oblique propagation of electrons in crystals of Ge and Si, where the electron velocity does not follow the electric field even on average, can be explained using standard anisotropic theory for indirect gap semiconductors. These effects are pronounced at temperatures below ~1K and for electric fields below ~5V/cm because inter-valley transitions are energetically suppressed forcing electrons to remain in the same band valley throughout their motion and the valleys to separate in position space. To model, we start with an isotropic approximation which incorporates the average properties of the crystals with one phonon mode, and include the ellipsoidal electron valleys by transforming into a momentum space where constant energy surfaces are spheres. We include comparisons of simulated versus measured drift velocities for holes and electrons, and explain the large discrepancy between electrons and holes for shared events in adjacent electrodes.

  16. Real-time observation of interfering crystal electrons in high-harmonic generation.

    Science.gov (United States)

    Hohenleutner, M; Langer, F; Schubert, O; Knorr, M; Huttner, U; Koch, S W; Kira, M; Huber, R

    2015-07-30

    Acceleration and collision of particles has been a key strategy for exploring the texture of matter. Strong light waves can control and recollide electronic wavepackets, generating high-harmonic radiation that encodes the structure and dynamics of atoms and molecules and lays the foundations of attosecond science. The recent discovery of high-harmonic generation in bulk solids combines the idea of ultrafast acceleration with complex condensed matter systems, and provides hope for compact solid-state attosecond sources and electronics at optical frequencies. Yet the underlying quantum motion has not so far been observable in real time. Here we study high-harmonic generation in a bulk solid directly in the time domain, and reveal a new kind of strong-field excitation in the crystal. Unlike established atomic sources, our solid emits high-harmonic radiation as a sequence of subcycle bursts that coincide temporally with the field crests of one polarity of the driving terahertz waveform. We show that these features are characteristic of a non-perturbative quantum interference process that involves electrons from multiple valence bands. These results identify key mechanisms for future solid-state attosecond sources and next-generation light-wave electronics. The new quantum interference process justifies the hope for all-optical band-structure reconstruction and lays the foundation for possible quantum logic operations at optical clock rates.

  17. Cation disordering in magnesium aluminate spinel crystals induced by electron or ion irradiation

    Energy Technology Data Exchange (ETDEWEB)

    Soeda, Takeshi E-mail: soeda@regroup5.nucl.kyushu-u.ac.jp; Matsumura, Syo; Kinoshita, Chiken; Zaluzec, Nestor J

    2000-12-01

    Structural changes in magnesium aluminate spinel (MgO {center_dot} nAl{sub 2}O{sub 3}) single crystals, which were irradiated with 900 keV electrons or 1 MeV Ne{sup +} ions at 873 K, were examined by electron channeling enhanced X-ray microanalysis. Unirradiated MgO {center_dot} Al{sub 2}O{sub 3} has a tendency to form the normal spinel configuration, where Mg{sup 2+} ions and Al{sup 3+} ions occupy mainly the tetrahedral and the octahedral sites, respectively. Electron irradiation induces simple cation disordering between the tetrahedral sites and the octahedral sites in MgO {center_dot} Al{sub 2}O{sub 3}. In addition to cation disordering, slight evacuation of cations from the tetrahedral sites to the octahedral sites occurs in a peak-damaged area in MgO {center_dot} Al{sub 2}O{sub 3} irradiated with Ne{sup +} ions. In contrast, cation disordering is suppressed in MgO {center_dot} 2.4Al{sub 2}O{sub 3} irradiated with electrons. The structural vacancies, present in the non-stoichiometric compound, appear to be effective in promoting irradiation damage recovery through interstitial-vacancy recombination.

  18. A crystal detector for measuring beta and internal conversion electrons in flowing air containing fission gases

    Science.gov (United States)

    Schell, W. R.; Vives-Batlle, J.; Yoon, S. R.; Tobin, M. J.

    1999-02-01

    Low levels of radioactive gases are released from nuclear electric power generation, nuclear fuel reprocessing plants, nuclear weapons tests and from diagnostic medical uses of radioactive gas tracers. A prototype model of an inorganic scintillator - Crystal Gas Electron Detector (CGED) - was built for measurements of xenon isotopes in-line by detecting the beta and internal conversion (IC) electrons present in atmospheric samples. The detection and quantification of the radionuclide spectra are accomplished, during air flow, without complete purification of the fission gases. Initial operational tests and calibrations made permit the integration of the CGED into a portable Gas Analysis, Separation and Purification (GASP) system [1-3]. The CGED detector, Pulse Shaping and Timing (PSA) electronics, and mathematical treatment of the accumulated spectra are used to resolve the K and LMNO-IC electrons and beta continuum. These data are used, in-line, for dating the age of an air parcel containing fission gases released from nuclear reactors and/or from nuclear weapons tests, as part of the monitoring equipment required to enforce the Comprehensive Test Ban Treaty, CTBT. This report is one of a series of papers providing the design features, operational methods, calibration, and applications of radioactive gas analysis system to the International CTBT.

  19. Electronic and crystal structure analysis of the FeCrO{sub 3} oxide

    Energy Technology Data Exchange (ETDEWEB)

    Ozkendir, Osman Murat, E-mail: ozkendir@gmail.com

    2013-12-15

    Highlights: •The crystal, electronic and magnetic properties of FeCrO{sub 3} compound are investigated. •The measured data were compared with the parent oxides Cr{sub 2}O{sub 3} and Fe{sub 2}O{sub 3}of the compound to identify the structural and electronic change during the process of FeCrO{sub 3} structure. •The electronic properties of the sample were investigated via Fe, Cr L{sub 3,2}and O K-edges and the measurements to probe magnetic properties were performed. •In the FeCrO{sub 3} structure, traces of the O{sub h} and T{sub d} site symmetric local Fe{sup 3+} formations were observed. •The Fe{sup 3+} ions with O{sub h} symmetry as in the parent oxide α-Fe{sub 2}O{sub 3} (hematite) were determined to have antiferromagnetic ordering. -- Abstract: The magnetic and electronic behaviors of FeCrO{sub 3} crystal were investigated by X-ray absorption near edge (XANES) and X-ray magnetic linear dichroism (XMLD) techniques. The measured data were compared with the parent oxides Cr{sub 2}O{sub 3} and α-Fe{sub 2}O{sub 3} of the compound to identify the structural and electronic change during the process of FeCrO{sub 3} structure. The electronic properties of the sample were investigated via Fe, Cr L{sub 3,2} and O K-edges. The XMCD measurements to probe magnetic properties were performed by an external magnetic field of 0.4 T. In the FeCrO{sub 3} structure, traces of the O{sub h} and T{sub d} site symmetric local Fe{sup 3+} formations were observed. The Fe{sup 3+} ions with O{sub h} symmetry as in the parent oxide α-Fe{sub 2}O{sub 3} (hematite) were determined to have antiferromagnetic order in the structure. However, domains who have T{sub d} site symmetry with ferrimagnetic order due to the γ-Fe{sub 2}O{sub 3} (maghemite) formation were determined.

  20. Characterization of the Absolute Crystal Polarity across Twin Boundaries in Gallium Phosphide Using Convergent-Beam Electron Diffraction.

    Science.gov (United States)

    Cohen; McKernan; Carter

    1999-05-01

    : The measurement of absolute crystal polarity is crucial to understanding the structural properties of many planar defects in compound semiconductors. Grain boundaries, including twin boundaries, in the sphalerite lattice are uniquely characterized by the crystallographic misorientation of individual grains and the direction of the crystal polarity in domains adjoining the grain boundary. To evaluate crystal polarity in gallium phosphide (GaP), asymmetrical interference contrast in convergent-beam electron-diffraction (CBED) patterns was used to ascertain the nature and direction of polar bonds. The direction of the asymmetry in the electron diffraction reflections was correlated with the crystal polarity of a sample with known polarity. The CBED technique was applied to determine the polar orientation of grains adjoining Sigma = 3 coherent and lateral twin boundaries in polycrystalline GaP.

  1. Suppression of Raman electron spin relaxation of radicals in crystals. Comparison of Cu2+ and free radical relaxation in triglycine sulfate and Tutton salt single crystals.

    Science.gov (United States)

    Hoffmann, S K; Goslar, J; Lijewski, S

    2011-08-31

    Electron spin-lattice relaxation was measured by the electron spin echo method in a broad temperature range above 4.2 K for Cu(2+) ions and free radicals produced by ionizing radiation in triglycine sulfate (TGS) and Tutton salt (NH4)(2)Zn(SO4)2 ⋅ 6H2O crystals. Localization of the paramagnetic centres in the crystal unit cells was determined from continuous wave electron paramagnetic resonance spectra. Various spin relaxation processes and mechanisms are outlined. Cu(2+) ions relax fast via two-phonon Raman processes in both crystals involving the whole phonon spectrum of the host lattice. This relaxation is slightly slower for TGS where Cu(2+) ions are in the interstitial position. The ordinary Raman processes do not contribute to the radical relaxation which relaxes via the local phonon mode. The local mode lies within the acoustic phonon band for radicals in TGS but within the optical phonon range in (NH4)(2)Zn(SO4)2 ⋅ 6H2O. In the latter the cross-relaxation was considered. A lack of phonons around the radical molecules suggested a local crystal amorphisation produced by x- or γ-rays.

  2. Electronic excitation energy transfer and nonstationary processes in KH2PO4:Tl crystals

    Science.gov (United States)

    Ogorodnikov, I. N.; Pustovarov, V. A.

    2017-04-01

    We report the results of our experimental study and numerical simulation of the electronic excitation energy transfer to impurity centers under conditions where nonstationary processes take place in the hydrogen sublattice of potassium dihydrogen phosphate (KH2PO4) single crystals doped with mercury-like Tl+ ions (KDP:Tl). We present the experimental results of our investigation of the decay kinetics of the transient optical absorption (100 ns-50 s) of intrinsic defects in the hydrogen sublattice of KDP:Tl obtained by pulsed absorption spectroscopy and the results of our study of the dynamics of the change in steady-state luminescence intensity with irradiation time (1-5000 s). To explain the transfer of the energy being released during electron recombination involving intrinsic KDP:Tl lattice defects, we formulate a mathematical model for the transfer of this energy to impurity Tl+ luminescence centers. Within the model being developed, we present the systems of differential balance equations describing the nonstationary processes in the electron subsystem and the hydrogen sublattice; provide a technique for calculating the pair correlation functions Y( r, t) of dissimilar defects based on the solution of the Smoluchowski equation for the system of mobile hydrogen sublattice defects; calculate the time-dependent reaction rate constants K( t) for various experimental conditions; and outline the peculiarities and results of the model parametrization based on our experimental data. Based on our investigation, the dramatic and significant effect of a gradual inertial increase by a factor of 50-100 in steady-state luminescence intensity in the 4.5-eV band in KDP:Tl crystals due to the luminescence of mercury-like Tl+ ions has been explained qualitatively and quantitatively.

  3. Electronic Properties of the Zirconium Crystal with Vacancies and Dynamics of Vacancies: ab-initio Calculations and Molecular Dynamics

    Directory of Open Access Journals (Sweden)

    V.O. Kharchenko

    2015-06-01

    Full Text Available Within this paper we have the studied structural and electronic properties of zirconium crystal with vacancies from the first principles. We have defined the optimal values for the lattice constants. The corresponding densities of states and energetic spectrum were calculated. These results gave a possibility to define the Fermi structure of the zirconium crystal with vacancies. In the framework of the molecular dynamics simulations we have studied the dynamics of the ensemble of periodically located vacancies in the zirconium crystal with an increase in temperature. We have analyzed the reconstruction of atomic structure and change in the total volume of the crystal with the temperature growth. The dependencies of the volume expansion coefficient for the pure zirconium without vacancies end zirconium crystal with different vacancies concentration on the temperature were studied.

  4. Electronic structures of TiN and TiC-Extension of Molecular Orbital Method into Crystals

    Institute of Scientific and Technical Information of China (English)

    Bin Song; Gaoling Zhao

    2000-01-01

    Density of states and theoretical X-ray emission spectra for the valence bands of TiN and TiC are obtained with a molecular orbital method. In order to describe electronic structures of crystals, local clusters for the molecular orbital calculations are extended, including the effects from the outside of the cluster in the crystal. The theoretical results are in good agreement with the experimental ones.

  5. Channeling and Radiation of 855 MeV Electrons and Positrons in Straight and Bent Tungsten (110) Crystals

    CERN Document Server

    Shen, H; Zhang, F S; Sushko, Gennady B; Korol, Andrei V; Solov'yov, Andrey V

    2016-01-01

    Planar channeling of 855 MeV electrons and positrons in straight and bent tungsten (110) crystal is simulated by means of the \\MBNExplorer software package. The results of simulations for a broad range of bending radii are analyzed in terms of the channel acceptance, dechanneling length, and spectral distribution of the emitted radiation. Comparison of the results with predictions of other theories as well as with the data for (110) oriented diamond, silicon and germanium crystals is carried out.

  6. Model of e-learning with electronic educational resources of new generation

    Directory of Open Access Journals (Sweden)

    A. V. Loban

    2017-01-01

    Full Text Available Purpose of the article: improving of scientific and methodical base of the theory of the е-learning of variability. Methods used: conceptual and logical modeling of the е-learning of variability process with electronic educational resource of new generation and system analysis of the interconnection of the studied subject area, methods, didactics approaches and information and communication technologies means. Results: the formalization complex model of the е-learning of variability with electronic educational resource of new generation is developed, conditionally decomposed into three basic components: the formalization model of the course in the form of the thesaurusclassifier (“Author of e-resource”, the model of learning as management (“Coordination. Consultation. Control”, the learning model with the thesaurus-classifier (“Student”. Model “Author of e-resource” allows the student to achieve completeness, high degree of didactic elaboration and structuring of the studied material in triples of variants: modules of education information, practical task and control tasks; the result of the student’s (author’s of e-resource activity is the thesaurus-classifier. Model of learning as management is based on the principle of personal orientation of learning in computer environment and determines the logic of interaction between the lecturer and the student when determining the triple of variants individually for each student; organization of a dialogue between the lecturer and the student for consulting purposes; personal control of the student’s success (report generation and iterative search for the concept of the class assignment in the thesaurus-classifier before acquiring the required level of training. Model “Student” makes it possible to concretize the learning tasks in relation to the personality of the student and to the training level achieved; the assumption of the lecturer about the level of training of a

  7. Structural, elastic and electronic Properties of isotropic cubic crystals of carbon and silicon nanotubes : Density functional based tight binding calculations.

    Directory of Open Access Journals (Sweden)

    Alexander L. Ivanovskii

    2008-01-01

    Full Text Available Atomic models of cubic crystals (CC of carbon and graphene-like Si nanotubes are offered and their structural, cohesive, elastic and electronic properties are predicted by means of the DFTB method. Our main findings are that the isotropic crystals of carbon nanotubes adopt a very high elastic modulus B and low compressibility β, namely B = 650 GPa, β = 0.0015 1/GPa. In addition, these crystals preserve the initial conductivity type of their “building blocks”, i.e. isolated carbon and Si nanotubes. This feature may be important for design of materials with the selected conductivity type.

  8. Kinetics of liquid-mediated crystallization of amorphous Ge from multi-frame dynamic transmission electron microscopy

    Energy Technology Data Exchange (ETDEWEB)

    Santala, M. K., E-mail: melissa.santala@oregonstate.edu; Campbell, G. H. [Materials Science Division, Lawrence Livermore National Laboratory, 7000 East Ave., Livermore, California 94551 (United States); Raoux, S. [Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Hahn-Meitner-Platz 1, D-14109 Berlin (Germany)

    2015-12-21

    The kinetics of laser-induced, liquid-mediated crystallization of amorphous Ge thin films were studied using multi-frame dynamic transmission electron microscopy (DTEM), a nanosecond-scale photo-emission transmission electron microscopy technique. In these experiments, high temperature gradients are established in thin amorphous Ge films with a 12-ns laser pulse with a Gaussian spatial profile. The hottest region at the center of the laser spot crystallizes in ∼100 ns and becomes nano-crystalline. Over the next several hundred nanoseconds crystallization continues radially outward from the nano-crystalline region forming elongated grains, some many microns long. The growth rate during the formation of these radial grains is measured with time-resolved imaging experiments. Crystal growth rates exceed 10 m/s, which are consistent with crystallization mediated by a very thin, undercooled transient liquid layer, rather than a purely solid-state transformation mechanism. The kinetics of this growth mode have been studied in detail under steady-state conditions, but here we provide a detailed study of liquid-mediated growth in high temperature gradients. Unexpectedly, the propagation rate of the crystallization front was observed to remain constant during this growth mode even when passing through large local temperature gradients, in stark contrast to other similar studies that suggested the growth rate changed dramatically. The high throughput of multi-frame DTEM provides gives a more complete picture of the role of temperature and temperature gradient on laser crystallization than previous DTEM experiments.

  9. Electronic and crystal structure changes induced by in-plane oxygen vacancies in multiferroic YMn O3

    Science.gov (United States)

    Cheng, Shaobo; Li, Menglei; Meng, Qingping; Duan, Wenhui; Zhao, Y. G.; Sun, X. F.; Zhu, Yimei; Zhu, Jing

    2016-02-01

    The widely spread oxygen vacancies (VO) in multiferroic materials can strongly affect their physical properties. However, their exact influence has rarely been identified in hexagonal manganites. Here, with the combined use of transmission electron microscopy (TEM) and first-principles calculations, we have systematically studied the electronic and crystal structure modifications induced by VO located at the same Mn atomic plane (in-plane VO). Our TEM experiments reveal that the easily formed in-plane VO not only influence the electronic structure of YMn O3 but alter the in-plane Wyckoff positions of Mn ions, which may subsequently affect the intraplane and interplane exchange interaction of Mn ions. The ferroelectricity is also impaired due to the introduction of VO. Further calculations confirm these electronic and structural changes and modifications. Our results indicate that the electronic and crystal structure of YMn O3 can be manipulated by the creation of VO.

  10. Measurement of Coherent Emission and Linear Polarization of Photons by Electrons in the Strong Fields of Aligned Crystals

    CERN Document Server

    Apyan, A; Badelek, B; Ballestrero, S; Biino, C; Birol, I; Cenci, P; Connell, S H; Eichblatt, S; Fonseca, T; Freund, A; Gorini, B; Groess, R; Ispirian, K; Ketel, T; Kononets, Yu V; López, A; Mangiarotti, A; Van Rens, B; Sellschop, J P Friedel; Shieh, M; Sona, P; Strakhovenko, V M; Uggerhøj, Erik; Uggerhøj, U; Ünel, G; Velasco, M; Vilakazi, Z Z; Wessely, O; Kononets, Yu.V.

    2004-01-01

    We present new results regarding the features of high energy photon emission by an electron beam of 178 GeV penetrating a 1.5 cm thick single Si crystal aligned at the Strings-Of-Strings (SOS) orientation. This concerns a special case of coherent bremsstrahlung where the electron interacts with the strong fields of successive atomic strings in a plane and for which the largest enhancement of the highest energy photons is expected. The polarization of the resulting photon beam was measured by the asymmetry of electron-positron pair production in an aligned diamond crystal analyzer. By the selection of a single pair the energy and the polarization of individual photons could be measured in an the environment of multiple photons produced in the radiator crystal. Photons in the high energy region show less than 20% linear polarization at the 90% confidence level.

  11. Binary ionic porphyrin nanosheets: electronic and light-harvesting properties regulated by crystal structure

    Science.gov (United States)

    Tian, Yongming; M. Beavers, Christine; Busani, Tito; Martin, Kathleen E.; Jacobsen, John L.; Mercado, Brandon Q.; Swartzentruber, Brian S.; van Swol, Frank; Medforth, Craig J.; Shelnutt, John A.

    2012-02-01

    Crystalline solids self-assembled from anionic and cationic porphyrins provide a new class of multifunctional optoelectronic micro- and nanomaterials. A 1 : 1 combination of zinc(ii) tetra(4-sulfonatophenyl)porphyrin (ZnTPPS) and tin(iv) tetra(N-methyl-4-pyridiniumyl)porphyrin (SnTNMePyP) gives porphyrin nanosheets with high aspect ratios and varying thickness. The room temperature preparation of the nanosheets has provided the first X-ray crystal structure of a cooperative binary ionic (CBI) solid. The unit cell contains one and one-half molecules of aquo-ZnTPPS4- (an electron donor) and three half molecules of dihydroxy-SnTNMePyP4+ (an electron acceptor). Charge balance in the solid is reached without any non-porphyrinic ions, as previously determined for other CBI nanomaterials by non-crystallographic means. The crystal structure reveals a complicated molecular arrangement with slipped π-π stacking only occurring in isolated dimers of one of the symmetrically unique zinc porphyrins. Consistent with the crystal structure, UV-visible J-aggregate bands indicative of exciton delocalization and extended π-π stacking are not observed. XRD measurements show that the structure of the Zn/Sn nanosheets is distinct from that of Zn/Sn four-leaf clover-like CBI solids reported previously. In contrast with the Zn/Sn clovers that do exhibit J-aggregate bands and are photoconductive, the nanosheets are not photoconductive. Even so, the nanosheets act as light-harvesting structures in an artificial photosynthesis system capable of reducing water to hydrogen but not as efficiently as the Zn/Sn clovers.Crystalline solids self-assembled from anionic and cationic porphyrins provide a new class of multifunctional optoelectronic micro- and nanomaterials. A 1 : 1 combination of zinc(ii) tetra(4-sulfonatophenyl)porphyrin (ZnTPPS) and tin(iv) tetra(N-methyl-4-pyridiniumyl)porphyrin (SnTNMePyP) gives porphyrin nanosheets with high aspect ratios and varying thickness. The room

  12. Electronic structure and pair potential energy analysis of 4-n-methoxy-4'-cyanobiphenyl: A nematic liquid crystal

    Science.gov (United States)

    Sharma, Dipendra; Dwivedi, M. K.; Tiwari, S. N.

    2016-05-01

    Electronic structure properties of 4-n-methoxy-4'-cyanobiphenyl, a pure nematic liquid crystal have been examined using an ab‒initio, HF/6‒31G(d,p) technique with GAMESS program. Conformational and charge distribution analysis have been carried out. MEP, HOMO and LUMO surfaces have been scanned. Ionization potential, electron affinity, electronegativity, global hardness and softness of the liquid crystal molecule have been calculated. Further, stacking, side by side and end to end interactions between a molecular pair have been evaluated. Results have been used to elucidate the physico-chemical and liquid crystalline properties of the system.

  13. Demonstration of Single-Crystal Self-Seeded Two-Color X-Ray Free-Electron Lasers

    Energy Technology Data Exchange (ETDEWEB)

    Lutman, A. A.; Decker, F. -J; Arthur, J.; Chollet, M.; Feng, Y.; Hastings, J.; Huang, Z.; Lemke, H.; Nuhn, H. -D.; Marinelli, A.; Turner, J. L.; Wakatsuki, S.; Welch, J.; Zhu, D.

    2014-12-18

    A scheme for generating two simultaneous hard-x-ray free-electron laser pulses with a controllable difference in photon energy is described and then demonstrated using the self-seeding setup at the Linac Coherent Light Source (LCLS). The scheme takes advantage of the existing LCLS equipment, which allows two independent rotations of the self-seeding diamond crystal. The two degrees of freedom are used to select two nearby crystal reflections, causing two wavelengths to be present in the forward transmitted seeding x-ray pulse. The free-electron laser system must support amplification at both desired wavelengths.

  14. Hard-photon emission from 150-GeV electrons incident on Si and Ge single crystals near axial directions

    Energy Technology Data Exchange (ETDEWEB)

    Medenwaldt, R.; Moller, S.P.; Sorensen, A.H.; Tang-Petersen, S.; Uggerhoj, E. (Institute of Physics, University of Aarhus, DK-8000 Aarhus C, Denmark (DK)); Elsener, K. (European Organization for Nuclear Research (CERN), CH-1211 Geneva 23, Switzerland (CH)); Hage-Ali, M.; Siffert, P.; Stoquert, J. (Centre de Recherches Nucleaires, F-67037 Strasbourg CEDEX, France (FR)); Maier, K. (The Max-Planck Institut fuer Metallforschung, D-7000 Stuttgart 80, Federal Republic of Germany (DE))

    1989-12-25

    The emission of high-energy photons from 150-GeV electrons traversing single crystals near axial directions is studied experimentally for Ge and, for the first time, also for Si. Enhancements relative to random up to 2 orders of magnitude are observed. For incident angles much less than the critical channeling angle {psi}{sub 1} a pronounced peak appears in the photon spectra near {similar to}85% of the electron energy for both the Si and the Ge crystals. The peak disappears for incident angles larger than {similar to}0.3{psi}{sub 1}. The experimental findings are compared to theoretical results.

  15. ELECTRONIC STRUCTURE OF BISMUTH MOLYBDENUM OXIDE SINGLE CRYSTAL Bi0.19MoO3

    Institute of Scientific and Technical Information of China (English)

    XIONG RUI; SHI JING; TANG WU-FENG; TIAN DE-CHENG

    2001-01-01

    Single crystal Bi0. 19MoO3 has been grown by fused salt electrolytic technique. X-ray powder diffraction shows that the unit cell parameters are: a=1.9985nm, b=0.4085nm and c=1.4437nm. The temperature dependence of resistivity demonstrates a semiconductor characteristic. X-ray photoemission spectroscopy studies provide that the valence band of Bi0.19MoO3 are made up of oxygen pπ and the r*, r and σ bonding bands formed by orbital combination. The shoulder at 0.4 eV near the top of valence band may be formed from the non-bonding dxy orbitals of some Mo atoms. The O1s core-electron spectrum reveals the presence of two inequivalent bonds of oxygen ions in Bi0.19MoO3. Bi4f core-level spectrum shows two bonding characters of Bi atoms in bismuth molybdenum oxide single crystals. Mo3d core-level spectrum could be decomposed into two kinds of valence states of molybdenum(Mo+5 and Mo+6).

  16. Applying shot boundary detection for automated crystal growth analysis during in situ transmission electron microscope experiments

    Energy Technology Data Exchange (ETDEWEB)

    Moeglein, W. A.; Griswold, R.; Mehdi, B. L.; Browning, N. D.; Teuton, J.

    2017-01-03

    In-situ (scanning) transmission electron microscopy (S/TEM) is being developed for numerous applications in the study of nucleation and growth under electrochemical driving forces. For this type of experiment, one of the key parameters is to identify when nucleation initiates. Typically the process of identifying the moment that crystals begin to form is a manual process requiring the user to perform an observation and respond accordingly (adjust focus, magnification, translate the stage etc.). However, as the speed of the cameras being used to perform these observations increases, the ability of a user to “catch” the important initial stage of nucleation decreases (there is more information that is available in the first few milliseconds of the process). Here we show that video shot boundary detection (SBD) can automatically detect frames where a change in the image occurs. We show that this method can be applied to quickly and accurately identify points of change during crystal growth. This technique allows for automated segmentation of a digital stream for further analysis and the assignment of arbitrary time stamps for the initiation of processes that are independent of the user’s ability to observe and react.

  17. Pulse-shape discrimination between electron and nuclear recoils in a NaI(Tl) crystal

    CERN Document Server

    Lee, H S; Adhikari, P; Choi, S; Hahn, I S; Jeon, E J; Joo, H W; Kang, W G; Kim, G B; Kim, H J; Kim, H O; Kim, K W; Kim, N Y; Kim, S K; Kim, Y D; Kim, Y H; Lee, J H; Lee, M H; Leonard, D S; Li, J; Oh, S Y; Olsen, S L; Park, H K; Park, H S; Park, K S; Shim, J H; So, J H

    2015-01-01

    We report on the response of a high light-output NaI(Tl) crystal to nuclear recoils induced by neutrons from an Am-Be source and compare the results with the response to electron recoils produced by Compton scattered 662 keV $\\gamma$-rays from a $^{137}$Cs source. The measured pulse-shape discrimination (PSD) power of the NaI(Tl) crystal is found to be significantly improved because of the high light output of the NaI(Tl) detector. We quantify the PSD power with a quality factor and estimate the sensitivity to the interaction rate for weakly interacting massive particles (WIMPs) with nucleons, and the result is compared with the annual modulation amplitude observed by the DAMA/LIBRA experiment. The sensitivity to spin-independent WIMP-nucleon interactions based on 100 kg$\\cdot$year of data from NaI detectors is estimated with simulated experiments, using the standard halo model.

  18. Crystal Structure and Electronic Structure of a Luminescent Compound 2-(2-Pyridyl) Benzimidazole

    Institute of Scientific and Technical Information of China (English)

    岳淑美; 苏忠民; 马建方; 廖奕; 阚玉和; 张恒君

    2003-01-01

    The crystal structure of 2-(2-pyridyl) benzimidazole was determined by singlecrystal X-ray diffraction at 193(2) K. It crystallizes in orthorhombic system, space group Pbca with unit cell constants a = 10.6204(7), b = 10.1407(4), c = 18.6327(8) A, Z= 8, V= 2006.7(2) A3, Dc. =1.292 g/cm3, F(000) = 816 andμ(MoKα) = 0.081 mm-1. The structure was refined to R = 0.0317 and wR = 0.0454 for 795 observed reflections with Ⅰ> 2σ(Ⅰ). In the solid state, it has an emission maximum at 369 nm, while in solution (DMSO), the maximum excitation is at 372 nm. Quantum chemistry calculation was performed by the method of density functional theory. Theoretical results show that atom N is the reactive site when coordinating with a metal, and the electronic structure of the title compound presents excellent carrier transport properties.

  19. Homoepitaxial Growth of Metal Halide Crystals Investigated by Reflection High-Energy Electron Diffraction

    Science.gov (United States)

    Chen, Pei; Kuttipillai, Padmanaban S.; Wang, Lili; Lunt, Richard R.

    2017-01-01

    We report the homoepitaxial growth of a metal halide on single crystals investigated with in situ reflection high-energy electron diffraction (RHEED) and ex situ atomic force microscopy (AFM). Epitaxial growth of NaCl on NaCl (001) is explored as a function of temperature and growth rate which provides the first detailed report of RHEED oscillations for metal halide growth. Layer-by-layer growth is observed at room temperature accompanied by clear RHEED oscillations while the growth mode transitions to an island (3D) mode at low temperature. At higher temperatures (>100 °C), RHEED oscillations and AFM data indicate a transition to a step-flow growth mode. To show the importance of such metal halide growth, green organic light-emitting diodes (OLEDs) are demonstrated using a doped NaCl film with a phosphorescent emitter as the emissive layer. This study demonstrates the ability to perform in situ and non-destructive RHEED monitoring even on insulating substrates and could enable doped single crystals and crystalline substrates for a range of optoelectronic applications.

  20. Homoepitaxial Growth of Metal Halide Crystals Investigated by Reflection High-Energy Electron Diffraction

    Science.gov (United States)

    Chen, Pei; Kuttipillai, Padmanaban S.; Wang, Lili; Lunt, Richard R.

    2017-01-01

    We report the homoepitaxial growth of a metal halide on single crystals investigated with in situ reflection high-energy electron diffraction (RHEED) and ex situ atomic force microscopy (AFM). Epitaxial growth of NaCl on NaCl (001) is explored as a function of temperature and growth rate which provides the first detailed report of RHEED oscillations for metal halide growth. Layer-by-layer growth is observed at room temperature accompanied by clear RHEED oscillations while the growth mode transitions to an island (3D) mode at low temperature. At higher temperatures (>100 °C), RHEED oscillations and AFM data indicate a transition to a step-flow growth mode. To show the importance of such metal halide growth, green organic light-emitting diodes (OLEDs) are demonstrated using a doped NaCl film with a phosphorescent emitter as the emissive layer. This study demonstrates the ability to perform in situ and non-destructive RHEED monitoring even on insulating substrates and could enable doped single crystals and crystalline substrates for a range of optoelectronic applications. PMID:28071732

  1. Zero temperature magnetic phase diagram of Wigner crystal in anisotropic two-dimensional electron systems

    Energy Technology Data Exchange (ETDEWEB)

    Zhou Chenggang [Department of Electrical Engineering, Princeton University, Princeton, NJ 08544 (United States)], E-mail: zcf@ornl.gov; Bhatt, Ravin N. [Department of Electrical Engineering, Princeton Center for Theoretical Physics, and Princeton Institute for the Science and Technology of Materials, Princeton University, Princeton, NJ 08544 (United States)

    2008-04-01

    We study the effect of mass anisotropy on the magnetic ordering of the Wigner crystal phase of low density electron systems in two dimensions at T=0. We apply the instanton approximation to various ring exchange processes, which includes the lowest order Gaussian fluctuations beyond the WKB approximation. The multi-particle exchange frequencies are calculated with effective mass anisotropy, both with and without ensuing lattice distortions. We find that when sufficient mass anisotropy is present, the two-spin exchange process between the nearest neighbors becomes more frequent than the three particle processes. Therefore, its corresponding antiferromagnetic exchange exceeds the ferromagnetic exchange from the three-spin process and becomes dominant. Numerical diagonalization of small clusters with two, three, and four-spin exchange terms shows a transition from a ferromagnetic to an antiferromagnetic ground state with increasing mass anisotropy.

  2. Inductive crystal field control in layered metal oxides with correlated electrons

    Energy Technology Data Exchange (ETDEWEB)

    Balachandran, P. V.; Cammarata, A.; Rondinelli, J. M., E-mail: jrondinelli@nortwestern.edu [Department of Materials Science and Engineering, Drexel University, Philadelphia, Pennsylvania 19104 (United States); Nelson-Cheeseman, B. B. [School of Engineering, University of St. Thomas, St. Paul, Minnesota 55105 (United States); Materials Science Division, Argonne National Laboratory, Argonne, Illinois 60439 (United States); Bhattacharya, A. [Materials Science Division, Argonne National Laboratory, Argonne, Illinois 60439 (United States); Center for Nanoscale Materials, Argonne National Laboratory, Argonne, Illinois 60439 (United States)

    2014-07-01

    We show that the NiO{sub 6} crystal field energies can be tailored indirectly via heterovalent A cation ordering in layered (La,A)NiO{sub 4} Ruddlesden–Popper (RP) oxides, where A = Sr, Ca, or Ba, using density functional calculations. We leverage as a driving force the electrostatic interactions between charged [LaO]{sup 1+} and neutral [AO]{sup 0} planes to inductively tune the Ni–O bond distortions, without intentional doping or epitaxial strain, altering the correlated d-orbital energies. We use this strategy to design cation ordered LaCaNiO{sub 4} and LaBaNiO{sub 4} with distortions favoring enhanced Ni e{sub g} orbital polarization, and find local electronic structure signatures analogous to those in RP La-cuprates, i.e., parent phases of the high-temperature superconducting oxides.

  3. Defects in electron-irradiated MgOxnAl/sub 2/O/sub 3/ crystals

    Energy Technology Data Exchange (ETDEWEB)

    Gritsyna, V.T.; Gritsenko, N.V.; Kobyakov, V.A. (Khar' kovskij Gosudarstvennyj Univ. (Ukrainian SSR))

    1984-01-01

    Using the methods of optical and EPR spectroscopy point defects in crystals of magnesium-aluminium spinel of the MgOxAl/sub 2/O/sub 3/ and MgOx2.5Al/sub 2/O/sub 3/ composition after-irradiation with high-energy (14 MeV) electrons have been studied. Based an comparing the intensity of optical absorption bands versus the irradiation dose (from 3 x 10/sup 14/ to 9 x 10/sup 15/ el x cm/sup -2/) and EPR signals, and on angular dependences of the EPR spectram the spectroscopic characteristics and structure of monoelectron and monohole centres are determined.

  4. Design and fabrication of Si-based photonic crystal stamps with electron beam lithography (EBL)

    Science.gov (United States)

    Jannesary, Reyhaneh; Bergmair, Iris; Zamiri, Saeid; Hingerl, Kurt; Hubbard, Graham; Abbott, Steven; Chen, Qin; Allsopp, Duncan

    2009-05-01

    The quest for mass replication has established technologies like nanoimprinting via hard stamps or PDMS stamps, where the stamps are usually produced via Electron Beam Lithography (EBL) for applications in the microelectronic industry. On the other hand, nanopatterning with self ordered structures1 or via holographic patterns provide the basis for large area imprints for applications for example, antireflection coatings based on biomimetic motheyes2. In this work we report on a technology for enabling the mass replication of custom-designed and e-beam lithographically prepared structures via establishing novel roll to roll nanoimprint processes for pattern transfer into UV curable pre-polymers. The new nano-fabrication technology is based on the concept of Disposal Master Technology (DMT) capable of patterning areas up to 1 x 1 m2 and is suitable for mass volume manufacturing of large area arrays of sub-wavelength photonic elements. As an example to show the potential of the application of the new nanoimprint technologies, we choose the fabrication of a photonic crystal (PhC) structure with integrated light coupling devices for low loss interconnection between PhC lightwave circuits and optical fibre systems. We present two methods for fabrication of nanoimprint lithography stamps in Si substrate. In the first method optimized electron beam lithography (EBL) and lift-off patterning of a 15-nm thick Cr mask, and then the pattern transfer into Si using reacting ion etching (RIE) with SF6 as etch gas. In the first method, we use 200nm of positive resist PMMA 950K for EBL exposure. In this method, resist thickness, exposure dose, development time and parameter for etching have been optimized and a photonic crystal of Si-rods in air was fabricated. In the second method lift-off has not been performed and metal mask has been used as master. The subsequent steps for fabricating the master will be presented in detail.

  5. [Use of internet and electronic resources among Spanish intensivist physicians. First national survey].

    Science.gov (United States)

    Gómez-Tello, V; Latour-Pérez, J; Añón Elizalde, J M; Palencia-Herrejón, E; Díaz-Alersi, R; De Lucas-García, N

    2006-01-01

    Estimate knowledge and use habits of different electronic resources in a sample of Spanish intensivists: Internet, E-mail, distribution lists, and use of portable electronic devices. Self-applied questionnaire. A 50-question questionnaire was distributed among Spanish intensivists through the hospital marketing delegates of a pharmaceutical company and of electronic forums. A total of 682 questionnaires were analyzed (participation: 74%). Ninety six percent of those surveyed used Internet individually: 67% admitted training gap. Internet was the second source of clinical consultations most used (61%), slightly behind consultation to colleagues (65%). The pages consulted most were bibliographic databases (65%) and electronic professional journals (63%), with limited use of Evidence Based Medicine pages (19%). Ninety percent of those surveyed used e-mail regularly in the practice of their profession, although 25% admitted that were not aware of its possibilities. The use of E-mail decreased significantly with increase in age. A total of 62% of the intensivists used distribution lists. Of the rest, 42% were not aware of its existence and 32% admitted they had insufficient training to handle them. Twenty percent of those surveyed had portable electronic devices and 64% considered it useful, basically due to its rapid consultation at bedside. Female gender was a negative predictive factor of its use (OR 0.35; 95% CI 0.2-0.63; p=0.0002). A large majority of the Spanish intensivists use Internet and E-mail. E-mail lists and use of portable devices are still underused resources. There are important gaps in training and infrequent use of essential pages. There are specific groups that require directed educational policies.

  6. Review of material recovery from used electric and electronic equipment-alternative options for resource conservation.

    Science.gov (United States)

    Friege, Henning

    2012-09-01

    For waste from electric and electronic equipment, the WEEE Directive stipulates the separate collection of electric and electronic waste. As to new electric and electronic devices, the Restriction of Hazardous Substances (RoHS) Directive bans the use of certain chemicals dangerous for man and environment. From the implementation of the WEEE directive, many unsolved problems have been documented: poor collection success, emission of dangerous substances during collection and recycling, irretrievable loss of valuable metals among others. As to RoHS, data from the literature show a satisfying success. The problems identified in the process can be reduced to some basic dilemmas at the borders between waste management, product policy and chemical safety. The objectives of the WEEE Directive and the specific targets for use and recycling of appliances are not consistent. There is no focus on scarce resources. Extended producer responsibility is not sufficient to guarantee sustainable waste management. Waste management reaches its limits due to problems of implementation but also due to physical laws. A holistic approach is necessary looking at all branch points and sinks in the stream of used products and waste from electric and electronic equipment. This may be done with respect to the general rules for sustainable management of material streams covering the three dimensions of sustainable policy. The relationships between the players in the field of electric and electronic devices have to be taken into account. Most of the problems identified in the implementation process will not be solved by the current amendment of the WEEE Directive.

  7. Measurement of the electron and ion temperatures by the x-ray imaging crystal spectrometer on joint Texas experimental tokamak

    Science.gov (United States)

    Yan, W.; Chen, Z. Y.; Jin, W.; Lee, S. G.; Shi, Y. J.; Huang, D. W.; Tong, R. H.; Wang, S. Y.; Wei, Y. N.; Ma, T. K.; Zhuang, G.

    2016-11-01

    An x-ray imaging crystal spectrometer has been developed on joint Texas experimental tokamak for the measurement of electron and ion temperatures from the Kα spectra of helium-like argon and its satellite lines. A two-dimensional multi-wire proportional counter has been applied to detect the spectra. The electron and ion temperatures have been obtained from the Voigt fitting with the spectra of helium-like argon ions. The profiles of electron and ion temperatures show the dependence on electron density in ohmic plasmas.

  8. Aufwand und Nutzen des Electronic Resource Management Systems RMS an der UB Kassel

    Directory of Open Access Journals (Sweden)

    Tobias Pohlmann

    2016-03-01

    The university library of Kassel therefore uses SemperTool’s web-based electronic resource management system RMS. This paper presents the functionality of this system and makes an estimate of the expenditure of work necessary to enter all relevant information about licensed databases, e-book and e-journal packages with the corresponding individual resources. It also describes existing and projected tools for analysis and evaluation, which are decisive for the usefulness of such a system, and concludes with the satisfaction reached at the university library of Kassel. These experiences may help other libraries to decide whether or not to introduce RMS or a comparable system.

  9. Surface Morphology and Microstructural Characterization of KCl Crystals Grown in Halite-Sylvite Brine Solutions by Electron Backscattered Diffraction Techniques

    Science.gov (United States)

    Podder, Jiban; Basu, Ritwik; Evitts, Richard William; Besant, Robert William

    2015-11-01

    In this paper, a study on the ternary NaCl-KCl-H2O system was carried out by an extractive metallurgy technique from mixed brine solutions of different compositions at room temperature (23°C). The surface morphology and microstructure were examined using a scanning electron microscope (SEM), electron backscattered diffraction (EBSD) and an energy dispersive X-ray (EDX) spectroscopy. The presence of Na{ }+ was found to reduce the stability of the solutions and increase the crystallization induction period, interfacial energy, energy of formation of the nucleus and greatly reduce the nucleation rate of KCl crystal. The surface morphology of KCl crystals is significantly changed due to presence of 5 to 10% (w/w) of NaCl as impurities in the binary solutions and shows the formation of co-crystals of different crystallographic orientation of NaCl on the KCl surface. In addition X-ray diffraction studies performed on KCl crystals grown in halite-sylvite binary solutions reveals that these crystals are cubic in nature and its lattice constant is 6.2952 Å when the NaCl concentration is small.

  10. ELECTRONIC EDUCATIONAL RESOURCES FOR ONLINE SUPPORT OF MODERN CHEMISTRY CLASSES IN SPECIALIZED SCHOOL

    Directory of Open Access Journals (Sweden)

    Maria D. Tukalo

    2013-09-01

    Full Text Available This article contains material of some modern electronic educational resources that can be used via the Internet to support the modern chemistry classes in specialized school. It was drawn attention to the educational chemical experiments as means of knowledge; simulated key motivational characteristics to enhance students interest for learning subjects, their cognitive and practical activity in the formation of self-reliance and self-creative; commented forecasts for creating of conditions to enhance the creative potential of students in a modern learning environment.

  11. Electron and Light Microscopy Techniques Suitable for Studying Fatigue Damage in a Crystallized Glass Ceramic

    Science.gov (United States)

    Harrell, Shelley; Zaretsky, Erwin V.

    1961-01-01

    The crystals of Pyroceram are randomly oriented and highly reflective so that standard microscopy techniques are not satisfactory for studying this material. Standard replicating procedures proved difficult to use. New microscopy techniques and procedures have therefore been developed. A method for locating, orienting, and identifying specific areas to be viewed with an electron microscope is described. This method not require any special equipment. Plastic replicas were found to be unsatisfactory because of their tendency to adhere to Pryoceram. This caused them to tear when released or resulted in artifacts. Preshadowed silicon monoxide replicas were satisfactory but required a releasing agent. A method of depositing the releasing agent is described. To polish specimens without evidence of fire-polishing, it was found necessary to use a vibratory polishing technique. Chrome oxide was used as the abrasive and either water or kerosene as the lubricant. Vibratory polishing is extremely slow, but surfaces so polished show no evidence of fire polishing, even when examined by electron microscopy. The most satisfactory etching process used for Pyroceram 9608 consisted of a primary etch of 5 milliliters of hydrochloric acid (concentrated), 5 milliliters of hydrogen fluoride (45 percent), and 45 milliliters of water, and a secondary etch with methyl alcohol replacing the water. Best results were obtained with total etching times from 25 to 30 seconds. Staining of the Pyroceram surface with a Sanford's marker was found to be an expedient way to reduce the glare of reflected light.

  12. Crystal growth, electronic structure, and properties of Ni-substituted FeGa3

    Science.gov (United States)

    Likhanov, Maxim S.; Verchenko, Valeriy Yu.; Bykov, Mikhail A.; Tsirlin, Alexander A.; Gippius, Andrei A.; Berthebaud, David; Maignan, Antoine; Shevelkov, Andrei V.

    2016-04-01

    Crystals of the Fe1-xNixGa3 limited solid solution (x<0.045) have been grown from gallium flux. We have explored the electronic structure as well as magnetic and thermoelectric properties of Fe0.975Ni0.025Ga3 in comparison with Fe0.95Co0.05Ga3, following the rigid band approach and assuming that one Ni atom donates twice the number of electrons as one Co atom. However, important differences between the Co- and Ni-doped compounds are found below 620 K, which is the temperature of the metal-to-insulator transition for both compounds. We have found that Fe0.975Ni0.025Ga3 displays lower degree of spatial inhomogeneity on the local level and exhibits diamagnetic behavior with a broad shallow minimum in the magnetic susceptibility near 35 K, in sharp contrast with the Curie-Weiss paramagnetism of Fe0.95Co0.05Ga3. Transport measurements have shown the maximum of the thermoelectric figure-of-merit ZT of 0.09 and 0.14 at 620 K for Fe0.975Ni0.025Ga3 and Fe0.95Co0.05Ga3, respectively.

  13. Crystal growth and electronic properties of a 3D Rashba material, BiTeI, with adjusted carrier concentrations.

    Science.gov (United States)

    Kanou, Manabu; Sasagawa, Takao

    2013-04-03

    3D Rashba materials can be a leading player in spin-related novel phenomena, ranging from the metallic extreme (unconventional superconductivity) to the transport intermediate (spin Hall effects) to the novel insulating variant (3D topological insulating states). As the essential backbone for both fundamental and applied research of such a 3D Rashba material, this study established the growth of sizeable single crystals of a candidate compound BiTeI with adjusted carrier concentrations. Three techniques (standard vertical Bridgman, modified horizontal Bridgman, and vapour transport) were employed, and BiTeI crystals (>1 × 1 × 0.2 mm(3)) with fundamentally different electronic states from metallic to insulating were successfully grown by the chosen technique. The 3D Rashba electronic states, including the Fermi surface topology, for the corresponding carrier concentrations of the obtained BiTeI crystals were revealed by relativistic first-principles calculations.

  14. Spatial separation of photogenerated electrons and holes among {010} and {110} crystal facets of BiVO4

    Science.gov (United States)

    Li, Rengui; Zhang, Fuxiang; Wang, Donge; Yang, Jingxiu; Li, Mingrun; Zhu, Jian; Zhou, Xin; Han, Hongxian; Li, Can

    2013-02-01

    Charge separation is crucial for increasing the activity of semiconductor-based photocatalysts, especially in water splitting reactions. Here we show, using monoclinic bismuth vanadate crystal as a model photocatalyst, that efficient charge separation can be achieved on different crystal facets, as evidenced by the reduction reaction with photogenerated electrons and oxidation reaction with photogenerated holes, which take place separately on the {010} and {110} facets under photo-irradiation. Based on this finding, the reduction and oxidation cocatalysts are selectively deposited on the {010} and {110} facets respectively, resulting in much higher activity in both photocatalytic and photoelectrocatalytic water oxidation reactions, compared with the photocatalyst with randomly distributed cocatalysts. These results show that the photogenrated electrons and holes can be separated between the different facets of semiconductor crystals. This finding may be useful in semiconductor physics and chemistry to construct highly efficient solar energy conversion systems.

  15. Zintl Salts Ba2P7X (X = Cl, Br, and I: Synthesis, Crystal, and Electronic Structures

    Directory of Open Access Journals (Sweden)

    Juli-Anna Dolyniuk

    2013-08-01

    Full Text Available Two barium phosphide halides, Ba2P7Br and Ba2P7I, were synthesized and structurally characterized by single crystal X-ray diffraction. Both compounds crystallize in the monoclinic space group P21/m (No. 11 and are isostructural to Ba2P7Cl. The crystal structures of Ba2P7X (X = Cl, Br, I feature the presence of heptaphosphanortricyclane P73− clusters along with halogen anions and barium cations. According to the Zintl concept, Ba2P7X compounds are electron-balanced semiconductors. Quantum-chemical calculations together with UV-Visible spectroscopy confirm the title compounds are wide bandgap semiconductors. The bonding in the P73− clusters was analyzed by means of electron localization function. The elemental compositions were confirmed using energy dispersive X-ray spectroscopy.

  16. Teachers' Link to Electronic Resources in the Library Media Center: A Local Study of Awareness, Knowledge, and Influence

    Science.gov (United States)

    Williams, Teresa D.; Grimble, Bonnie J.; Irwin, Marilyn

    2004-01-01

    High school students often use online databases and the Internet in the school library media center (SLMC) to complete teachers' assignments. This case study used a survey to assess teachers' awareness of electronic resources, and to determine whether their directions influence student use of these resources in the SLMC. Participants were teachers…

  17. Impact of Knowledge Resources Linked to an Electronic Health Record on Frequency of Unnecessary Tests and Treatments

    Science.gov (United States)

    Goodman, Kenneth; Grad, Roland; Pluye, Pierre; Nowacki, Amy; Hickner, John

    2012-01-01

    Introduction: Electronic knowledge resources have the potential to rapidly provide answers to clinicians' questions. We sought to determine clinicians' reasons for searching these resources, the rate of finding relevant information, and the perceived clinical impact of the information they retrieved. Methods: We asked general internists, family…

  18. Ab initio electronic structure and correlations in pristine and potassium-doped molecular crystals of copper phthalocyanine

    NARCIS (Netherlands)

    Giovannetti, Gianluca; Brocks, Geert; Brink, van den Jeroen

    2008-01-01

    We investigate the effect that potassium intercalation has on the electronic structure of copper phthalocyanine (CuPc) molecular crystals by means of ab initio density functional calculations. Pristine CuPc (in its alpha and beta structures) is found to be an insulator containing local magnetic mome

  19. A United Effort for Crystal Growth, Neutron Scattering, and X-ray Scattering Studies of Novel Correlated Electron Materials

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Young S. [Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States)

    2015-02-12

    The research accomplishments during the award involved experimental studies of correlated electron systems and quantum magnetism. The techniques of crystal growth, neutron scattering, x-ray scattering, and thermodynamic & transport measurements were employed, and graduate students and postdoctoral research associates were trained in these techniques.

  20. Extreme UV and X-ray scattering measurements from a rough LiF crystal surface characterized by electron micrography

    DEFF Research Database (Denmark)

    Alehyane; Arbaoui; Barchewitz

    1989-01-01

    XUV and X-ray scattering by a LiF crystal is measured. The angular distribution of the scattered radiation (ADSR) reveals characteristic features, side peaks or asymmetry. The surface of the sample is statistically characterized by a microdensitometer analysis of electron micrographs resolving th...

  1. Ab initio electronic structure and correlations in pristine and potassium-doped molecular crystals of copper phthalocyanine

    NARCIS (Netherlands)

    Giovannetti, G.; Brocks, G.; van den Brink, J.

    2008-01-01

    We investigate the effect that potassium intercalation has on the electronic structure of copper phthalocyanine (CuPc) molecular crystals by means of ab initio density functional calculations. Pristine CuPc (in its alpha and beta structures) is found to be an insulator containing local magnetic

  2. Ab initio electronic structure and correlations in pristine and potassium-doped molecular crystals of copper phthalocyanine

    NARCIS (Netherlands)

    Giovannetti, G.; Brocks, G.; van den Brink, J.

    2008-01-01

    We investigate the effect that potassium intercalation has on the electronic structure of copper phthalocyanine (CuPc) molecular crystals by means of ab initio density functional calculations. Pristine CuPc (in its alpha and beta structures) is found to be an insulator containing local magnetic mome

  3. The Impact of Interlayer Electronic Coupling on Charge Transport in Organic Semiconductors: A Case Study on Titanylphthalocyanine Single Crystals.

    Science.gov (United States)

    Zhang, Zongpeng; Jiang, Lang; Cheng, Changli; Zhen, Yonggang; Zhao, Guangyao; Geng, Hua; Yi, Yuanping; Li, Liqiang; Dong, Huanli; Shuai, Zhigang; Hu, Wenping

    2016-04-18

    Traditionally, it is believed that three-dimensional transport networks are preferable to those of lower dimensions. We demonstrate that inter-layer electronic couplings may result in a drastic decrease of charge mobilities by utilizing field-effect transistors (FET) based on two phases of titanyl phthalocyanine (TiOPc) crystals. The α-phase crystals with electronic couplings along two dimensions show a maximum mobility up to 26.8 cm(2)  V(-1)  s(-1) . In sharp contrast, the β-phase crystals with extra significant inter-layer electronic couplings show a maximum mobility of only 0.1 cm(2)  V(-1)  s(-1) . Theoretical calculations on the bulk crystals and model slabs reveal that the inter-layer electronic couplings for the β-phase devices will diminish remarkably the device charge transport abilities owing to the coupling direction perpendicular to the current direction. This work provides new insights into the impact of the dimensionality and directionality of the packing arrangements on charge transport in organic semiconductors.

  4. Assessing two-dimensional crystallization trials of small membrane proteins for structural biology studies by electron crystallography.

    Science.gov (United States)

    Johnson, Matthew C; Rudolph, Frederik; Dreaden, Tina M; Zhao, Gengxiang; Barry, Bridgette A; Schmidt-Krey, Ingeborg

    2010-10-29

    Electron crystallography has evolved as a method that can be used either alternatively or in combination with three-dimensional crystallization and X-ray crystallography to study structure-function questions of membrane proteins, as well as soluble proteins. Screening for two-dimensional (2D) crystals by transmission electron microscopy (EM) is the critical step in finding, optimizing, and selecting samples for high-resolution data collection by cryo-EM. Here we describe the fundamental steps in identifying both large and ordered, as well as small 2D arrays, that can potentially supply critical information for optimization of crystallization conditions. By working with different magnifications at the EM, data on a range of critical parameters is obtained. Lower magnification supplies valuable data on the morphology and membrane size. At higher magnifications, possible order and 2D crystal dimensions are determined. In this context, it is described how CCD cameras and online-Fourier Transforms are used at higher magnifications to assess proteoliposomes for order and size. While 2D crystals of membrane proteins are most commonly grown by reconstitution by dialysis, the screening technique is equally applicable for crystals produced with the help of monolayers, native 2D crystals, and ordered arrays of soluble proteins. In addition, the methods described here are applicable to the screening for 2D crystals of even smaller as well as larger membrane proteins, where smaller proteins require the same amount of care in identification as our examples and the lattice of larger proteins might be more easily identifiable at earlier stages of the screening.

  5. Origin of electronic properties of PbGa{sub 2}Se{sub 4} crystal: Experimental and theoretical investigations

    Energy Technology Data Exchange (ETDEWEB)

    Babuka, T. [Institute of Physics, Jan Dlugosz University in Czestochowa, Al. Armii Krajowej 13/15, 42-200 Czestochowa (Poland); Kityk, I.V. [Faculty of Electrical Engineering, Czestochowa University Technology, Al. Armii Krajowej 17, 42-201 Czestochowa (Poland); Department of Solid State Physics, Eastern European National University, Voli 13 Ave., Lutsk 43205 (Ukraine); Parasyuk, O.V. [Department of Inorganic and Physical Chemistry, Eastern European National University, Voli 13 Ave., Lutsk 43205 (Ukraine); Myronchuk, G. [Department of Solid State Physics, Eastern European National University, Voli 13 Ave., Lutsk 43205 (Ukraine); Khyzhun, O.Y. [Institute for Problems of Materials Science, National Academy of Sciences of Ukraine, 3 Krzhyzhanivsky Street, Kyiv 03142 (Ukraine); Fedorchuk, A.O. [Lviv National University of Veterinary Medicine and Biotechnologies, Department of Inorganic and Organic Chemistry, Pekarska St. 50, 79010 Lviv (Ukraine); Makowska-Janusik, M., E-mail: m.makowska@ajd.czest.pl [Institute of Physics, Jan Dlugosz University in Czestochowa, Al. Armii Krajowej 13/15, 42-200 Czestochowa (Poland)

    2015-06-05

    Graphical abstract: In the presented work the structural and electronic properties of the PbGa{sub 2}Se{sub 4} single crystal were investigated experimentally as well as theoretically. The XPS spectra, Urbach’s rule and steepness parameters of PbGa{sub 2}Se{sub 4} single crystal have been investigated for the first time. The quantum chemical calculations were also never performed before for the studied structure. The theoretically obtained data help to explain the properties of material. - Highlights: • Urbach’s rule and steepness parameters for PbGa{sub 2}Se{sub 4} crystals explored for the first time. • Non-reactivity of the PbGa{sub 2}Se{sub 4} surface was established by XPS. • DFT approach shows its efficiency to describe electronic properties of PbGa{sub 2}Se{sub 4}. • Electronic parameters are affected by existence of electron–phonon interaction. - Abstract: The PbGa{sub 2}Se{sub 4} crystal is a promising material for optoelectronic applications. It is caused by coexistence of the large polarized Pb cations and a huge contribution of anharmonic phonon subsystem caused by chalcogenide anions. In the present work the electronic and optical properties of the mentioned material were studied theoretically as well as experimentally by optical and X-ray photoelectron spectroscopy methods. The DFT approach has been used for the quantum chemical electronic properties calculations. Urbach rule and steepness parameters of the PbGa{sub 2}Se{sub 4} crystal have been evaluated for the first time. These parameters and Urbach energies increase with increasing temperature of the samples that is typical for the semiconducting materials. The XPS measurements of the investigated crystal reveal that all the spectral features are originated from core-level states of the constituent elements. Simultaneously these results also confirm non-reactivity of the PbGa{sub 2}Se{sub 4} surface. However, the titled single crystal possesses a number of intrinsic structural

  6. A Review of Interface Electronic Systems for AT-cut Quartz Crystal Microbalance Applications in Liquids

    Directory of Open Access Journals (Sweden)

    Antonio Arnau

    2008-01-01

    Full Text Available From the first applications of AT-cut quartz crystals as sensors in solutionsmore than 20 years ago, the so-called quartz crystal microbalance (QCM sensor isbecoming into a good alternative analytical method in a great deal of applications such asbiosensors, analysis of biomolecular interactions, study of bacterial adhesion at specificinterfaces, pathogen and microorganism detection, study of polymer film-biomolecule orcell-substrate interactions, immunosensors and an extensive use in fluids and polymercharacterization and electrochemical applications among others. The appropriateevaluation of this analytical method requires recognizing the different steps involved andto be conscious of their importance and limitations. The first step involved in a QCMsystem is the accurate and appropriate characterization of the sensor in relation to thespecific application. The use of the piezoelectric sensor in contact with solutions stronglyaffects its behavior and appropriate electronic interfaces must be used for an adequatesensor characterization. Systems based on different principles and techniques have beenimplemented during the last 25 years. The interface selection for the specific application isimportant and its limitations must be known to be conscious of its suitability, and foravoiding the possible error propagation in the interpretation of results. This article presentsa comprehensive overview of the different techniques used for AT-cut quartz crystalmicrobalance in in-solution applications, which are based on the following principles:network or impedance analyzers, decay methods, oscillators and lock-in techniques. Theelectronic interfaces based on oscillators and phase-locked techniques are treated in detail,with the description of different configurations, since these techniques are the most used inapplications for detection of analytes in solutions, and in those where a fast sensorresponse is necessary.

  7. The detailed crystal and electronic structures of the cotunnite-type ZrO2

    Science.gov (United States)

    Zhang, Yan; Duan, Li; Ji, Vincent

    2016-07-01

    The detailed crystal and orbital-decomposed electronic structures of cotunnite-type ZrO2 have been investigated by using the first-principles projector augmented wave (PAW) potential within the generalized gradient approximation as well as taking into account on-site Coulomb repulsive interaction (GGA+U). The optimized structure shows that the OI and OII anions are surrounded by an arbitrary tetrahedron of four Zr cations and an arbitrary pentahedron of five Zr cations, respectively, in turn, the Zr cation is surrounded by an arbitrary tetrakaidecahedron formed by nine oxygen ligands. Although one more Zr cation is coordinated to OII, the larger bond lengths between OII and its adjacent five Zr cations (dOII-Zr) than those between OI and its adjacent four Zr cations (dOI-Zr) makes density of states (DOS) of s and three p (px , py and pz) states of the OII anion driving down in lower energy region and driving up in higher energy region. No crystal-field splitting is observed between three p (px , py and pz) states of anions OI and OII (between three p (px , py and pz) states and five d (dxy , dyz , dxz , dz2 and dx2-y2) states of cation Zr) is resulted from the arrangements of the surrounding cations (anions) do not have any symmetry. The additional covalent character upon Zr-O ionic bonds is attributed to the hybridization of itinerant Zr(5s) and less filled Zr(4d) states to the separated O(2s) and O(2p) states.

  8. Reducing Clinical Trial Monitoring Resource Allocation and Costs Through Remote Access to Electronic Medical Records

    Science.gov (United States)

    Uren, Shannon C.; Kirkman, Mitchell B.; Dalton, Brad S.; Zalcberg, John R.

    2013-01-01

    Purpose: With electronic medical records (eMRs), the option now exists for clinical trial monitors to perform source data verification (SDV) remotely. We report on a feasibility study of remote access to eMRs for SDV and the potential advantages of such a process in terms of resource allocation and cost. Methods: The Clinical Trials Unit at the Peter MacCallum Cancer Centre, in collaboration with Novartis Pharmaceuticals Australia, conducted a 6-month feasibility study of remote SDV. A Novartis monitor was granted dedicated software and restricted remote access to the eMR portal of the cancer center, thereby providing an avenue through which perform SDV. Results: Six monitoring visits were conducted during the study period, four of which were performed remotely. The ability to conduct two thirds of the monitoring visits remotely in this complex phase III study resulted in an overall cost saving to Novartis. Similarly, remote monitoring eased the strain on internal resources, particularly monitoring space and hospital computer terminal access, at the cancer center. Conclusion: Remote access to patient eMRs for SDV is feasible and is potentially an avenue through which resources can be more efficiently used. Although this feasibility study involved limited numbers, there is no limit to scaling these processes to any number of patients enrolled onto large clinical trials. PMID:23633977

  9. Tetrel Bonds in Infinite Molecular Chains by Electronic Structure Theory and Their Role for Crystal Stabilization.

    Science.gov (United States)

    George, Janine; Dronskowski, Richard

    2017-02-16

    Intermolecular bonds play a crucial role in the rational design of crystal structures, dubbed crystal engineering. The relatively new term tetrel bonds (TBs) describes a long-known type of such interactions presently in the focus of quantum chemical cluster calculations. Here, we energetically explore the strengths and cooperativity of these interactions in infinite chains, a possible arrangement of such tetrel bonds in extended crystals, by periodic density functional theory. In the chains, the TBs are amplified due to cooperativity by up to 60%. Moreover, we computationally take apart crystals stabilized by infinite tetrel-bonded chains and assess the importance of the TBs for the crystal stabilization. Tetrel bonds can amount to 70% of the overall interaction energy within some crystals, and they can also be energetically decisive for the taken crystal structure; their individual strengths also compete with the collective packing within the crystal structures.

  10. Electronic theses and dissertations: a review of this valuable resource for nurse scholars worldwide.

    Science.gov (United States)

    Goodfellow, L M

    2009-06-01

    A worldwide repository of electronic theses and dissertations (ETDs) could provide worldwide access to the most up-to-date research generated by masters and doctoral students. Until that international repository is established, it is possible to access some of these valuable knowledge resources. ETDs provide a technologically advanced medium with endless multimedia capabilities that far exceed the print and bound copies of theses and dissertations housed traditionally in individual university libraries. CURRENT USE: A growing trend exists for universities worldwide to require graduate students to submit theses or dissertations as electronic documents. However, nurse scholars underutilize ETDs, as evidenced by perusing bibliographic citation lists in many of the research journals. ETDs can be searched for and retrieved through several digital resources such as the Networked Digital Library of Theses and Dissertations (http://www.ndltd.org), ProQuest Dissertations and Theses (http://www.umi.com), the Australasian Digital Theses Program (http://adt.caul.edu.au/) and through individual university web sites and online catalogues. An international repository of ETDs benefits the community of nurse scholars in many ways. The ability to access recent graduate students' research electronically from anywhere in the world is advantageous. For scholars residing in developing countries, access to these ETDs may prove to be even more valuable. In some cases, ETDs are not available for worldwide access and can only be accessed through the university library from which the student graduated. Public access to university library ETD collections is not always permitted. Nurse scholars from both developing and developed countries could benefit from ETDs.

  11. Angular distribution of the emission from ultrarelativistic electrons moving near crystallographic axes in diamond and tungsten crystals

    Energy Technology Data Exchange (ETDEWEB)

    Aleinik, A.N.; Vorobev, S.A.; Kalinin, B.N.; Kurkov, A.A.; Potylitsyn, A.P.

    1986-07-01

    Data on the angular distribution of the emission from ultrarelativistic electrons moving near crystallographic axes in diamond and tungsten crystals are reviewed. A graph is presented of the orientational dependence of soft gamma rays measured by a thin-walled ionization chamber sensitive to gamma rays with energies greater than 0.3 MeV and a radiative loss measured by a total-absorption Gauss quantometer with a threshold of about 5 MeV at an angle to the primary electron-beam direction of motion. It is concluded that knowledge of the scattering processes of ultrarelativistic electrons near crytal axes makes it easier to choose the optimum type and thickness of a crystal to achieve the maximum yield of gamma radiation into a given solid angle. 8 references.

  12. A preliminary categorization of end-of-life electrical and electronic equipment as secondary metal resources.

    Science.gov (United States)

    Oguchi, Masahiro; Murakami, Shinsuke; Sakanakura, Hirofumi; Kida, Akiko; Kameya, Takashi

    2011-01-01

    End-of-life electrical and electronic equipment (EEE) has recently received attention as a secondary source of metals. This study examined characteristics of end-of-life EEE as secondary metal resources to consider efficient collection and metal recovery systems according to the specific metals and types of EEE. We constructed an analogy between natural resource development and metal recovery from end-of-life EEE and found that metal content and total annual amount of metal contained in each type of end-of-life EEE should be considered in secondary resource development, as well as the collectability of the end-of-life products. We then categorized 21 EEE types into five groups and discussed their potential as secondary metal resources. Refrigerators, washing machines, air conditioners, and CRT TVs were evaluated as the most important sources of common metals, and personal computers, mobile phones, and video games were evaluated as the most important sources of precious metals. Several types of small digital equipment were also identified as important sources of precious metals; however, mid-size information and communication technology (ICT) equipment (e.g., printers and fax machines) and audio/video equipment were shown to be more important as a source of a variety of less common metals. The physical collectability of each type of EEE was roughly characterized by unit size and number of end-of-life products generated annually. Current collection systems in Japan were examined and potentially appropriate collection methods were suggested for equipment types that currently have no specific collection systems in Japan, particularly for video games, notebook computers, and mid-size ICT and audio/video equipment.

  13. From Millennium ERM to Proquest 360 Resource Manager: Implementing a new Electronic Resources Management System ERMS in an International Graduate Research University in Saudi Arabia

    KAUST Repository

    Ramli, Rindra M.

    2017-05-17

    An overview of the Recommendation Study and the subsequent Implementation of a new Electronic Resources Management system ERMS in an international graduate research university in the Kingdom of Saudi Arabia. It covers the timeline, deliverables and challenges as well as lessons learnt by the Project Team.

  14. Effect of an electron beam irradiation on optical and luminescence properties of LiBaAlF6 single crystals

    Science.gov (United States)

    Ogorodnikov, I. N.; Pustovarov, V. A.; Omelkov, S. I.; Kirm, M.

    2017-07-01

    Paper reports the effect of a 10 keV, 110 keV and 10 MeV electron beam irradiation on optical and luminescence properties of LiBaAlF6 (LBAF) single crystals at 10, 90, and 293 K. Five absorption bands at 2.0, 3.2, 4.3, 4.9 and 5.5 eV were revealed in irradiated crystals in the energy range of 1.2-9.5 eV. Several PL emission bands (1.7-1.8, 2.2 and 2.5-3.5 eV) related to defects were found in the luminescence spectra at room temperature, while only one luminescence band at E = 2.2 eV appears at T = 90 K in LBAF crystals after a 10 MeV electron bombardment. The PL excitation spectra and time-response for these emission bands were studied at 10, 90, and 293 K. Thermoluminescence (TL) of irradiated crystals was studied in the temperature range of 90-740 K. New TL glow peaks at 166, 530 and 670 K were revealed and their parameters were determined. Temperature dependence of relative photoluminescence yield recorded monitoring emission at the 1.87 and 2.23 eV in the temperature range from 130 to 450 K, were fitted using five quenching processes related to TL glow peaks revealed in our research. Significant similarity in the manifestation of radiation-induced defects for LBAF and previously studied LiBaF3 single crystals is noted. The effect of an electron beam irradiation on optical and luminescence properties of LBAF single crystals and possible origin of the radiation defects were discussed.

  15. Electron Scattering and Doping Mechanisms in Solid-Phase-Crystallized In2O3:H Prepared by Atomic Layer Deposition.

    Science.gov (United States)

    Macco, Bart; Knoops, Harm C M; Kessels, Wilhelmus M M

    2015-08-01

    Hydrogen-doped indium oxide (In2O3:H) has recently emerged as an enabling transparent conductive oxide for solar cells, in particular for silicon heterojunction solar cells because its high electron mobility (>100 cm(2)/(V s)) allows for a simultaneously high electrical conductivity and optical transparency. Here, we report on high-quality In2O3:H prepared by a low-temperature atomic layer deposition (ALD) process and present insights into the doping mechanism and the electron scattering processes that limit the carrier mobility in such films. The process consists of ALD of amorphous In2O3:H at 100 °C and subsequent solid-phase crystallization at 150-200 °C to obtain large-grained polycrystalline In2O3:H films. The changes in optoelectronic properties upon crystallization have been monitored both electrically by Hall measurements and optically by analysis of the Drude response. After crystallization, an excellent carrier mobility of 128 ± 4 cm(2)/(V s) can be obtained at a carrier density of 1.8 × 10(20) cm(-3), irrespective of the annealing temperature. Temperature-dependent Hall measurements have revealed that electron scattering is dominated by unavoidable phonon and ionized impurity scattering from singly charged H-donors. Extrinsic defect scattering related to material quality such as grain boundary and neutral impurity scattering was found to be negligible in crystallized films indicating that the carrier mobility is maximized. Furthermore, by comparison of the absolute H-concentration and the carrier density in crystallized films, it is deduced that <4% of the incorporated H is an active dopant in crystallized films. Therefore, it can be concluded that inactive H atoms do not (significantly) contribute to defect scattering, which potentially explains why In2O3:H films are capable of achieving a much higher carrier mobility than conventional In2O3:Sn (ITO).

  16. Synergetic crystallization in a Nd2Fe14B/α-Fe nanocomposite under electron beam exposure conditions.

    Science.gov (United States)

    Tian, Haidong; Zhang, Yinfeng; Han, Jingzhi; Xu, Zhuang; Zhang, Xiaodong; Liu, Shunquan; Wang, Changsheng; Yang, Yingchang; Han, Li; Yang, Jinbo

    2016-10-27

    Nd2Fe14B/α-Fe nanocomposite magnets are prepared through electron beam exposure with a greatly reduced annealing time of 0.1 s. This is by far the most effective approach due to the effect of an extremely high heating rate featuring a rapid thermal process. The impact that the rapid thermal process has on crystallization is expounded by the introduction of the Landau model and Langevin dynamical simulations. The change of crystallization sequence from the α-Fe phase preceding the Nd2Fe14B phase under conventional annealing conditions, to synergetic crystallization under electron beam conditions is investigated. Synergetic crystallization results in more intense interaction between the α-Fe phase and the Nd2Fe14B phase in order to refine the microstructure as the fraction of Fe increases within our addition range. Improved uniformity, and shifts in the microstructure and distribution of the α-Fe phase contribute to the improvement of the magnetic properties. Compared with conventional furnace annealing ones, the magnetic properties of samples under electron beam exposure conditions are improved. For the Nd10Fe83.3B6.2Nb0.2Ga0.3 alloy, coercivity is enhanced from 4.56 kOe to 6.73 kOe, remanence ratio increases from 0.75 to 0.79, and a superior squareness of the hysteresis loop is achieved.

  17. Method for the preparation of inorganic single crystal and polycrystalline electronic materials

    Science.gov (United States)

    Groves, W. O. (Inventor)

    1969-01-01

    Large area, semiconductor crystals selected from group 3-5 compounds and alloys are provided for semiconductor device fabrication by the use of a selective etching operation which completely removes the substrate on which the desired crystal was deposited. The substrate, selected from the same group as the single crystal, has a higher solution rate than the epitaxial single crystal which is essentially unaffected by the etching solution. The preparation of gallium phosphide single crystals using a gallium arsenide substrate and a concentrated nitric acid etching solution is described.

  18. Evidence for weakly bound electrons in non-irradiated alkane crystals. The electrons as a probe of structural differences in crystals

    CERN Document Server

    Pietrow, M; Misiak, L E; Kornarzynski, K; Szurkowski, J; Rochowski, P; Grzegorczyk, M

    2014-01-01

    It is generally assumed that weakly bound (trapped) electrons in organic solids come only from radiolytical (or photochemical) processes like ionization caused by an excited positron entering the sample. This paper presents an evidence for the presence of these electrons in non-irradiated samples of docosane. We argue that these electrons can be located (trapped) either in interlamellar gaps or in spaces made by non-planar conformers. The electrons from the former ones are bound more weakly than those from the latter ones. The origin of Vis absorption for the samples is explained. These spectra can be used as a probe indicating differences in the solid structures of hydrocarbons.

  19. Heteroepitaxy, an Amazing Contribution of Crystal Growth to the World of Optics and Electronics

    Directory of Open Access Journals (Sweden)

    Vladimir L. Tassev

    2017-06-01

    Full Text Available Advances in Electronics and Optics are often preceded by discoveries in Crystal Growth theory and practice. This article represents in retrospect some of the most significant contributions of heteroepitaxy in these and some other areas—the strong impact of the three modes of heteroepitaxy on microelectronics and quantum optics, the big “push” of PENDEO epitaxy in development of Light Emitting Diodes, etc. A large part of the text is dedicated to heteroepitaxy of nonlinear optical materials grown on orientation-patterned templates and used in the development of new quasi-phase-matching frequency conversion laser sources. By achieving new frequency ranges such sources will result in a wide variety of applications in areas such as defense, security, industry, medicine, and science. Interesting facts from the scientific life of major contributors in the field are mixed in the text with fine details from growth experiments, chemical equations, results from material characterizations and some optical and crystallographic considerations—all these presented in a popular way but without neglecting their scientific importance and depth. The truth is that often heteroepitaxy is not just the better but the only available option. The truth is that delays in device development are usually due to gaps in materials research. In all this, miscommunication between different scientific communities always costs vain efforts, uncertainty, and years of going in a wrong scientific direction. With this article we aim to stimulate a constructive dialog that could lead to solutions of important interdisciplinary scientific and technical issues.

  20. Crystal structure and electronic and magnetic properties of hexacyanoosmate(III).

    Science.gov (United States)

    Albores, Pablo; Slep, Leonardo D; Baraldo, Luis M; Baggio, Ricardo; Garland, María Teresa; Rentschler, Eva

    2006-03-20

    The [Os(III)(CN)6]3- anion is prepared by chemical oxidation in aqueous solution and isolated as yellow prisms of [Ph4P]3[Os(III)(CN)6].6H2O (1). This species crystallizes in the triclinic space group P with cell parameters a = 13.7609(11) A, b = 16.2275(13) A, c = 17.0895(14) A, alpha = 91.4040(10) degrees , beta = 109.3600(10) degrees , gamma = 102.3970(10) degrees , V = 3497.4(5) A(3), and Z = 2. The slightly distorted octahedral moiety displays Os-C and C-N bond lengths that average 2.058 and 1.146 A, respectively. Spin-orbit-coupling splitting of the ground-state term dominates the NIR region of the electronic spectrum and the magnetic behavior of 1. The experimental information points to higher spin delocalization over the coordinated cyanides than in [Fe(III)(CN)6]3-.

  1. Crystal Structures, Stabilities, Electronic Properties, and Hardness of MoB2: First-Principles Calculations.

    Science.gov (United States)

    Ding, Li-Ping; Shao, Peng; Zhang, Fang-Hui; Lu, Cheng; Ding, Lei; Ning, Shu Ya; Huang, Xiao Fen

    2016-07-18

    On the basis of the first-principles techniques, we perform the structure prediction for MoB2. Accordingly, a new ground-state crystal structure WB2 (P63/mmc, 2 fu/cell) is uncovered. The experimental synthesized rhombohedral R3̅m and hexagonal AlB2, as well as theoretical predicted RuB2 structures, are no longer the most favorite structures. By analyzing the elastic constants, formation enthalpies, and phonon dispersion, we find that the WB2 phase is thermodynamically and mechanically stable. The high bulk modulus B, shear modulus G, low Poisson's ratio ν, and small B/G ratio are benefit to its low compressibility. When the pressure is 10 GPa, a phase transition is observed between the WB2-MoB2 and the rhombohedral R3̅m MoB2 phases. By analyzing the density of states and electron density, we find that the strong covalent is formed in MoB2 compounds, which contributes a great deal to its low compressibility. Furthermore, the low compressibility is also correlated with the local buckled structure.

  2. Electron spin relaxation governed by Raman processes both for Cu²⁺ ions and carbonate radicals in KHCO₃ crystals: EPR and electron spin echo studies.

    Science.gov (United States)

    Hoffmann, Stanislaw K; Goslar, Janina; Lijewski, Stefan

    2012-08-01

    EPR studies of Cu²⁺ and two free radicals formed by γ-radiation were performed for KHCO₃ single crystal at room temperature. From the rotational EPR results we concluded that Cu²⁺ is chelated by two carbonate molecules in a square planar configuration with spin-Hamiltonian parameters g(||)=2.2349 and A(||)=18.2 mT. Free radicals were identified as neutral HOCO· with unpaired electron localized on the carbon atom and a radical anion CO₃·⁻ with unpaired electron localized on two oxygen atoms. The hyperfine splitting of the EPR lines by an interaction with a single hydrogen atom of HOCO· was observed with isotropic coupling constants a₀=0.31 mT. Two differently oriented radical sites were identified in the crystal unit cell. Electron spin-lattice relaxation measured by electron spin echo methods shows that both Cu²⁺ and free radicals relax via two-phonon Raman processes with almost the same relaxation rate. The temperature dependence of the relaxation rate 1/T₁ is well described with the effective Debye temperature Θ(D)=175 K obtained from a fit to the Debye-type phonon spectrum. We calculated a more realistic Debye temperature value from available elastic constant values of the crystal as Θ(D)=246 K. This Θ(D)-value and the Debye phonon spectrum approximation give a much worse fit to the experimental results. Possible contributions from a local mode or an optical mode are considered and it is suggested that the real phonon spectrum should be used for the relaxation data interpretation. It is unusual that free radicals in KHCO₃ relax similarly to the well localized Cu²⁺ ions, which suggests a small destruction of the host crystal lattice by the ionizing irradiation allowing well coupling between radical and lattice dynamics.

  3. Electron spin relaxation governed by Raman processes both for Cu2+ ions and carbonate radicals in KHCO3 crystals: EPR and electron spin echo studies

    Science.gov (United States)

    Hoffmann, Stanislaw K.; Goslar, Janina; Lijewski, Stefan

    2012-08-01

    EPR studies of Cu2+ and two free radicals formed by γ-radiation were performed for KHCO3 single crystal at room temperature. From the rotational EPR results we concluded that Cu2+ is chelated by two carbonate molecules in a square planar configuration with spin-Hamiltonian parameters g|| = 2.2349 and A|| = 18.2 mT. Free radicals were identified as neutral HOCOrad with unpaired electron localized on the carbon atom and a radical anion CO3·- with unpaired electron localized on two oxygen atoms. The hyperfine splitting of the EPR lines by an interaction with a single hydrogen atom of HOCOrad was observed with isotropic coupling constants ao = 0.31 mT. Two differently oriented radical sites were identified in the crystal unit cell. Electron spin-lattice relaxation measured by electron spin echo methods shows that both Cu2+ and free radicals relax via two-phonon Raman processes with almost the same relaxation rate. The temperature dependence of the relaxation rate 1/T1 is well described with the effective Debye temperature ΘD = 175 K obtained from a fit to the Debye-type phonon spectrum. We calculated a more realistic Debye temperature value from available elastic constant values of the crystal as ΘD = 246 K. This ΘD-value and the Debye phonon spectrum approximation give a much worse fit to the experimental results. Possible contributions from a local mode or an optical mode are considered and it is suggested that the real phonon spectrum should be used for the relaxation data interpretation. It is unusual that free radicals in KHCO3 relax similarly to the well localized Cu2+ ions, which suggests a small destruction of the host crystal lattice by the ionizing irradiation allowing well coupling between radical and lattice dynamics.

  4. Effect of heat treatment on electronic phase in underdoped La2-xSrxCuO4 single crystal

    Institute of Scientific and Technical Information of China (English)

    Shen Cai-Xia; Shen Xiao-Li; Lu Wei; Dong Xiao-Li; Li Zheng-Cai; Xiong Ji-Wu; Zhou Fang

    2008-01-01

    Superconducting La1.937Sr0.063CuO4 crystals grown by the travelling-solvent floating-zone technique were thermally treated under various temperatures and oxygen pressures for moderately adjusting the oxygen content. The response of intrinsic electronic property of the crystals to the change of hole density in La2-xSrxCuO4 in the vicinity of the magic doping of x = 1/16 (= 0.0625) is studied in detail by magnetic measurements under various fields up to 1 T. It is found that when the superconducting critical temperature (TC) increases with the oxygen content, there appears also a new subtle electronic state that can be detected from the differential curves of diamagnetic susceptibility dx/dT of the crystal sample. In contrast with the intrinsic state, the new subtle electronic state is very fragile under the magnetic fields. Our results indicate that a moderate change in oxygen doping does not significantly modify the intrinsic electronic state originally existing at the magic doping level.

  5. Electron paramagnetic resonance and electron-nuclear double resonance study of the neutral copper acceptor in ZnGeP sub 2 crystals

    CERN Document Server

    Stevens, K T; Setzler, S D; Schünemann, P G; Pollak, T M

    2003-01-01

    Electron paramagnetic resonance (EPR) and electron-nuclear double resonance have been used to characterize the neutral copper acceptor in ZnGeP sub 2 crystals. The copper substitutes for zinc and behaves as a conventional acceptor (i.e. the 3d electrons do not play a dominant role). Because of a high degree of compensation from native donors, the copper acceptors in our samples were initially in the nonparamagnetic singly ionized state (Cu sub Z sub n sup -). The paramagnetic neutral state (Cu sub Z sub n sup 0) was observed when the crystals were exposed to 632.8 nm or 1064 nm laser light while being held at a temperature below 50 K. The g matrix of the neutral copper acceptor is axial g sub p sub a sub r = 2.049 and g sub p sub e sub r sub p = 2.030), with the unique principal direction parallel to the tetragonal c axis of the crystal. The hyperfine and nuclear quadrupole matrices also exhibit c-axis symmetry (A sub p sub a sub r = 87.6 MHz, A sub p sub e sub r sub p = 34.8 MHz and P = 0.87 MHz for sup 6 su...

  6. Electronic tracking of human resource skills and knowledge, just in time training, manageable due diligence

    Energy Technology Data Exchange (ETDEWEB)

    Kolodziej, M.A. [Quick Test International Inc., (Canada). Canadian Technology Human Resource Board; Baker, O. [KeySpan Energy Canada, Calgary, AB (Canada)

    2001-06-01

    KeySpan Energy Canada is in the process of obtaining recognition of various occupational profiles including pipeline operators, inspectors, and field and plant operators from various certifying organizations. The process of allowing individuals to obtain certification is recognized by Canadian Technology Human Resources Board as a step towards national standards for technologists and technicians. Proven competency is a must for workers in todays oil industry in response to increasingly stringent government safety regulations, environmental concerns and high public scrutiny. Quick Test international Inc. has developed a management tool in collaboration with end users at KeySpan Energy Canada. It is an electronic, Internet based competency tool for tracking personal competencies and maintaining continued competency. Response to the tool has been favourable. 2 refs., 4 figs.

  7. [HYGIENIC REGULATION OF THE USE OF ELECTRONIC EDUCATIONAL RESOURCES IN THE MODERN SCHOOL].

    Science.gov (United States)

    Stepanova, M I; Aleksandrova, I E; Sazanyuk, Z I; Voronova, B Z; Lashneva, L P; Shumkova, T V; Berezina, N O

    2015-01-01

    We studied the effect of academic studies with the use a notebook computer and interactive whiteboard on the functional state of an organism of schoolchildren. Using a complex of hygienic and physiological methods of the study we established that regulation of the computer activity of students must take into account not only duration but its intensity either. Design features of a notebook computer were shown both to impede keeping the optimal working posture in primary school children and increase the risk offormation of disorders of vision and musculoskeletal system. There were established the activating influence of the interactive whiteboard on performance activities and favorable dynamics of indices of the functional state of the organism of students under keeping optimal density of the academic study and the duration of its use. There are determined safety regulations of the work of schoolchildren with electronic resources in the educational process.

  8. Medical Image Resource Center--making electronic teaching files from PACS.

    Science.gov (United States)

    Lim, C C Tchoyoson; Yang, Guo Liang; Nowinski, Wieslaw L; Hui, Francis

    2003-12-01

    A picture archive and communications system (PACS) is a rich source of images and data suitable for creating electronic teaching files (ETF). However, the potential for PACS to support nonclinical applications has not been fully realized: at present there is no mechanism for PACS to identify and store teaching files; neither is there a standardized method for sharing such teaching images. The Medical Image Resource Center (MIRC) is a new central image repository that defines standards for data exchange among different centers. We developed an ETF server that retrieves digital imaging and communication in medicine (DICOM) images from PACS, and enables users to create teaching files that conform to the new MIRC schema. We test-populated our ETF server with illustrative images from the clinical case load of the National Neuroscience Institute, Singapore. Together, PACS and MIRC have the potential to benefit radiology teaching and research.

  9. Electronic Human Resource Management (e-HRM of Hotel Business in Phuket

    Directory of Open Access Journals (Sweden)

    Kitimaporn Choochote

    2015-04-01

    Full Text Available This research aims to study the pattern of the electronic human resources management (e-HRM of the hotel business in Phuket. The study is conducted with the implementation of field data and in-depth interview of hotels’ HR managers. In consequence, the study reveals that the hotel business has applied the use of the e-HRM varying in job recruitment (15 percent, employee engagement (55 percent, organizational file structure (10 percent, idea and creativity exchanges (38 percent and assessment system (6 percent. However, considered as 100 percent, the hotel business has not prepared to apply the use of the e-HRM in salary system, learning and training program, welfare allocation and career development.

  10. Evidence for weakly bound electrons in non-irradiated alkane crystals: The electrons as a probe of structural differences in crystals

    Energy Technology Data Exchange (ETDEWEB)

    Pietrow, M., E-mail: mrk@kft.umcs.lublin.pl; Misiak, L. E. [Institute of Physics, M. Curie-Skłodowska University, ul. Pl. M. Curie-Skłodowskiej 1, 20-031 Lublin (Poland); Gagoś, M. [Department of Cell Biology, Institute of Biology and Biochemistry, Maria Curie-Skłodowska University, ul. Akademicka 19, 20-033 Lublin (Poland); Kornarzyński, K. [Department of Physics, University of Life Sciences in Lublin, Akademicka 13, 20-950 Lublin (Poland); Szurkowski, J.; Grzegorczyk, M. [Institute of Experimental Physics, University of Gdańsk, Wita Stwosza 57, 80-952 Gdańsk (Poland); Rochowski, P. [Institute of Experimental Physics, University of Gdańsk, Wita Stwosza 57, 80-952 Gdańsk (Poland); Pomeranian University in Słupsk, Arciszewskiego 22b, 76-200 Słupsk (Poland)

    2015-02-14

    It is generally assumed that weakly bound (trapped) electrons in organic solids come only from radiolytical (or photochemical) processes like ionization caused by an excited positron entering the sample. This paper presents evidence for the presence of these electrons in non-irradiated samples of docosane. This can be due to the triboelectrification process. We argue that these electrons can be located (trapped) either in interlamellar gaps or in spaces made by non-planar conformers. Electrons from the former ones are bound more weakly than electrons from the latter ones. The origin of Vis absorption for the samples is explained. These spectra can be used as a probe indicating differences in the solid structures of hydrocarbons.

  11. Using mobile electronic devices to deliver educational resources in developing countries.

    Science.gov (United States)

    Mazal, Jonathan Robert; Ludwig, Rebecca

    2015-01-01

    Developing countries have far fewer trained radiography professionals than developed countries, which exacerbates the limited access to imaging services. The lack of trained radiographers reflects, in part, limited availability of radiographer-specific educational resources. Historically, organizations that provided such resources in the developing world faced challenges related to the limited stock of current materials as well as expenses associated with shipping and delivery. Four mobile electronic devices (MEDs) were loaded with educational content (e-books, PDFs, and digital applications) spanning major radiography topics. The MEDs were distributed to 4 imaging departments in Ghana, India, Nepal, and Nigeria based on evidence of need for radiography-specific resources, as revealed by survey responses. A cost comparison of postal delivery vs digital delivery of educational content was performed. The effectiveness of delivering additional content via Wi-Fi transmission also was evaluated. Feedback was solicited on users' experience with the MEDs as a delivery tool for educational content. An initial average per e-book expense of $30.05, which included the cost of the device, was calculated for the MED delivery method compared with $15.56 for postal delivery of printed materials. The cost of the MED delivery method was reduced to an average of $10.05 for subsequent e-book deliveries. Additional content was successfully delivered via Wi-Fi transmission to all recipients during the 3-month follow-up period. Overall user feedback on the experience was positive, and ideas for enhancing the MED-based method were identified. Using MEDs to deliver radiography-specific educational content appears to be more cost effective than postal delivery of printed materials on a long-term basis. MEDs are more efficient for providing updates to educational materials. Customization of content to department needs, and using projector devices could enhance the usefulness of MEDs for

  12. Two-dimensional crystallization and preliminary electron crystallographic result of partially purified Fo from porcine mitochondria

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    After removal of cytoplasmic sector F1 from submitochondrial particles of FoF1-ATP synthase complex with guanidine hydrochloride, the transmembrane sector Fo was specifically extracted from the stripped membranes in the presence of detergent CHAPS and partially purified.Two-dimensional crystals were produced by the reconstitution of the partially purified Fo into asolectin and microdialysis. The obtained crystals are able to diffract to 2 nm. The projection map of the negatively stained crystal shows that the crystal has p4212 symmetry, lattice constant, a = b = 14.4nm. A unit cell contains four Fo molecules.

  13. Plastics disassembly versus bulk recycling: engineering design for end-of-life electronics resource recovery.

    Science.gov (United States)

    Rios, Pedro; Stuart, Julie Ann; Grant, Ed

    2003-12-01

    Annual plastic flows through the business and consumer electronics manufacturing supply chain include nearly 3 billion lb of high-value engineering plastics derived from petroleum. The recovery of resource value from this stream presents critical challenges in areas of materials identification and recycling process design that demand new green engineering technologies applied together with life cycle assessment and ecological supply chain analysis to create viable plastics-to-plastics supply cycles. The sustainable recovery of potentially high-value engineering plastics streams requires that recyclers either avoid mixing plastic parts or purify later by separating smaller plastic pieces created in volume reduction (shredding) steps. Identification and separation constitute significant barriers in the plastics-to-plastics recycling value proposition. In the present work, we develop a model that accepts randomly arriving electronic products to study scenarios by which a recycler might identify and separate high-value engineering plastics as well as metals. Using discrete eventsimulation,we compare current mixed plastics recovery with spectrochemical plastic resin identification and subsequent sorting. Our results show that limited disassembly with whole-part identification can produce substantial yields in separated streams of recovered engineering thermoplastics. We find that disassembly with identification does not constitute a bottleneck, but rather, with relatively few workers, can be configured to pull the process and thus decrease maximum staging space requirements.

  14. Collecting, shipping, storing, and imaging snow crystals and ice grains with low-temperature scanning electron microscopy

    Science.gov (United States)

    Erbe, E.F.; Rango, A.; Foster, J.; Josberger, E.G.; Pooley, C.; Wergin, W.P.

    2003-01-01

    Methods to collect, transport, and store samples of snow and ice have been developed that enable detailed observations of these samples with a technique known as low-temperature scanning electron microscopy (LTSEM). This technique increases the resolution and ease with which samples of snow and ice can be observed, studied, and photographed. Samples are easily collected in the field and have been shipped to the electron microscopy laboratory by common air carrier from distances as far as 5,000 miles. Delicate specimens of snow crystals and ice grains survive the shipment procedures and have been stored for as long as 3 years without undergoing any structural changes. The samples are not subjected to the melting or sublimation artifacts. LTSEM allows individual crystals to be observed for several hours with no detectable changes. Furthermore, the instrument permits recording of photographs containing the parallax information necessary for three-dimensional imaging of the true shapes of snowflakes, snow crystals, snow clusters, ice grains, and interspersed air spaces. This study presents detailed descriptions of the procedures that have been used successfully in the field and the laboratory to collect, ship, store, and image snow crystals and ice grains. Published 2003 Wiley-Liss, Inc.

  15. Crystal Field and First Principle Calculation of Optical and Electronic Properties of ZnCr2O4 Spinel

    Science.gov (United States)

    Avram, N. M.; Brik, M. G.; Avram, C. N.; Gruia, A. S.

    2011-10-01

    In the present work we report on combined methods for calculation of optical energy levels scheme and electronic properties of antiferromagnetic spinel ZnCr2O4. The exchange charge model (ECM) was used to calculate the crystal field parameters (CFP) with taking into account the effects of the covalent bond formation between the Cr3+ and O2- ions. The calculated CFP values were used for diagonalization of the Cr3+ Hamiltonian in a complete basis set spanned by all wave functions of the LS terms of 3d3 electron configuration. Ab initio calculations (with the CRYSTAL09 computer program) of the density of states allowed evaluating contribution of each ion into the calculated bands. In addition, the spin-polarized calculations allowed for finding difference between densities of the spin-up and spin-down states of 6-fold coordinated Cr3+ ion. The obtained results are discussed and compared with experimental data.

  16. SAGES: a suite of freely-available software tools for electronic disease surveillance in resource-limited settings.

    Directory of Open Access Journals (Sweden)

    Sheri L Lewis

    Full Text Available Public health surveillance is undergoing a revolution driven by advances in the field of information technology. Many countries have experienced vast improvements in the collection, ingestion, analysis, visualization, and dissemination of public health data. Resource-limited countries have lagged behind due to challenges in information technology infrastructure, public health resources, and the costs of proprietary software. The Suite for Automated Global Electronic bioSurveillance (SAGES is a collection of modular, flexible, freely-available software tools for electronic disease surveillance in resource-limited settings. One or more SAGES tools may be used in concert with existing surveillance applications or the SAGES tools may be used en masse for an end-to-end biosurveillance capability. This flexibility allows for the development of an inexpensive, customized, and sustainable disease surveillance system. The ability to rapidly assess anomalous disease activity may lead to more efficient use of limited resources and better compliance with World Health Organization International Health Regulations.

  17. Impact of exact exchange in the description of the electronic structure of organic charge-transfer molecular crystals

    KAUST Repository

    Fonari, Alexandr

    2014-10-21

    We evaluate the impact that the amount of nonlocal Hartree-Fock (%HF) exchange included in a hybrid density functional has on the microscopic parameters (transfer integrals, band gaps, bandwidths, and effective masses) describing charge transport in high-mobility organic crystals. We consider both crystals based on a single molecule, such as pentacene, and crystals based on mixed-stack charge-transfer systems, such as dibenzo-TTF–TCNQ. In the pentacene crystal, the band gap decreases and the effective masses increase linearly with an increase in the amount of %HF exchange. In contrast, in the charge-transfer crystals, while the band gap increases linearly, the effective masses vary only slightly with an increase in %HF exchange. We show that the superexchange nature of the electronic couplings in charge-transfer systems is responsible for this peculiar evolution of the effective masses. We compare the density functional theory results with results obtained within the G0W0 approximation as a way of benchmarking the optimal amount of %HF exchange needed in a given functional.

  18. Radiation from 170 GeV electrons and positrons traversing thin Si and Ge crystals near the <110> axis

    Energy Technology Data Exchange (ETDEWEB)

    Bak, J.F.; Moeller, S.P.; Petersen, J.B.B.; Soerensen, A.H.; Uggerhoej, E.; Barberis, D.; Elsener, K.; Brodbeck, T.J.; Newton, D.; Wilson, G.W.

    1988-10-20

    The first results from a broad angular beam experiment on emission of high-energy photons from 170 GeV electrons and positrons are presented. The targets were 0.5 mm thick Si and Ge crystals. A dramatic enhancement in the emitted radiation is found for angles of incidence close to the <110> axis. The experimental results are compared to a constant-field cascade calculation.

  19. Surface structure determinations of crystalline ionic thin films grown on transition metal single crystal surfaces by low energy electron diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Roberts, Joel Glenn [Univ. of California, Berkeley, CA (United States)

    2000-05-01

    The surface structures of NaCl(100), LiF(100) and alpha-MgCl2(0001) adsorbed on various metal single crystals have been determined by low energy electron diffraction (LEED). Thin films of these salts were grown on metal substrates by exposing the heated metal surface to a molecular flux of salt emitted from a Knudsen cell. This method of investigating thin films of insulators (ionic salts) on a conducting substrate (metal) circumvents surface charging problems that plagued bulk studies, thereby allowing the use of electron-based techniques to characterize the surface.

  20. Electron gas polarization effect induced by heavy H-like ions of moderate velocities channeled in a silicon crystal

    CERN Document Server

    Dauvergne, D; Bosch, F; Bräuning, H; Chevallier, M; Cohen, C; Gumberidze, A; Hagmann, S; L'Hoir, A; Kirsch, R; Kozhuharov, C; Liesen, D; Mokler, P H; Poizat, J C; Ray, C; Rozet, J P; Stöhlker, T; Toleikis, S; Toulemonde, M; Verma, P; St\\"{o}hlker, Th.

    2006-01-01

    We report on the observation of a strong perturbation of the electron gas induced by 20 MeV/u U$^{91+}$ ions and 13 MeV/u Pb$^{81+}$ ions channeled in silicon crystals. This collective response (wake effect) in-duces a shift of the continuum energy level by more than 100 eV, which is observed by means of Radiative Electron Capture into the K and L-shells of the projectiles. We also observe an increase of the REC probability by 20-50% relative to the probability in a non-perturbed electron gas. The energy shift is in agreement with calculations using the linear response theory, whereas the local electron density enhancement is much smaller than predicted by the same model. This shows that, for the small values of the adiabaticity parameter achieved in our experiments, the density fluctuations are not strongly localized at the vicinity of the heavy ions.

  1. Electron gas polarization effect induced by heavy H-like ions of moderate velocities channeled in a silicon crystal

    Energy Technology Data Exchange (ETDEWEB)

    Testa, E. [Institut de Physique Nucleaire de Lyon, CNRS-IN2P3, Universite Claude Bernard Lyon 1, F-69622 Villeurbanne (France); Dauvergne, D. [Institut de Physique Nucleaire de Lyon, CNRS-IN2P3, Universite Claude Bernard Lyon 1, F-69622 Villeurbanne (France)]. E-mail: d.dauvergne@ipnl.in2p3.fr; Braeuning-Demian, A. [Gesellschaft fuer Schwerionen Forschung (GSI), D-64291 Darmstadt (Germany); Bosch, F. [Gesellschaft fuer Schwerionen Forschung (GSI), D-64291 Darmstadt (Germany); Braeuning, H. [Institut fuer Kernphysik, Justus Liebig Universitaet, D-35392 Giessen (Germany); Chevallier, M. [Institut de Physique Nucleaire de Lyon, CNRS-IN2P3, Universite Claude Bernard Lyon 1, F-69622 Villeurbanne (France); Cohen, C. [Institut des Nano-Sciences de Paris, CNRS-UMR75-88, Universites Paris VI et Paris VII, 75251 Paris cedex 05 (France); Gumberidze, A. [Gesellschaft fuer Schwerionen Forschung (GSI), D-64291 Darmstadt (Germany); Hagmann, S. [Gesellschaft fuer Schwerionen Forschung (GSI), D-64291 Darmstadt (Germany); L' Hoir, A. [Institut des Nano-Sciences de Paris, CNRS-UMR75-88, Universites Paris VI et Paris VII, 75251 Paris cedex 05 (France); Kirsch, R. [Institut de Physique Nucleaire de Lyon, CNRS-IN2P3, Universite Claude Bernard Lyon 1, F-69622 Villeurbanne (France); Kozhuharov, C.; Liesen, D.; Mokler, P.H. [Gesellschaft fuer Schwerionen Forschung (GSI), D-64291 Darmstadt (Germany); Poizat, J.-C.; Ray, C. [Institut de Physique Nucleaire de Lyon, CNRS-IN2P3, Universite Claude Bernard Lyon 1, F-69622 Villeurbanne (France); Rozet, J.-P. [Institut des Nano-Sciences de Paris, CNRS-UMR75-88, Universites Paris VI et Paris VII, 75251 Paris cedex 05 (France); Stoehlker, Th.; Toleikis, S. [Gesellschaft fuer Schwerionen Forschung (GSI), D-64291 Darmstadt (Germany); Toulemonde, M. [Centre Interdisciplinaire de Recherche Ions-Lasers, UMR 11, CEA-CNRS, 14040 Caen cedex (France); Verma, P. [Gesellschaft fuer Schwerionen Forschung (GSI), D-64291 Darmstadt (Germany)

    2006-04-15

    We report on the observation of a strong perturbation of the electron gas induced by 20 MeV/u U{sup 91+} ions and 13 MeV/u Pb{sup 81+} ions channeled in silicon crystals. This collective response (wake effect) induces a shift of the continuum energy level by more than 100 eV, which is observed by means of radiative electron capture into the K- and L-shells of the projectiles. We also observe an increase of the REC probability by 20-50% relative to the probability in a non-perturbed electron gas. The energy shift is in agreement with calculations using the linear response theory, whereas the local electron density enhancement is much smaller than predicted by the same model. This shows that, for the small values of the adiabaticity parameter achieved in our experiments, the density fluctuations are not strongly localized in the vicinity of the heavy ions.

  2. Transport in an Electron Interferometer and an Artificial One-Dimensional Crystal

    NARCIS (Netherlands)

    Wees, B.J. van; Kouwenhoven, L.P.; Kraayeveld, J.R.; Hekking, F.W.J.; Harmans, C.J.P.M.; Williamson, J.G.

    1990-01-01

    We have studied the electron transport in a one-dimensional electron interferometer. It consists of a quantum dot, defined in a two-dimensional electron gas, to which quantum point contacts are attached. Discrete electronic states are formed due to the constructive interference of electron waves whi

  3. Magnetic properties and electronic structure of neptunyl(VI) complexes: wavefunctions, orbitals, and crystal-field models

    Energy Technology Data Exchange (ETDEWEB)

    Gendron, Frederic; Pritchard, Ben; Autschbach, Jochen [Department of Chemistry, University at Buffalo, State University of New York, Buffalo, NY (United States); Paez-Hernandez, Dayan; Bolvin, Helene [Laboratoire de Physique et de Chimie Quantiques, Universite Toulouse 3 (France); Notter, Francois-Paul [Laboratoire de Chimie Quantique, Universite de Strasbourg (France)

    2014-06-23

    The electronic structure and magnetic properties of neptunyl(VI), NpO{sub 2}{sup 2+}, and two neptunyl complexes, [NpO{sub 2}(NO{sub 3}){sub 3}]{sup -} and [NpO{sub 2}Cl{sub 4}]{sup 2-}, were studied with a combination of theoretical methods: ab initio relativistic wavefunction methods and density functional theory (DFT), as well as crystal-field (CF) models with parameters extracted from the ab initio calculations. Natural orbitals for electron density and spin magnetization from wavefunctions including spin-orbit coupling were employed to analyze the connection between the electronic structure and magnetic properties, and to link the results from CF models to the ab initio data. Free complex ions and systems embedded in a crystal environment were studied. Of prime interest were the electron paramagnetic resonance g-factors and their relation to the complex geometry, ligand coordination, and nature of the nonbonding 5f orbitals. The g-factors were calculated for the ground and excited states. For [NpO{sub 2}Cl{sub 4}]{sup 2-}, a strong influence of the environment of the complex on its magnetic behavior was demonstrated. Kohn-Sham DFT with standard functionals can produce reasonable g-factors as long as the calculation converges to a solution resembling the electronic state of interest. However, this is not always straightforward. (copyright 2014 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  4. Radiative instability of a relativistic electron beam moving in a photonic crystal

    CERN Document Server

    Baryshevsky, V G

    2010-01-01

    The radiative instability of a beam moving in a photonic crystal of finite dimensions is studied. The dispersion equation is obtained. The law $\\Gamma\\sim \\rho ^{1/\\left( {s + 3} \\right)}$ is shown to be valid and caused by the mixing of the electromagnetic field modes in the finite volume due to the periodic disturbance from the photonic crystal.

  5. Radiative instability of a relativistic electron beam moving in a photonic crystal

    OpenAIRE

    Baryshevsky, V.G.; Gurinovich, A. A.

    2013-01-01

    The radiative instability of a beam moving in a photonic crystal of finite dimensions is studied. The dispersion equation is obtained. The law $\\Gamma\\sim \\rho ^{1/\\left( {s + 3} \\right)}$ is shown to be valid and caused by the mixing of the electromagnetic field modes in the finite volume due to the periodic disturbance from the photonic crystal.

  6. Spin dynamics, electronic, and thermal transport properties of two-dimensional CrPS{sub 4} single crystal

    Energy Technology Data Exchange (ETDEWEB)

    Pei, Q. L.; Luo, X., E-mail: xluo@issp.ac.cn, E-mail: ypsun@issp.ac.cn; Lin, G. T.; Song, J. Y.; Hu, L.; Song, W. H.; Lu, W. J. [Key Laboratory of Materials Physics, Institute of Solid State Physics, Chinese Academy of Sciences, Hefei 230031 (China); Zou, Y. M.; Yu, L.; Tong, W. [High Magnetic Field Laboratory, Chinese Academy of Sciences, Hefei 230031 (China); Sun, Y. P., E-mail: xluo@issp.ac.cn, E-mail: ypsun@issp.ac.cn [High Magnetic Field Laboratory, Chinese Academy of Sciences, Hefei 230031 (China); Key Laboratory of Materials Physics, Institute of Solid State Physics, Chinese Academy of Sciences, Hefei 230031 (China); Collaborative Innovation Center of Advanced Microstructures, Nanjing University, Nanjing 210093 (China)

    2016-01-28

    2-Dimensional (2D) CrPS{sub 4} single crystals have been grown by the chemical vapor transport method. The crystallographic, magnetic, electronic, and thermal transport properties of the single crystals were investigated by the room-temperature X-ray diffraction, electrical resistivity ρ(T), specific heat C{sub P}(T), and the electronic spin response (ESR) measurements. CrPS{sub 4} crystals crystallize into a monoclinic structure. The electrical resistivity ρ(T) shows a semiconducting behavior with an energy gap E{sub a} = 0.166 eV. The antiferromagnetic transition temperature is about T{sub N} = 36 K. The spin flipping induced by the applied magnetic field is observed along the c axis. The magnetic phase diagram of CrPS{sub 4} single crystal has been discussed. The extracted magnetic entropy at T{sub N} is about 10.8 J/mol K, which is consistent with the theoretical value R ln(2S + 1) for S = 3/2 of the Cr{sup 3+} ion. Based on the mean-field theory, the magnetic exchange constants J{sub 1} and J{sub c} corresponding to the interactions of the intralayer and between layers are about 0.143 meV and −0.955 meV are obtained based on the fitting of the susceptibility above T{sub N}, which agree with the results obtained from the ESR measurements. With the help of the strain for tuning the magnetic properties, monolayer CrPS{sub 4} may be a promising candidate to explore 2D magnetic semiconductors.

  7. Crystal and electronic characterization of Nd{sub x}Ti{sub 1−x}BO{sub 2+d} semiconductors

    Energy Technology Data Exchange (ETDEWEB)

    Ozkendir, Osman Murat, E-mail: ozkendir@gmail.com

    2016-02-15

    Highlights: • Crystal and electronic structure properties of Nd{sub x}Ti{sub 1−x}BO{sub 2+d} structure were investigated. • New crystal structures for Nd–Ti complexes are determined. • Distortions in the crystal structure were observed as a result of Boron shortage. • Prominent change in electronic properties of the samples with the increasing Nd amount. - Abstract: Neodymium substituted TiBO{sub 3} samples were investigated according to their crystal, electric and electronic properties. Studies were conducted by X-ray absorption fine structure spectroscopy (XAFS) technique for the samples with different substitutions in the preparation processes. To achieve better crystal structure results during the study, XRD pattern results were supported by extended-XAFS (EXAFS) analysis. The electronic structure analysis were studied by X-ray absorption near-edge structure spectroscopy (XANES) measurements at the room temperatures. Due to the substituted Nd atoms, prominent changes in crystal structure, new crystal geometries for Nd-Ti complexes, phase transitions in the crystals structure were detected according to the increasing Nd substitutions in the samples. In the entire stages of the substitutions, Nd atoms were observed as governing the whole phenomena due to their dominant characteristics in Ti geometries. Besides, electrical resistivity decay was determined in the materials with the increasing amount of Nd substitution.

  8. Impact of Electronic Resources and Usage in Academic Libraries in Ghana: Evidence from Koforidua Polytechnic & All Nations University College, Ghana

    Science.gov (United States)

    Akussah, Maxwell; Asante, Edward; Adu-Sarkodee, Rosemary

    2015-01-01

    The study investigates the relationship between impact of electronic resources and its usage in academic libraries in Ghana: evidence from Koforidua Polytechnic & All Nations University College, Ghana. The study was a quantitative approach using questionnaire to gather data and information. A valid response rate of 58.5% was assumed. SPSS…

  9. Utilization of Electronic Information Resources by Undergraduate Students of University of Ibadan: A Case Study of Social Sciences and Education

    Science.gov (United States)

    Owolabi, Sola; Idowu, Oluwafemi A.; Okocha, Foluke; Ogundare, Atinuke Omotayo

    2016-01-01

    The study evaluated utilization of electronic information resources by undergraduates in the Faculties of Education and the Social Sciences in University of Ibadan. The study adopted a descriptive survey design with a study population of 1872 undergraduates in the Faculties of Education and the Social Sciences in University of Ibadan, from which a…

  10. Fabrication of size-controllable hexagonal non-close-packed colloidal crystals and binary colloidal crystals by pyrolysis combined with plasma-electron co-irradiation of polystyrene colloidal monolaye

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Jae Joon

    2011-02-15

    We present an unprecedented and systematic route to controllably fabricate hexagonal non-close-packed (HNCP) monolayer colloidal crystals and binary colloidal crystals (BCCs) based on plasma-electron co-irradiation of polystyrene colloidal monolayers followed by thermal decomposition. HNCP colloidal crystals with tunable particle sizes and periods could be fabricated by changing the pristine colloidal particle size and the thermal decomposition time. In addition, BCCs and trimodal colloidal crystals that are composed of different-sized colloidal particles can also be fabricated by adding small particles on the prepared HNCP colloidal crystals. Both the particle size ratio and the volume fraction of the BCCs can be widely tuned. These HNCP colloidal crystals and BCCs have various potential applications as optical and photonic materials as well as in catalysis and sensors.

  11. Zero-Phonon Transition and Spectral Hole Burning of Colour Centres in Doped Lithium Fluoride Crystals Bombarded by Electrons

    Institute of Scientific and Technical Information of China (English)

    顾洪恩; 王克起; 刘洪海

    2001-01-01

    Two zero-phonon lines with wide linewidth on R1- and unknown colour centres have been observed in the magnesium-doped lithium fluoride crystals coloured by electron beam bombardment at 200 K in the measured temperature range of 10-77 K. The R1- zero-phonon line can be nearly completely bleached using the normal spectrophotometer light at 10K. An obvious spectral burning hole in the absorption profile of the R1- zero-phonon line of colour centres in the coloured lithium fluoride crystals has been obtained by using the spectrophotometer light adjusted to narrower bandwidth at 10K. The optical bleaching of the zero-phonon line can be partially recovered by annealing the crystals to room temperature for a short time period or irradiating the crystals with ultraviolet light above 40 K, and nearly complete restoration can be obtained after the ultraviolet light irradiation and storage in the dark for a long time at room temperature.

  12. Spatially Resolved Spectra from a new X-ray Imaging Crystal Spectrometer for Measurements of Ion and Electron Temperature Profiles

    Energy Technology Data Exchange (ETDEWEB)

    Bitter, M; Stratton, B; Roquemore, A; Mastrovito, D; Lee, S; Bak, J; Moon, M; Nam, U; Smith, G; Rice, J; Beiersdorfer, P; Fraenkel, B

    2004-08-10

    A new type of high-resolution X-ray imaging crystal spectrometer is being developed to measure ion and electron temperature profiles in tokamak plasmas. The instrument is particularly valuable for diagnosing plasmas with purely Ohmic heating and rf heating, since it does not require the injection of a neutral beam - although it can also be used for the diagnosis of neutral-beam heated plasmas. The spectrometer consists of a spherically bent quartz crystal and a two-dimensional position-sensitive detector. It records spectra of helium-like argon (or krypton) from multiple sightlines through the plasma and projects a de-magnified image of a large plasma cross-section onto the detector. The spatial resolution in the plasma is solely determined by the height of the crystal, its radius of curvature, and the Bragg angle. This new X-ray imaging crystal spectrometer may also be of interest for the diagnosis of ion temperature profiles in future large tokamaks, such as KSTAR and ITER, where the application of the presently used charge-exchange spectroscopy will be difficult, if the neutral beams do not penetrate to the plasma center. The paper presents the results from proof-of-principle experiments performed with a prototype instrument at Alcator C-Mod.

  13. Quasi 2D electronic states with high spin-polarization in centrosymmetric MoS2 bulk crystals

    Science.gov (United States)

    Gehlmann, Mathias; Aguilera, Irene; Bihlmayer, Gustav; Młyńczak, Ewa; Eschbach, Markus; Döring, Sven; Gospodarič, Pika; Cramm, Stefan; Kardynał, Beata; Plucinski, Lukasz; Blügel, Stefan; Schneider, Claus M.

    2016-06-01

    Time reversal dictates that nonmagnetic, centrosymmetric crystals cannot be spin-polarized as a whole. However, it has been recently shown that the electronic structure in these crystals can in fact show regions of high spin-polarization, as long as it is probed locally in real and in reciprocal space. In this article we present the first observation of this type of compensated polarization in MoS2 bulk crystals. Using spin- and angle-resolved photoemission spectroscopy (ARPES), we directly observed a spin-polarization of more than 65% for distinct valleys in the electronic band structure. By additionally evaluating the probing depth of our method, we find that these valence band states at the point in the Brillouin zone are close to fully polarized for the individual atomic trilayers of MoS2, which is confirmed by our density functional theory calculations. Furthermore, we show that this spin-layer locking leads to the observation of highly spin-polarized bands in ARPES since these states are almost completely confined within two dimensions. Our findings prove that these highly desired properties of MoS2 can be accessed without thinning it down to the monolayer limit.

  14. Creation of trapped electrons and holes in alkaline-earth fluoride crystals doped by rare-earth ions

    Science.gov (United States)

    Radzhabov, E.

    2002-06-01

    Defects in Ce 3+- and Eu 2+-doped alkaline-earth fluorides, created by vacuum ultraviolet (VUV) photons with energy lower than that of the band gap, were investigated by various methods: thermostimulated luminescence, photostimulated luminescence and optical absorption. The CaF 2:Eu 2+ thermoluminescence curves in the range of 60-330 K due to various types of trapped holes were the same after VUV illumination as after X-ray irradiation. Thermoluminescence curves of Ce 3+-doped alkaline-earth fluorides created by VUV illumination or X-ray irradiation were generally similar. However, Vk thermoluminescence peaks were absent in VUV-illuminated CaF 2:Ce 3+ and SrF 2:Ce 3+ crystals. Creation of Ce 2+ characteristic bands was observed in photostimulated luminescence spectra as well as in optical absorption spectra of vacuum ultraviolet-illuminated or X-ray-irradiated Ce 3+-doped crystals. The proposed mechanism of creation of trapped hole and trapped electron defects by vacuum ultraviolet illumination involves charge transfer-type transitions, in which the electron transfers from valence band to an impurity level, lying in the band gap. Comparison of all involved energies of transitions in the crystals investigated shows that the sum of all transition energies is less than that of the band gap by 1-3 eV. This energy difference can be considered as the energy of lattice relaxation around created Ce 2+ or Eu + ions.

  15. Raman electron spin-lattice relaxation with the Debye-type and with real phonon spectra in crystals.

    Science.gov (United States)

    Hoffmann, Stanislaw K; Lijewski, Stefan

    2013-02-01

    Electron spin-lattice relaxation temperature dependence was measured for Ti(2+) (S=1) and for Cu(2+) (S=1/2) ions in SrF(2) single crystal by electron spin echo method in temperature range 4-109K. The spin relaxation was governed by the two-phonon Raman processes. The relaxation theory is outlined and presented in a form suitable for applying with real phonon spectra. The experimental relaxation results were described using Debye-type phonon spectrum and the real phonon spectrum of SrF(2) crystal. The Debye approximation does not fit well the results for SrF(2) both at low and at high temperature. The relaxation rate is faster than that predicted by Debye-type phonon spectrum at low temperatures where excess of lattice vibrations over the Debye model exists but is slower at higher temperatures (above 50K) where density of phonon states continuously decreases when approaching to the maximal acoustic phonon frequency. The expected deviation from Debye approximation was analyzed also for Cu(2+) in NaCl and MgSiO(3) crystals for which phonon spectra are available. The fitting with the real phonon spectrum allowed us to calculate spin-phonon coupling parameter as 267 cm(-1) for Ti(2+) and 1285 cm(-1) for Cu(2+) in SrF(2).

  16. Quasi 2D electronic states with high spin-polarization in centrosymmetric MoS2 bulk crystals.

    Science.gov (United States)

    Gehlmann, Mathias; Aguilera, Irene; Bihlmayer, Gustav; Młyńczak, Ewa; Eschbach, Markus; Döring, Sven; Gospodarič, Pika; Cramm, Stefan; Kardynał, Beata; Plucinski, Lukasz; Blügel, Stefan; Schneider, Claus M

    2016-06-01

    Time reversal dictates that nonmagnetic, centrosymmetric crystals cannot be spin-polarized as a whole. However, it has been recently shown that the electronic structure in these crystals can in fact show regions of high spin-polarization, as long as it is probed locally in real and in reciprocal space. In this article we present the first observation of this type of compensated polarization in MoS2 bulk crystals. Using spin- and angle-resolved photoemission spectroscopy (ARPES), we directly observed a spin-polarization of more than 65% for distinct valleys in the electronic band structure. By additionally evaluating the probing depth of our method, we find that these valence band states at the point in the Brillouin zone are close to fully polarized for the individual atomic trilayers of MoS2, which is confirmed by our density functional theory calculations. Furthermore, we show that this spin-layer locking leads to the observation of highly spin-polarized bands in ARPES since these states are almost completely confined within two dimensions. Our findings prove that these highly desired properties of MoS2 can be accessed without thinning it down to the monolayer limit.

  17. Electron transport of photoconductive n-type liquid crystals based on a redox-active tetraazanaphthacene framework.

    Science.gov (United States)

    Isoda, Kyosuke; Abe, Tomonori; Funahashi, Masahiro; Tadokoro, Makoto

    2014-06-10

    The preparation of two liquid crystals composed of a redox-active tetraazanaphthacene (TANC) framework is reported. The materials form smectic A (SmA) thin-film liquid-crystalline (LC) phases over a wide temperature range. Cyclic voltammetry analysis revealed that LC TANCs behave as organic electron acceptors. The electron mobilities of the thin films were determined by time- of-flight (TOF) measurements, which are the order of 10(-4)  cm(2)  V(-1)  s(-1) in the SmA LC phase. This value is two orders of magnitude larger than those of amorphous organic semiconductors. To the best of our knowledge, very few reports exist on the electron-transporting behaviors of LC N-heteroacene semiconductors.

  18. Electronic and crystal structure of the high entropy TiZrHfCoNiCu intermetallics undergoing martensitic transformation

    Directory of Open Access Journals (Sweden)

    Firstov Georgiy

    2015-01-01

    Full Text Available It was shown very recently that despite high thermal stability some high entropy alloys, namely, intermetallic compounds of TiZrHfCoNiCu family, undergo martensitic transformation and exhibit shape memory effect [1]. It was also found that X-ray diffraction patterns taken from those compounds resemble qualitatively ones of B2 ordering type for austenitic state and B19` - for martensite. It is going to be shown [2] that the ordered structure of austenite phase is not B2 but is a result of group-subgroup transition down to triclinic P1 space group. Present paper reports onto the results of electron structure modelling combined with crystal structure analysis with the help of experimental data Rietveld refinement performed for TiZrHfCoNiCu intermetallics. Crystal structures of austenite and martensite phases for these high entropy intermetallics will be discussed.

  19. First-principles theoretical investigation of the electronic couplings in single crystals of phenanthroline-based organic semiconductors.

    Science.gov (United States)

    Li, Hong; Brédas, Jean-Luc; Lennartz, Christian

    2007-04-28

    The electronic couplings between adjacent molecules in the phenanthroline-based bathocuproine (BCP) and bathophenanthroline (Bphen) crystals have been studied using density functional theory on model dimers. Within the frame of the "two-state model" of charge-transfer theory, a generalized definition of the "effective transfer integral" is proposed. This definition addresses the issue arising when the lowest unoccupied molecular orbital (LUMO) [highest occupied molecular orbital (HOMO)] and LUMO+1 (HOMO-1) of the single molecules both have significant contributions to the dimer LUMO (HOMO) level. Charge-transfer integrals based on the new definition are compared with those from previous models; significant differences are found. The authors' results indicate that, within a simple Marcus theory approach, the charge-transport parameters of the BCP and Bphen crystals are expected to be similar.

  20. Shear-band propagation in fully amorphous and partially crystallized Mg-based alloys studied by nanoindentation and transmission electron microscopy

    Energy Technology Data Exchange (ETDEWEB)

    Castellero, A. [Department of Materials Science and Metallurgy, University of Cambridge, Pembroke Street, Cambridge CB2 3QZ (United Kingdom) and Laboratory of Metal Physics and Technology, Department of Materials, ETH Zuerich, Wolfgang-Pauli-Strasse 10, CH-8093 Zurich (Switzerland)]. E-mail: alberto.castellero@unito.it; Lloyd, S.J. [Department of Materials Science and Metallurgy, University of Cambridge, Pembroke Street, Cambridge CB2 3QZ (United Kingdom); Madge, S.V. [Department of Materials Science and Metallurgy, University of Cambridge, Pembroke Street, Cambridge CB2 3QZ (United Kingdom); International Advanced Research Centre for Powder Metallurgy and New Materials (ARCI), PO Balapur, Hyderabad 500 005 (India); Kovacs, Zs. [Department of General Physics, Eoetvoes Lorand University, Pazmany P. setany 1/a, 1117 Budapest (Hungary); Loeffler, J.F. [Laboratory of Metal Physics and Technology, Department of Materials, ETH Zuerich, Wolfgang-Pauli-Strasse 10, CH-8093 Zurich (Switzerland); Baricco, M. [Dipartimento di Chimica I.F.M. and N.I.S., Universita degli Studi di Torino, Via P. Giuria 9, I-10125 Turin (Italy); Greer, A.L. [Department of Materials Science and Metallurgy, University of Cambridge, Pembroke Street, Cambridge CB2 3QZ (United Kingdom)

    2007-05-31

    Fully amorphous and partially crystallized Mg{sub 66}Ni{sub 20}Nd{sub 14} and partially crystallized Mg{sub 60}Cu{sub 30}Y{sub 10} alloys were indented and, subsequently, thinned along the cross-section of the indent by means of a focused ion beam (FIB) for transmission electron microscopy (TEM) observation. Depending on the crystallized fraction and the crystal size, the volume deformed under the indenter tip shows different features that can be associated with the different ability of the shear bands to propagate in the two partially devitrified metallic glasses.

  1. Wigner crystallization of electrons in deep traps in a two-dimensional dielectric

    Energy Technology Data Exchange (ETDEWEB)

    Shaimeev, S. S., E-mail: shaimeev@isp.nsc.ru; Gritsenko, V. A. [Institute of Semiconductor Physics (Russian Federation)

    2011-03-15

    A two-dimensional model is used to examine the spatial distribution of electrons in deep traps in a two-dimensional dielectric. When the trap concentration is much higher than the trapped electron concentration, Coulomb repulsion leads to the formation of a two-dimensional quasi-periodic hexagonal lattice of localized electrons (Wigner glass).

  2. Bulk crystal growth and electronic characterization of the 3D Dirac semimetal Na3Bi

    Directory of Open Access Journals (Sweden)

    Satya K. Kushwaha

    2015-04-01

    Full Text Available High quality hexagon plate-like Na3Bi crystals with large (001 plane surfaces were grown from a molten Na flux. The freshly cleaved crystals were analyzed by low temperature scanning tunneling microscopy and angle-resolved photoemission spectroscopy, allowing for the characterization of the three-dimensional (3D Dirac semimetal (TDS behavior and the observation of the topological surface states. Landau levels were observed, and the energy-momentum relations exhibited a linear dispersion relationship, characteristic of the 3D TDS nature of Na3Bi. In transport measurements on Na3Bi crystals, the linear magnetoresistance and Shubnikov-de Haas quantum oscillations are observed for the first time.

  3. Intercontinental quantum liaisons between entangled electrons in ion traps of thermoluminescent crystals

    CERN Document Server

    Desbrandes, R; Desbrandes, Robert; Gent, Daniel Van

    2006-01-01

    The experiments reported in this paper were carried out with space-separated entangled thermoluminescent dosimetry (TLD) crystals in Baton Rouge, Louisiana (USA) and Givarlais (France) at 8,182 km between entangled samples. Samples consisted of doped lithium fluoride TLD's that were simultaneously irradiated in pairs together at one location by Bremsstrahlung radiation generated by a Varian CLINAC unit. One of the paired TLD crystals was then mailed to Baton Rouge and its entangled counterpart remained in Givarlais. The crystal in Baton Rouge (master) was then subjected to thermal stimulation which elicited a measurable light emission response in the counterpart (slave) under a photomultiplier in Givarlais. Highly correlated passive light emissions were observed in the nonheated slave TLD while the master TLD was ramped up in temperature and then allowed to cool to ambient temperature. Maximum correlations in the slave TLD light emissions were observed at the turn around temperature which is the point where t...

  4. The unoccupied electronic structure characterization of hydrothermally grown ThO{sub 2} single crystals

    Energy Technology Data Exchange (ETDEWEB)

    Kelly, T.D.; Petrosky, J.C.; McClory, J.W. [Department of Engineering Physics, Air Force Institute of Technology, WPAFB, OH (United States); Turner, D. [Oak Ridge Institute for Science and Education, Oak Ridge, TN (United States); Mann, J.M. [Sensors Directorate, Air Force Research Laboratory, Wright-Patterson AFB, OH (United States); Kolis, J.W. [Department of Chemistry and Center for Optical Materials Science and Engineering Technologies (COMSET), Clemson University, Clemson, SC (United States); Zhang, Xin; Dowben, P.A. [Department of Physics and Astronomy, University of Nebraska-Lincoln, Lincoln, NE (United States)

    2014-03-15

    Single crystals of thorium dioxide ThO{sub 2}, grown by the hydrothermal growth technique, have been investigated by ultraviolet photoemission spectroscopy (UPS), inverse photoemission spectroscopy (IPES), and L{sub 3}, M{sub 3}, M{sub 4}, and M{sub 5} X-ray absorption near edge spectroscopy (XANES). The experimental band gap for large single crystals has been determined to be 6 eV to 7 eV, from UPS and IPES, in line with expectations. The combined UPS and IPES, place the Fermi level near the conduction band minimum, making these crystals n-type, with extensive band tailing, suggesting an optical gap in the region of 4.8 eV for excitations from occupied to unoccupied edge states. Hybridization between the Th 6d/5f bands with O 2p is strongly implicated. (copyright 2014 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  5. Bismuth zinc vanadate, BiZn{sub 2}VO{sub 6}: New crystal structure type and electronic structure

    Energy Technology Data Exchange (ETDEWEB)

    Eliziario Nunes, Sayonara [Department of Chemistry, Durham University, South Road, Durham DH1 3LE (United Kingdom); Department of Materials Engineering, Federal University of São Carlos, 13565-905 São Carlos, SP (Brazil); Wang, Chun-Hai; So, Karwei; Evans, John S.O. [Department of Chemistry, Durham University, South Road, Durham DH1 3LE (United Kingdom); Evans, Ivana Radosavljević, E-mail: ivana.radosavljevic@durham.ac.uk [Department of Chemistry, Durham University, South Road, Durham DH1 3LE (United Kingdom)

    2015-02-15

    We report a combined experimental and computational study of the crystal structure and electronic properties of bismuth zinc vanadate, BiZn{sub 2}VO{sub 6}, known for its visible light photocatalytic activity. The crystal structure has been solved from laboratory powder X-ray diffraction data using the repeated minimisations from random starting values method. BiZn{sub 2}VO{sub 6} adopts a new structure type, based on the following building blocks: corner- and edge-sharing ZnO{sub 4} tetrahedra, ZnO{sub 6} octahedra and VO{sub 4} tetrahedra, and Bi{sub 2}O{sub 12} dimers. It is the only known member of the BiM{sub 2}AO{sub 6} (M=Pb, Ca, Cd, Mn, Zn, Mg, Cu; A=V, P, As) family which does not appear to be structurally closely related to others. The electronic structure of BiZn{sub 2}VO{sub 6}, calculated by DFT methods, shows that it is an indirect gap semiconductor with a calculated band gap of 1.6 eV, which compares favourably to the experimentally measured value of 2.4 eV. - Graphical abstract: The crystal structure of BiZn{sub 2}VO{sub 6}, a new structure type in the BiM{sub 2}AO{sub 6} (M=Mg, Ca, Cd, Cu, Pb, Mn, Zn; A=V, P, As) family. - Highlights: • Structure solution from PXRD data by repeated minimisations from random starting values. • New structure type in the BiM{sub 2}AO{sub 6} (M=Pb, Ca, Cd, Mn, Zn, Mg, Cu; A=V, P, As) family. • Electronic structure calculation.

  6. Simulation of ultra-relativistic electrons and positrons channeling in crystals with MBN Explorer

    DEFF Research Database (Denmark)

    Sushko, Gennady B.; Bezchastnov, Victor G.; Solov'yov, Ilia;

    2013-01-01

    A newly developed code, implemented as a part of the MBN Explorer package (Solov'yov et al., 2012; http://www.mbnexplorer.com/, 2012) [1] and [2] to simulate trajectories of an ultra-relativistic projectile in a crystalline medium, is presented. The motion of a projectile is treated classically...... by integrating the relativistic equations of motion with account for the interaction between the projectile and crystal atoms. The probabilistic element is introduced by a random choice of transverse coordinates and velocities of the projectile at the crystal entrance as well as by accounting for the random...

  7. Human resource requirements for quality-assured electronic data capture of the tuberculosis case register

    Directory of Open Access Journals (Sweden)

    Hoa Nguyen B

    2012-01-01

    Full Text Available Abstract Background The tuberculosis case register is the data source for the reports submitted by basic management units to the national tuberculosis program. Our objective was to measure the data entry time required to complete and double-enter one record, and to estimate the time for the correction of errors in the captured information from tuberculosis case registers in Cambodia and Viet Nam. This should assist in quantifying the additional requirements in human resources for national programs moving towards electronic recording and reporting. Methods Data from a representative sample of tuberculosis case registers from Cambodia and Viet Nam were double-entered and discordances resolved by rechecking the original case register. Computer-generated data entry time recorded the time elapsed between opening of a new record and saving it to disk. Results The dataset comprised 22,732 double-entered records of 11,366 patients (37.1% from Cambodia and 62.9% from Viet Nam. The mean data entry times per record were 97.5 (95% CI: 96.2-98.8 and 66.2 (95% CI: 59.5-73.0 seconds with medians of 90 and 31 s respectively in Cambodia and in Viet Nam. The percentage of records with an error was 6.0% and 39.0% respectively in Cambodia and Viet Nam. Data entry time was inversely associated with error frequency. We estimate that approximately 118-person-hours were required to produce 1,000 validated records. Conclusions This study quantifies differences between two countries for data entry time for the tuberculosis case register and frequencies of data entry errors and suggests that higher data entry speed is partially offset by requiring revisiting more records for corrections.

  8. Use and Cost of Electronic Resources in Central Library of Ferdowsi University Based on E-metrics

    Directory of Open Access Journals (Sweden)

    Mohammad Reza Davarpanah

    2012-07-01

    Full Text Available The purpose of this study was to investigate the usage of electronic journals in Ferdowsi University, Iran based on e-metrics. The paper also aimed to emphasize the analysis of cost-benefit and the correlation between the journal impact factors and the usage data. In this study experiences of Ferdowsi University library on licensing and usage of electronic resources was evaluated by providing a cost-benefit analysis based on the cost and usage statistics of electronic resources. Vendor-provided data were also compared with local usage data. The usage data were collected by tracking web-based access locally, and by collecting vender-provided usage data. The data sources were one-year of vendor-supplied e-resource usage data such as Ebsco, Elsevier, Proquest, Emerald, Oxford and Springer and local usage data collected from the Ferdowsi university web server. The study found that actual usage values differ for vendor-provided data and local usage data. Elsevier has got the highest usage degree in searches, sessions and downloads. Statistics also showed that a small number of journals satisfy significant amount of use while the majority of journals were used less frequent and some were never used at all. The users preferred the PDF rather than HTML format. The data in subject profile suggested that the provided e-resources were best suited to certain subjects. There was no correlation between IF and electronic journal use. Monitoring the usage of e-resources gained increasing importance for acquisition policy and budget decisions. The article provided information about local metrics for the six surveyed vendors/publishers, e.g. usage trends, requests per package, cost per use as related to the scientific specialty of the university.

  9. Crystal and electronic structure study of AgAu and AgCu bimetallic alloy thin films by X-ray techniques

    Energy Technology Data Exchange (ETDEWEB)

    Ozkendir, O. Murat, E-mail: ozkendir@gmail.com [Mersin University, Faculty of Technology, Energy Systems Engineering, Tarsus (Turkey); Mersin University, Institute of Natural Science, Department of Nanotechnology and Advanced Materials, Mersin (Turkey); Cengiz, E. [Karadeniz Technical University, Faculty of Science, Department of Physics, Trabzon (Turkey); Yalaz, E. [Mersin University, Institute of Natural Science, Department of Nanotechnology and Advanced Materials, Mersin (Turkey); Söğüt, Ö.; Ayas, D.H. [Kahramanmaraş Sütçü İmam Üniversitesi, Faculty of Science and Letters, Department of Physics, Kahramanmaraş (Turkey); Thammajak, B. Nirawat [Synchrotron Light Research Institute (Public Organisation), 111 University Avenue, T. Suranaree, A. Muang, Nakhon Ratchasima 30000 (Thailand)

    2016-05-15

    Highlights: • Crystal and electronic properties of bimetallic AgCu and AgAu alloy thin films were studied. • Both AgCu and AgAu bimetallic samples were determined to have cubic crystal geometry. • Strong influence of Cu and Au atoms on the electronic structure of the Ag atoms were determined. - Abstract: Crystal and electronic structure properties of bimetallic AgAu and AgCu alloy thin films were investigated by X-ray spectroscopic techniques. The aim of this study is to probe the influence of Au or Cu atoms on the electronic behaviors of Ag ions in bimetallic alloy materials that yields different crystal properties. To identify the mechanisms causing crystal phase transitions, study were supported by the collected EXAFS (Extended X-ray Absorption Fine Structure) data. Crystal structures of both Cu and Au doped bimetallic Ag samples were determined mainly in cubic geometry with “Fm3m” space group. Through the Ag–Au and Ag–Cu molecular interactions during bimetallic alloy formations, highly overlapped electronic levels that supports large molecular band formations were observed with different ionization states. Besides, traces of the d–d interactions in Au rich samples were determined as the main interplay in the broad molecular bond formations. The exact atomic locations and types in the samples were determined by EXAFS studies and supported by the performed calculations with FEFF scientific code.

  10. Study of electronic structures and absorption bands of BaMgF4 crystal with F colour centre

    Institute of Scientific and Technical Information of China (English)

    Kang Ling-Ling; Liu Ting-Yu; Zhang Qi-Ren; Xu Ling-Zhi; Zhang Fei-Wu

    2011-01-01

    The electronic structures of BaMgF4 crystals containing an F colour centre are studied within the framework of the fully relativistic self-consistent Direc-Slate-theory, using a numerically discrete variational (DV-Xα)method. It is concluded from the calculated results that the energy levels of the F colour centre are located in the forbidden band.The optical transition energy from the ground state to the excited state for the F colour centre is about 5.12 eV, which corresponds to the 242-nm absorption band. These calculated results can explain the origin of the absorption bands.

  11. Channeling and Radiation of Electrons in Silicon Single Crystals and Si1−xGex Crystalline Undulators

    DEFF Research Database (Denmark)

    Backe, H.; Krambrich, D.; Lauth, W.

    2013-01-01

    potential of the silicon single crystals. Radiation from a crystalline undulator, produced at the Aarhus University (UAAR), has been investigated at the Mainz Microtron electron accelerator facility MAMI. The 4-period epitaxially grown strained layer Si1−xGex undulator had a period length λu = 9.9 μm....... At a beam energy of 375 MeV a broad excess yield around the theoretically expected photon energy of 0.132 MeV has been observed. Model calculations on the basis of synchrotron-like radiation emission suggest that evidence for a weak undulator effect has been observed....

  12. Ab initio calculation of electron-phonon coupling in monoclinic β-Ga2O3 crystal

    Science.gov (United States)

    Ghosh, Krishnendu; Singisetti, Uttam

    2016-08-01

    The interaction between electrons and vibrational modes in monoclinic β-Ga2O3 is theoretically investigated using ab-initio calculations. The large primitive cell of β-Ga2O3 gives rise to 30 phonon modes all of which are taken into account in transport calculation. The electron-phonon interaction is calculated under density functional perturbation theory and then interpolated using Wannier-Fourier interpolation. The long-range interaction elements between electrons and polar optical phonon (POP) modes are calculated separately using the Born effective charge tensor. The direction dependence of the long-range POP coupling in a monoclinic crystal is explored and is included in the transport calculations. Scattering rate calculations are done using the Fermi golden rule followed by solving the Boltzmann transport equation using the Rode's method to estimate low field mobility. A room temperature mobility of 115 cm2/V s is observed. Comparison with recent experimentally reported mobility is done for a wide range of temperatures (30 K-650 K). It is also found that the POP interaction dominates the electron mobility under low electric field conditions. The relative contribution of the different POP modes is analyzed and the mode 21 meV POP is found to have the highest impact on low field electron mobility at room temperature.

  13. First spin-resolved electron distributions in crystals from combined polarized neutron and X-ray diffraction experiments

    Directory of Open Access Journals (Sweden)

    Maxime Deutsch

    2014-05-01

    Full Text Available Since the 1980s it has been possible to probe crystallized matter, thanks to X-ray or neutron scattering techniques, to obtain an accurate charge density or spin distribution at the atomic scale. Despite the description of the same physical quantity (electron density and tremendous development of sources, detectors, data treatment software etc., these different techniques evolved separately with one model per experiment. However, a breakthrough was recently made by the development of a common model in order to combine information coming from all these different experiments. Here we report the first experimental determination of spin-resolved electron density obtained by a combined treatment of X-ray, neutron and polarized neutron diffraction data. These experimental spin up and spin down densities compare very well with density functional theory (DFT calculations and also confirm a theoretical prediction made in 1985 which claims that majority spin electrons should have a more contracted distribution around the nucleus than minority spin electrons. Topological analysis of the resulting experimental spin-resolved electron density is also briefly discussed.

  14. Temperature dependences of the Hall and magnetoresistance coefficients of vanadium and tantalum single crystals: Anisotropy of electron-phonon scattering

    Energy Technology Data Exchange (ETDEWEB)

    Volkenshtein, N.V.; Veprev, A.G.; Startsev, V.E.; Cherepanov, A.N.; Cherepanov, V.I.

    1985-07-01

    The Hall coefficient R/sub H/(T), transverse magnetoresistance rho/sub c/(T), and the temperature-dependent component rho/sub c/(T) of the impurity electrical resistance are measured as functions of temperature T = 4.2--300 K for vanadium and tantalum single crystals with rho/sub 273.2//rho/sub 4.2/ = 1350 and 500, respectively. The curves R/sub H/(T) have minima at T0 = 33 and 24 K for vanadium and tantalum, respectively, which indicates that the electron-phonon scattering is anisotropic. The anisotropy is caused by ''intersheet'' electron-phonon processes in which the charge carriers are scattered between the open hole surface GAMMAH3h and the closed hole ellipsoids N3h. The curves r/sub H/(T) and rho/sub c/(T) have maxima for T close to T0. The observed extrema have a common physical origin and can be explained by the Kagan-Zhernov-Flerov theory, which postulates that the nonequilibrium part of the electron distribution function is anisotropic. The observed dependence R/sub H/(T) for T>T0 agrees with calculations of R/sub H/(T) for vanadium based on realistic models for the electron and phonon spectra, including the anisotropy for the electron-phonon interaction matrix element.

  15. CRYSTAL-STRUCTURE OF AN ELECTRON-TRANSFER COMPLEX BETWEEN METHYLAMINE DEHYDROGENASE AND AMICYANIN

    NARCIS (Netherlands)

    CHEN, LY; DURLEY, R; POLIKS, BJ; HAMADA, K; CHEN, ZW; MATHEWS, FS; DAVIDSON, VL; SATOW, Y; HUIZINGA, E; VELLIEUX, FMD; HOL, WGJ

    1992-01-01

    The crystal structure of the complex between the quinoprotein methylamine dehydrogenase (MADH) and the type I blue copper protein amicyanin, both from Paracoccus denitrificans, has been determined at 2.5-angstrom resolution using molecular replacement. The search model was MADH from Thiobacillus ver

  16. CRYSTAL-STRUCTURE OF AN ELECTRON-TRANSFER COMPLEX BETWEEN METHYLAMINE DEHYDROGENASE AND AMICYANIN

    NARCIS (Netherlands)

    CHEN, LY; DURLEY, R; POLIKS, BJ; HAMADA, K; CHEN, ZW; MATHEWS, FS; DAVIDSON, VL; SATOW, Y; HUIZINGA, E; VELLIEUX, FMD; HOL, WGJ

    1992-01-01

    The crystal structure of the complex between the quinoprotein methylamine dehydrogenase (MADH) and the type I blue copper protein amicyanin, both from Paracoccus denitrificans, has been determined at 2.5-angstrom resolution using molecular replacement. The search model was MADH from Thiobacillus

  17. Channeling, volume reflection, and volume capture study of electrons in a bent silicon crystal

    DEFF Research Database (Denmark)

    Wistisen, T. N.; Uggerhoj, U. I.; Wienands, U.;

    2016-01-01

    We present the experimental data and analysis of experiments conducted at SLAC National Accelerator Laboratory investigating the processes of channeling, volume-reflection and volume-capture along the (111) plane in a strongly bent quasimosaic silicon crystal. These phenomena were investigated at...

  18. Liquid crystal multi-mode lenses and axicons based on electronic phase shift control.

    Science.gov (United States)

    Kirby, Andrew K; Hands, Philip J; Love, Gordon D

    2007-10-17

    We report on the principle of operation, construction and testing of a liquid crystal lens which is controlled by distributing voltages across the control electrodes, which are in turn controlled by adjusting the phase of the applied voltages. As well as (positive and negative) defocus, then lenses can be used to control tip/tilt, astigmatism, and to create variable axicons.

  19. Full analysis of feldspar texture and crystal structure by combining X-ray and electron techniques

    DEFF Research Database (Denmark)

    Balic Zunic, Tonci; Piazolo, Sandra; Katerinopoulou, Anna;

    2013-01-01

    identification plus crystal structure refinement of all components in a feldspar intergrowth. This procedure was applied to perthitic intergrowths in feldspars from two different pegmatites in the Larvik plutonic complex in the southern part of the Oslo region, Norway. It revealed that the two starting high...

  20. A combined study of mesomorphism, optical, and electronic properties of donor-acceptor columnar liquid crystals

    NARCIS (Netherlands)

    Eichhorn, S.H.; Shuai, C.; Ahmida, M.; Demenev, A.; Kayal, H.; Raad, F.S.; Kaafarani, B.R.; Patwardhan, S.; Grozema, F.C.; Siebbeles, L.D.A.; Taerum, T.; Perepichka, D.F.; Klenkler, R.

    2011-01-01

    Donor-acceptor structures have recently gained great popularity for the design of low band gap polymeric organic semiconductors. Presented here is a first systematic study of organic semiconductors based on columnar liquid crystals that consist of discotic and board-shaped donor-acceptor structures.

  1. CRYSTAL-STRUCTURE OF AN ELECTRON-TRANSFER COMPLEX BETWEEN METHYLAMINE DEHYDROGENASE AND AMICYANIN

    NARCIS (Netherlands)

    CHEN, LY; DURLEY, R; POLIKS, BJ; HAMADA, K; CHEN, ZW; MATHEWS, FS; DAVIDSON, VL; SATOW, Y; HUIZINGA, E; VELLIEUX, FMD; HOL, WGJ

    1992-01-01

    The crystal structure of the complex between the quinoprotein methylamine dehydrogenase (MADH) and the type I blue copper protein amicyanin, both from Paracoccus denitrificans, has been determined at 2.5-angstrom resolution using molecular replacement. The search model was MADH from Thiobacillus ver

  2. Synthesis, crystal and electronic structure, and optical property of the pentanary chalcohalide Ba3KSb4S9Cl

    Science.gov (United States)

    Zhao, Hua-Jun; Liu, Peng-Fei

    2015-12-01

    The pentanary chalcohalide Ba3KSb4S9Cl has been prepared from stoichiometric mixtures of KCl, Ba, Sb, and S in an evacuated silica tube, which is the first example of chalcohalides in the pentanary A/Ae/Sb/Q/X (A=alkali metal; Ae=alkaline-earth metal; Q=S, Se, Te; X=F, Cl, Br, I) system. This material crystallize in the Pnnm space group and its new structure type comprises one-dimensional (1D) [Sb3S7]5- chains running down the [001] direction separated by isolated dimeric Sb2S4 polyhedra, Ba2+, K+, and Cl-, respectively. The optical gap of 1.99 eV for Ba3KSb4S9Cl was deduced from the UV/vis reflectance spectroscopy and DFT study indicates a indirect band gap with an electronic transfer excitation of S 3p to Sb 5p orbital electrons.

  3. Electron spin echo studies of the internal motion of radicals in crystals: Phase memory vs correlation time

    Science.gov (United States)

    Kispert, Lowell D.; Bowman, Michael K.; Norris, James R.; Brown, Meta S.

    1982-01-01

    An electron spin echo (ESE) study of the internal motion of the CH2 protons in irradiated zinc acetate dihydrate crystals shows that quantitative measurements of the motional correlation time can be obtained quite directly from pulsed measurements. In the slow motional limit, the motional correlation time is equal to the phase memory time determined by ESE. In the fast motional limit, the motional correlation time is proportional to the no motion spectral second moment divided by the ESE phase memory time. ESE offers a convenient method of studying motion, electron transfer, conductivity, etc. in a variety of systems too complicated for study by ordinary EPR. New systems for study by ESE include biological samples, organic polymers, liquid solutions of radicals with unresolved hyperfine, etc. When motion modulates large anisotropic hyperfine couplings, ESE measurements of the phase memory time are sensitive to modulation of pseudosecular hyperfine interactions.

  4. Radiation emission at channeling of electrons in a strained layer Si1-xGex undulator crystal

    DEFF Research Database (Denmark)

    Backe, H.; Krambrich, D.; Lauth, W.

    2013-01-01

    Experiments have been performed at the Mainz Microtron MAMI to explore the radiation emission spectra from a crystalline undulator at electron beam energies of 270 and 855 MeV. The epitaxially grown graded composition strained layer Si1-xGex undulator had 4-period with a period length View the Math......ML source. Spectra taken at the beam energy of 270 MeV at channeling in the undulating (110) planes exhibit a broad excess yield around the theoretically expected photon energies of 0.069 MeV, as compared with a flat silicon reference crystal. Model calculations on the basis of synchrotron-like radiation...... emission from finite single arc elements, taking into account also coherence effects, suggest that evidence for a weak undulator effect has been observed for the first time for electrons....

  5. Creation of domains by direct electron beam writing in magnesium-doped LiNbO{sub 3} and LiNbO{sub 3}:Fe single crystals

    Energy Technology Data Exchange (ETDEWEB)

    Palatnikov, M.N. [Institute of Chemistry and Technology of Rare Elements and Mineral Raw Materials, 26a Akademgorodok, Apatity, Murmansk 184209 (Russian Federation); Kokhanchik, L.S.; Emelin, E.V. [Institute of Microelectronics Technology and High Purity Materials of Russian Academy of Sciences, 6 Academician Ossipyan st, Chernogolovka, Moscow 142432 (Russian Federation); Sidorov, N.V. [Institute of Chemistry and Technology of Rare Elements and Mineral Raw Materials, 26a Akademgorodok, Apatity, Murmansk 184209 (Russian Federation); Manukovskaya, D.V., E-mail: deenka@yandex.ru [Institute of Chemistry and Technology of Rare Elements and Mineral Raw Materials, 26a Akademgorodok, Apatity, Murmansk 184209 (Russian Federation)

    2016-03-01

    Highlights: • The periodic domains are created in crystal LiNbO{sub 3}:Mg by direct electron beam writing. • Periodic domains appear only at equilibrium between switching and screening times. • Equilibrium exists in crystal co-doped by Fe. • Shape and appearance of domains depend on the conductivity type. - Abstract: Domain structures in the Z-cut of highly doped LiNbO{sub 3}:Mg and LiNbO{sub 3}:Mg,Fe single crystals were created by direct electron beam writing (DEBW). It was found that the value and type of electron conductivity influence the shape and number of domains thus created. Controlled electron beam regular domains were created only in samples of the crystal LiNbO{sub 3}:Mg,Fe [MgO] = 5.16 mol.%, [Fe] = 0.007 mol.%. In highly doped LiNbO{sub 3}:Mg ([MgO] = 5.19 mol.%) crystal, the domains were formed chaotically and controlled creation of domains did not occur. The domain shapes were analyzed in the framework of the theory of screening of domain nuclei depolarizing electric fields and the influence of screening on the final shape of domains. It was found that screening of intrinsic electric fields is faster in the LiNbO{sub 3}:Mg,Fe crystal. This crystal has a high electronic conductivity of hopping type with a high mobility of charge carriers. Thus, a small amount of Fe provides equilibrium between the ferroelectric switching velocity and screening of the depolarizing electric field velocity. The results are discussed considering differences in the electron conductivity mechanisms, which control the screening of depolarizing electric field velocity and spatial charge area formed under an electron beam.

  6. Stretchable form of single crystal silicon for high performance electronics on rubber substrates

    Energy Technology Data Exchange (ETDEWEB)

    Rogers, John A.; Khang, Dahl-Young; Sun, Yugang; Menard, Etienne

    2016-12-06

    The present invention provides stretchable, and optionally printable, semiconductors and electronic circuits capable of providing good performance when stretched, compressed, flexed or otherwise deformed. Stretchable semiconductors and electronic circuits of the present invention preferred for some applications are flexible, in addition to being stretchable, and thus are capable of significant elongation, flexing, bending or other deformation along one or more axes. Further, stretchable semiconductors and electronic circuits of the present invention may be adapted to a wide range of device configurations to provide fully flexible electronic and optoelectronic devices.

  7. Stretchable form of single crystal silicon for high performance electronics on rubber substrates

    Energy Technology Data Exchange (ETDEWEB)

    Rogers, John A [Champaign, IL; Khang, Dahl-Young [Seoul, KR; Sun, Yugang [Naperville, IL; Menard, Etienne [Durham, NC

    2012-06-12

    The present invention provides stretchable, and optionally printable, semiconductors and electronic circuits capable of providing good performance when stretched, compressed, flexed or otherwise deformed. Stretchable semiconductors and electronic circuits of the present invention preferred for some applications are flexible, in addition to being stretchable, and thus are capable of significant elongation, flexing, bending or other deformation along one or more axes. Further, stretchable semiconductors and electronic circuits of the present invention may be adapted to a wide range of device configurations to provide fully flexible electronic and optoelectronic devices.

  8. Stretchable form of single crystal silicon for high performance electronics on rubber substrates

    Energy Technology Data Exchange (ETDEWEB)

    Rogers, John A.; Khang, Dahl -Young; Sun, Yugang; Menard, Etienne

    2015-08-11

    The present invention provides stretchable, and optionally printable, semiconductors and electronic circuits capable of providing good performance when stretched, compressed, flexed or otherwise deformed. Stretchable semiconductors and electronic circuits of the present invention preferred for some applications are flexible, in addition to being stretchable, and thus are capable of significant elongation, flexing, bending or other deformation along one or more axes. Further, stretchable semiconductors and electronic circuits of the present invention may be adapted to a wide range of device configurations to provide fully flexible electronic and optoelectronic devices.

  9. Stretchable form of single crystal silicon for high performance electronics on rubber substrates

    Energy Technology Data Exchange (ETDEWEB)

    University of Illinois (Urbana, IL)

    2009-04-21

    The present invention provides stretchable, and optionally printable, semiconductors and electronic circuits capable of providing good performance when stretched, compressed, flexed or otherwise deformed. Stretchable semiconductors and electronic circuits of the present invention preferred for some applications are flexible, in addition to being stretchable, and thus are capable of significant elongation, flexing, bending or other deformation along one or more axes. Further, stretchable semiconductors and electronic circuits of the present invention may be adapted to a wide range of device configurations to provide fully flexible electronic and optoelectronic devices.

  10. Stretchable form of single crystal silicon for high performance electronics on rubber substrates

    Energy Technology Data Exchange (ETDEWEB)

    Rogers, John A.; Khang, Dahl-Young; Sun, Yugang; Menard, Etienne

    2014-06-17

    The present invention provides stretchable, and optionally printable, semiconductors and electronic circuits capable of providing good performance when stretched, compressed, flexed or otherwise deformed. Stretchable semiconductors and electronic circuits of the present invention preferred for some applications are flexible, in addition to being stretchable, and thus are capable of significant elongation, flexing, bending or other deformation along one or more axes. Further, stretchable semiconductors and electronic circuits of the present invention may be adapted to a wide range of device configurations to provide fully flexible electronic and optoelectronic devices.

  11. Stretchable form of single crystal silicon for high performance electronics on rubber substrates

    Science.gov (United States)

    University of Illinois

    2009-04-21

    The present invention provides stretchable, and optionally printable, semiconductors and electronic circuits capable of providing good performance when stretched, compressed, flexed or otherwise deformed. Stretchable semiconductors and electronic circuits of the present invention preferred for some applications are flexible, in addition to being stretchable, and thus are capable of significant elongation, flexing, bending or other deformation along one or more axes. Further, stretchable semiconductors and electronic circuits of the present invention may be adapted to a wide range of device configurations to provide fully flexible electronic and optoelectronic devices.

  12. Use and User Perception of Electronic Information Resources: A Case Study of Siva Institute of Frontier Technology, India

    Directory of Open Access Journals (Sweden)

    Velmurugan Chandran

    2013-12-01

    Full Text Available The present study aims to explore the use and user perception of electronic resources in Siva Institute of Frontier Technology, India. A total number of 123 users were taken into account for the study through a questionnaire-based survey method. A well-structured questionnaire was designed and distributed to the selected 200 students and staff members. 123 copies of the questionnaires were returned dully filled in and the overall response rate was 61.50 percent. The questionnaire contained both open- and close-ended questions. The collected data were classified, analyzed, and tabulated by using simple statistical methods. This study covers the impact of electronic resources on students and faculty in their academic pursuit.

  13. A high resolution X-ray crystal spectrometer to study electron and heavy-ion impact atomic collisions

    Indian Academy of Sciences (India)

    Ajay Kumar; D Misra; A H Kelkar; U R Kadhane; K V Thulasiram; Lokesh C Tribedi

    2007-06-01

    We have studied fast ion–atom and electron–atom collision processes using a reconditioned high resolution X-ray spectrometer. The X-rays, generated by the collisions, are dispersed by a curved ADP crystal (Johansson geometry) and detected by a gas proportional counter. A self-written LabVIEW based program has been used to give precise and controlled movement to the crystal and for data acquisition. The performance was tested by detecting the K diagram and satellite lines of several elements. The K satellite lines of Al have been studied in collision with 3–12 keV electrons and 40 MeV C4+ ions. In ion collisions as large as four L-vacancies are created simultaneously with the K-vacancy, compared to two satellites in case of the e-impact. In addition, we have measured the X-rays from H-, He- and Li-like Si ions which arise due to the electron loss/capture process in highly charged 80 MeV Si7+ ions in collision with thin carbon foil. Approximate charge state distribution has been obtained using this new technique.

  14. Imaging crystal spectrometer for high-resolution x-ray measurements on electron beam ion traps and tokamaks

    Science.gov (United States)

    Beiersdorfer, P.; Magee, E. W.; Hell, N.; Brown, G. V.

    2016-11-01

    We describe a crystal spectrometer implemented on the Livermore electron beam ion traps that employ two spherically bent quartz crystals and a cryogenically cooled back-illuminated charge-coupled device detector to measure x rays with a nominal resolving power of λ/Δλ ≥ 10 000. Its focusing properties allow us to record x rays either with the plane of dispersion perpendicular or parallel to the electron beam and, thus, to preferentially select one of the two linear x-ray polarization components. Moreover, by choice of dispersion plane and focussing conditions, we use the instrument either to image the distribution of the ions within the 2 cm long trap region, or to concentrate x rays of a given energy to a point on the detector, which optimizes the signal-to-noise ratio. We demonstrate the operation and utility of the new instrument by presenting spectra of Mo34+, which prepares the instrument for use as a core impurity diagnostic on the NSTX-U spherical torus and other magnetic fusion devices that employ molybdenum as plasma facing components.

  15. Channeling, volume reflection, and volume capture study of electrons in a bent silicon crystal

    Science.gov (United States)

    Wistisen, T. N.; Uggerhøj, U. I.; Wienands, U.; Markiewicz, T. W.; Noble, R. J.; Benson, B. C.; Smith, T.; Bagli, E.; Bandiera, L.; Germogli, G.; Guidi, V.; Mazzolari, A.; Holtzapple, R.; Tucker, S.

    2016-07-01

    We present the experimental data and analysis of experiments conducted at SLAC National Accelerator Laboratory investigating the processes of channeling, volume-reflection and volume-capture along the (111) plane in a strongly bent quasimosaic silicon crystal. These phenomena were investigated at 5 energies: 3.35, 4.2, 6.3, 10.5, and 14.0 GeV with a crystal with bending radius of 0.15 m, corresponding to curvatures of 0.053, 0.066, 0.099, 0.16, and 0.22 times the critical curvature, respectively. Based on the parameters of fitting functions we have extracted important parameters describing the channeling process such as the dechanneling length, the angle of volume reflection, the surface transmission, and the widths of the distribution of channeled particles parallel and orthogonal to the plane.

  16. How Human Resource Professionals Use Electronic Channels to Communicate CSR : A case study focused on Solvay's French industrial sites

    OpenAIRE

    Fournet, Clara; Pauly, Marissa

    2015-01-01

    Corporate Social Responsibility (CSR) has become a large concern for many companies with the rise of globalization. Oftentimes, companies are encouraged to communicate CSR externally, but not internally. This research focuses upon the internal communication of CSR, specifically how Human Resource (HR) professionals use electronic channels to communicate to employees. The scope of this research is focused solely upon HR professionals within Solvay’s French industrial sites, which produce chemi...

  17. Challenges in the implementation of an electronic surveillance system in a resource-limited setting: Alerta, in Peru

    Directory of Open Access Journals (Sweden)

    Soto Giselle

    2008-11-01

    Full Text Available Abstract Background Infectious disease surveillance is a primary public health function in resource-limited settings. In 2003, an electronic disease surveillance system (Alerta was established in the Peruvian Navy with support from the U.S. Naval Medical Research Center Detachment (NMRCD. Many challenges arose during the implementation process, and a variety of solutions were applied. The purpose of this paper is to identify and discuss these issues. Methods This is a retrospective description of the Alerta implementation. After a thoughtful evaluation according to the Centers for Disease Control and Prevention (CDC guidelines, the main challenges to implementation were identified and solutions were devised in the context of a resource-limited setting, Peru. Results After four years of operation, we have identified a number of challenges in implementing and operating this electronic disease surveillance system. These can be divided into the following categories: (1 issues with personnel and stakeholders; (2 issues with resources in a developing setting; (3 issues with processes involved in the collection of data and operation of the system; and (4 issues with organization at the central hub. Some of the challenges are unique to resource-limited settings, but many are applicable for any surveillance system. For each of these challenges, we developed feasible solutions that are discussed. Conclusion There are many challenges to overcome when implementing an electronic disease surveillance system, not only related to technology issues. A comprehensive approach is required for success, including: technical support, personnel management, effective training, and cultural sensitivity in order to assure the effective deployment of an electronic disease surveillance system.

  18. Electronic Transport Properties of Sodium Tungsten Bronzes Nao.54WO3 Single Crystals

    Institute of Scientific and Technical Information of China (English)

    Song Yue; Yuan Zhang

    2012-01-01

    Single crystals of ternary sodium tungsten bronzes have been prepared by the electrolysis of molten Na2W04-W03 system. X-ray powder diffraction and energy dispersive spectroscopy results reveal that the obtained samples are of cubic phase with empirical formula of Na0.54W03. Electrical resistivity measurement indicates a metallic conducting behavior without any anomaly from 5-300 K.

  19. Electronic Properties of Graphene Encapsulated with Different Two-Dimensional Atomic Crystals

    OpenAIRE

    2014-01-01

    Hexagonal boron nitride is the only substrate that has so far allowed graphene devices exhibiting micron-scale ballistic transport. Can other atomically flat crystals be used as substrates for making quality graphene heterostructures? Here we report on our search for alternative substrates. The devices fabricated by encapsulating graphene with molybdenum or tungsten disulphides and hBN are found to exhibit consistently high carrier mobilities of about 60,000 cm$^{2}$V$^{-1}$s$^{-1}$. In contr...

  20. Tracking the Flow of Resources in Electronic Waste - The Case of End-of-Life Computer Hard Disk Drives.

    Science.gov (United States)

    Habib, Komal; Parajuly, Keshav; Wenzel, Henrik

    2015-10-20

    Recovery of resources, in particular, metals, from waste flows is widely seen as a prioritized option to reduce their potential supply constraints in the future. The current waste electrical and electronic equipment (WEEE) treatment system is more focused on bulk metals, where the recycling rate of specialty metals, such as rare earths, is negligible compared to their increasing use in modern products, such as electronics. This study investigates the challenges in recovering these resources in the existing WEEE treatment system. It is illustrated by following the material flows of resources in a conventional WEEE treatment plant in Denmark. Computer hard disk drives (HDDs) containing neodymium-iron-boron (NdFeB) magnets were selected as the case product for this experiment. The resulting output fractions were tracked until their final treatment in order to estimate the recovery potential of rare earth elements (REEs) and other resources contained in HDDs. The results further show that out of the 244 kg of HDDs treated, 212 kg comprising mainly of aluminum and steel can be finally recovered from the metallurgic process. The results further demonstrate the complete loss of REEs in the existing shredding-based WEEE treatment processes. Dismantling and separate processing of NdFeB magnets from their end-use products can be a more preferred option over shredding. However, it remains a technological and logistic challenge for the existing system.

  1. The impact of electronic healthcare associated infection surveillance software on infection prevention resources: A systematic review of the literature.

    Science.gov (United States)

    Russo, Philip L; Shaban, Ramon Z; MacBeth, Deborough; Carter, Abigail; Mitchell, Brett G

    2017-09-08

    Surveillance of healthcare-associated infections is fundamental for infection prevention. The methods and practices for surveillance have evolved as technology becomes more advanced. The availability of electronic surveillance software (ESS) has increased, and yet adoption of ESS is slow. It is argued that ESS deliver savings through automation, particularly in terms of human resourcing and infection prevention (IP) staff time. This paper describes the findings of a systematic review on the impact of ESS on IP resources. A systematic search was conducted of electronic databases Medline and the Cumulative Index to Nursing and Allied Health Literature published between 1st January 2006 and 31(st) December 2016 with analysis using Newcastle-Ottawa Scale. 2832 articles were reviewed of which 16 studies met the inclusion criteria. IP resources were identified as time undertaken on surveillance. A reduction in IP staff time to undertake surveillance was demonstrated in 13 studies. The reduction proportion ranged from 12.5% - 98.4% (mean 73.9%). The remaining three did not allow for any estimation of the effect in terms of IP staff time. None of the studies demonstrated an increase in IP staff time. The results of this review demonstrate that adopting ESS yield considerable dividends in IP staff time relating to data collection and case ascertainment whilst maintaining high levels of sensitivity and specificity. This has the potential to enable reinvestment into other components of IP to maximise efficient use of scare IP resources. Copyright © 2017. Published by Elsevier Ltd.

  2. Magnetic interactions and electronic structure of uvarovite and andradite garnets. An ab initio all-electron simulation with the CRYSTAL06 program

    Science.gov (United States)

    Meyer, A.; Pascale, F.; Zicovich-Wilson, C. M.; Dovesi, R.

    The ground-state electronic structure of a number of magnetic phases of the garnets andradite (Ca3Fe2Si3O12) and uvarovite (Ca3Cr2Si3O12) has been investigated at the density functional theory level of approximation using the periodic ab initio code CRYSTAL. An all-electron Gaussian-type basis has been used in conjunction with the B3LYP hybrid functional. The exchange coupling constants between the first (J1a and J1b differentiating the two nonidentical sites), second (J2), and third (J3) nearest neighbors have been evaluated and are found to be in good agreement with the experimental data that is available for andradite. As a consequence of both the different J1a to J1b ratio and the opposite sign of J2 in the two minerals, different antiferromagnetic (AF) ground states are found for uvarovite and andradite, which is in agreement with experimental observation. Strong support for the additivity and transferability of the J constants is provided by calculations in which Cr and Fe ions are embedded in the related grossular structure. The mechanism for the stabilization of the AF states is discussed within the Anderson theory of superexchange; the kinetic energy gain in the AF states is calculated, and the spin density maps and profiles are examined. Density of states, charge density maps, and Mulliken population data complete the analysis of the electronic structure.

  3. GENERAL REGULARITIES OF FORMATION OF CRYSTAL STRUCTURES OF ELEMENTS DEPENDING ON ELECTRON STRUCTURE OF ATOMS (OBSHCHILE ZAKONOMERNOSTI OBRAZOVANIYA KRISTALLICHESKIKH STRUKTUR ELEMENTOV V ZAVISIMOSTI OT ELEKTRONNOGO STROENIYA ATOMOV),

    Science.gov (United States)

    A table is given showing the dependence of crystalline structures of elements on the number of electrons in the incompleted electronic subshells of...its atoms. The conclusion is drawn that the types of crystalline structures of the elements depend on the configuration of the outer electronic...subshells acquired by the atoms prior to crystallization. Crystalline structures of elements not governed by the 8 - N rule are determined by one or both

  4. HELP (INFORMATION ELECTRONIC RESOURCE "CHRONICLE OF ONU: DATES, FACTS, EVENTS": HISTORY OF UNIVERSITY IN INFORMATION SPACE

    Directory of Open Access Journals (Sweden)

    А. М. Гавриленко

    2016-03-01

    Object of research is the help information resource "The chronicle of the Odessa national university of I. I. Mechnikov: dates, facts, events". The main objective of our article – to state the main methodological bases of creation of information resource. One of advantages of information resource is possibility of continuous updating and replenishment by new information. Main objective of creation of this information resource is systematization of material on stories of the Odessa national university of I. I. Mechnikov from the date of his basis to the present, ensuring interactive access to information on the main dates, the most significant events in life of university. The base of research are sources on the history of university, chronology of historical development, formation of infrastructure, cadres and scientific researches. In information resource the main stages of development, functioning and transformation of the Odessa University are analyzed, information on its divisions is collected. For creation of this information resource in Scientific library the method of work was developed, the main selection criteria of data are allocated. This information resource have practical value for all who is interested in history of university, historians, scientists-researchers of history of science and the city of Odessa.

  5. Probing low-energy hyperbolic polaritons in van der Waals crystals with an electron microscope

    KAUST Repository

    Govyadinov, Alexander A.

    2017-07-14

    Van der Waals materials exhibit intriguing structural, electronic, and photonic properties. Electron energy loss spectroscopy within scanning transmission electron microscopy allows for nanoscale mapping of such properties. However, its detection is typically limited to energy losses in the eV range-too large for probing low-energy excitations such as phonons or mid-infrared plasmons. Here, we adapt a conventional instrument to probe energy loss down to 100 meV, and map phononic states in hexagonal boron nitride, a representative van der Waals material. The boron nitride spectra depend on the flake thickness and on the distance of the electron beam to the flake edges. To explain these observations, we developed a classical response theory that describes the interaction of fast electrons with (anisotropic) van der Waals slabs, revealing that the electron energy loss is dominated by excitation of hyperbolic phonon polaritons, and not of bulk phonons as often reported. Thus, our work is of fundamental importance for interpreting future low-energy loss spectra of van der Waals materials.Here the authors adapt a STEM-EELS system to probe energy loss down to 100 meV, and apply it to map phononic states in hexagonal boron nitride, revealing that the electron loss is dominated by hyperbolic phonon polaritons.

  6. The study of electron scattering mechanisms in single crystal oxide nanowires

    Energy Technology Data Exchange (ETDEWEB)

    Berengue, Olivia M; Chiquito, Adenilson J [NanO LaB - Departamento de Fisica, Universidade Federal de Sao Carlos, CEP 13565-905, CP 676, Sao Carlos, Sao Paulo (Brazil); Simon, Ricardo A [UTFPR - Campus Apucarana, Rua MarcIlio Dias, 635, CEP 86812-460, Apucarana, Parana (Brazil); Leite, Edson R, E-mail: oliberengue@yahoo.com.br [Laboratorio Interdisciplinar de EletroquImica e Ceramicas, Departamento de Quimica, Universidade Federal de Sao Carlos, CEP 13565-905, CP 676, Sao Carlos, Sao Paulo (Brazil)

    2011-06-01

    We report on transport measurements of individual Sn doped In{sub 2}O{sub 3} nanowires. From these measurements we point out that spin-orbit and boundary scattering mechanisms seem to give a negligible contribution to the transport of electrons in these nanowires. In fact, these results can be extended to other oxide systems: the presence of a weak disorder arising from the random potential at the boundaries screen electrons away from the surface into the nanowire. Electrons travelling through the nanowire in inner conducting channels are not directly influenced by the surfaces and the boundary scattering is decreased. These findings were also supported by calculations of the electron distribution in the cross-section of the nanowires when some disorder is taken into account.

  7. Electronic, mechanical and optical properties of atomically thin tow-dimensional crystals

    Directory of Open Access Journals (Sweden)

    A. Castellanos-Gómez

    2012-03-01

    Full Text Available This work is devoted to the study of electronic and mechanical properties of crystalline atomically thin two-dimensional sheets, such as graphene, MoS2, NbSe2 and mica by scanning probe microscopy.

  8. Modification to an Auger Electron Spectroscopy system for measuring segregation in a bi-crystal

    CSIR Research Space (South Africa)

    Jafta, CJ

    2013-03-01

    Full Text Available to the scanning control unit of the AES electron beam to eliminate the difference in experimental parameters and specialized written software to automate the data acquisition process. This makes direct comparison of segregation parameters on two different...

  9. Calculation of the spectral, structural, and electronic properties of NaCrSi2O6 and LiCrSi2O6 crystals

    Science.gov (United States)

    Brik, M. G.; Avram, N. M.; Gruia, A. S.

    2013-08-01

    Spectral, structural and electronic properties of two Cr3+-bearing systems (NaCrSi2O6, LiCrSi2O6) have been theoretically modeled using two different approaches: semi-empirical model of crystal field, in the framework of the Exchange Charge Model and two ab initio DFT-based calculations, as implemented in the CASTEP module [1] of Materials Studio package [2] and, for reliability, CRYSTAL09 code [3]. The first one allows for calculations of the electronic levels of sixfold coordinated Cr3+ ions in a crystal field of host's ligands and direct comparison with experimental absorption spectra [4]. The latter two allow for the analysis of the band structure and density of states (DOS), after optimization of the crystal lattice structures of these materials. In particular, a special attention was paid to the energetic position of the Cr3+ 3d states. All obtained results are compared with corresponding experimental values and discussed.

  10. Effect of Access to an Electronic Medical Resource on Performance Characteristics of a Certification Examination: A Randomized Controlled Trial.

    Science.gov (United States)

    Lipner, Rebecca S; Brossman, Bradley G; Samonte, Kelli M; Durning, Steven J

    2017-09-05

    Electronic resources are increasingly used in medical practice. Their use during high-stakes certification examinations has been advocated by many experts, but whether doing so would affect the capacity to differentiate between high and low abilities is unknown. To determine the effect of electronic resources on examination performance characteristics. Randomized controlled trial. Medical certification program. 825 physicians initially certified by the American Board of Internal Medicine (ABIM) who passed the Internal Medicine Certification examination or sat for the Internal Medicine Maintenance of Certification (IM-MOC) examination in 2012 to 2015. Participants were randomly assigned to 1 of 4 conditions: closed book using typical or additional time, or open book (that is, UpToDate [Wolters Kluwer]) using typical or additional time. All participants took the same modified version of the IM-MOC examination. Primary outcomes included item difficulty (how easy or difficult the question was), item discrimination (how well the question differentiated between high and low abilities), and average question response time. Secondary outcomes included examination dimensionality (that is, the number of factors measured) and test-taking strategy. Item response theory was used to calculate question characteristics. Analysis of variance compared differences among conditions. Closed-book conditions took significantly less time than open-book conditions (mean, 79.2 seconds [95% CI, 78.5 to 79.9 seconds] vs. 110.3 seconds [CI, 109.2 to 111.4 seconds] per question). Mean discrimination was statistically significantly higher for open-book conditions (0.34 [CI, 0.32 to 0.35] vs. 0.39 [CI, 0.37 to 0.41] per question). A strong single dimension showed that the examination measured the same factor with or without the resource. Only 1 electronic resource was evaluated. Inclusion of an electronic resource with time constraints did not adversely affect test performance and did not change

  11. Magnetic microstructure of iron sulfide crystals in magnetotactic bacteria from off-axis electron holography

    Energy Technology Data Exchange (ETDEWEB)

    Kasama, T. [Frontier Research System, Institute of Physical and Chemical Research (Japan); Department of Materials Science and Metallurgy, University of Cambridge (United Kingdom); Posfai, M. [Department of Earth and Environmental Sciences, University of Veszprem (Hungary); Chong, R.K.K. [Department of Materials Science and Metallurgy, University of Cambridge (United Kingdom); Finlayson, A.P. [Department of Materials Science and Metallurgy, University of Cambridge (United Kingdom); Dunin-Borkowski, R.E. [Department of Materials Science and Metallurgy, University of Cambridge (United Kingdom); Frontier Research System, Institute of Physical and Chemical Research (Japan); Frankel, R.B. [Department of Physics, California Polytechnic State University, San Luis Obispo, CA 93407 (United States)]. E-mail: rfrankel@calpoly.edu

    2006-10-01

    Transmission electron microscopy, off-axis electron holography and energy-selected imaging were used to study the crystallography, morphology, and magnetic microstructure of nanoscale greigite (Fe{sub 3}S{sub 4}) magnetosomes in magnetotactic bacteria from a sulfidic habitat. The greigite magnetosomes were organized in chains, but were less ordered than magnetite magnetosomes in other bacteria. Nevertheless, the magnetosomes comprise a permanent magnetic dipole, sufficient for magnetotaxis.

  12. Understanding intention to use electronic information resources: A theoretical extension of the technology acceptance model (TAM).

    Science.gov (United States)

    Tao, Donghua

    2008-11-06

    This study extended the Technology Acceptance Model (TAM) by examining the roles of two aspects of e-resource characteristics, namely, information quality and system quality, in predicting public health students' intention to use e-resources for completing research paper assignments. Both focus groups and a questionnaire were used to collect data. Descriptive analysis, data screening, and Structural Equation Modeling (SEM) techniques were used for data analysis. The study found that perceived usefulness played a major role in determining students' intention to use e-resources. Perceived usefulness and perceived ease of use fully mediated the impact that information quality and system quality had on behavior intention. The research model enriches the existing technology acceptance literature by extending TAM. Representing two aspects of e-resource characteristics provides greater explanatory information for diagnosing problems of system design, development, and implementation.

  13. EuAu3Al2: Crystal and Electronic Structures and Spectroscopic, Magnetic, and Magnetocaloric Properties.

    Science.gov (United States)

    Schmiegel, Jan-Patrick; Block, Theresa; Gerke, Birgit; Fickenscher, Thomas; Touzani, Rachid St; Fokwa, Boniface P T; Janka, Oliver

    2016-09-06

    The intermetallic compound EuAu3Al2 has been prepared by reaction of the elements in tantalum ampules. The structure was refined from single-crystal data, indicating that the title compound crystallizes in the orthorhombic crystal system (a = 1310.36(4), b = 547.87(1), c = 681.26(2) pm) with space group Pnma (wR2 = 0.0266, 1038 F(2) values, 35 parameters) and is isostructural to SrAu3Al2 (LT-SrZn5 type). Full ordering of the gold and aluminum atoms was observed. Theoretical calculations confirm that the title compound can be described as a polar intermetallic phase containing a polyanionic [Au3Al2](δ-) network featuring interconnected strands of edge-sharing [AlAu4] tetrahedra. Magnetic measurements and (151)Eu Mössbauer spectroscopic investigations confirmed the divalent character of the europium atoms. Ferromagnetic ordering below TC = 16.5(1) K was observed. Heat capacity measurements showed a λ-type anomaly at T = 15.7(1) K, in line with the ordering temperature from the susceptibility measurements. The magnetocaloric properties of EuAu3Al2 were determined, and a magnetic entropy of ΔSM = -4.8 J kg(-1) K(-1) for a field change of 0 to 50 kOe was determined. Band structure calculations found that the f-bands of Eu present at the Fermi level of non-spin-polarized calculations are responsible for the ferromagnetic ordering in this phase, whereas COHP chemical bonding coupled with Bader charge analysis confirmed the description of the structure as covalently bonded polyanionic [Au3Al2](δ-) network interacting ionically with Eu(δ+).

  14. Soft x-ray free-electron laser imaging by LiF crystal and film detectors over a wide range of fluences.

    Science.gov (United States)

    Pikuz, Tatiana A; Faenov, Anatoly Ya; Fukuda, Yuji; Kando, Masaki; Bolton, Paul; Mitrofanov, Alexander; Vinogradov, Alexander V; Nagasono, Mitsuru; Ohashi, Haruhiko; Yabashi, Makina; Tono, Kensuke; Senba, Yasunori; Togashi, Tadashi; Ishikawa, Tetsuya

    2013-01-20

    LiF crystal and film detectors were used to measure the far-field fluence profile of a self-amplified spontaneous-emission free-electron laser beam and diffraction imaging with high spatial resolution. In these measurements the photoluminescence (PL) response of LiF crystal and film was compared over a wide range of soft x-ray fluences. It was found that the soft x-ray fluence dependences of LiF crystal and film differ. At low fluence, the LiF crystal shows higher PL response compared to LiF film, while this comparison is the opposite at higher fluence. Accurate measurement of LiF crystal and film PL response is important for precise characterization of the spatial, spectral, and coherence features of x-ray beams across the full profile and in localized areas. For such measurements, crucial LiF detector attributes are high spatial resolution and high dynamic range.

  15. Crystal and electronic structure of BiTeI, AuTeI, and PdTeI compounds: A dispersion-corrected density-functional study

    OpenAIRE

    Güler-Kılıç, Sümeyra; Kılıç, Çetin

    2015-01-01

    Semilocal and dispersion-corrected density-functional calculations have been performed to study the crystal structure, equation of state, and electronic structure of metal tellurohalides with chemical formula MeTeI where Me=Bi, Au, or Pd. A comparative investigation of the results of these calculations is conducted which reveals the role of van der Waals attraction. It is shown that the prediction of crystal structure of metal tellurohalides is systematically improved thanks to the inclusion ...

  16. Building and Managing Electronic Resources in Digital Era in India with Special Reference to IUCAA and NIV, Pune: A Comparative Case Study

    Science.gov (United States)

    Sahu, H. K.; Singh, S. N.

    2015-04-01

    This paper discusses and presents a comparative case study of two libraries in Pune, India, Inter-University Centre for Astronomy and Astrophysics and Information Centre and Library of National Institute of Virology (Indian Council of Medical Research). It compares how both libraries have managed their e-resource collections, including acquisitions, subscriptions, and consortia arrangements, while also developing a collection of their own resources, including pre-prints and publications, video lectures, and other materials in an institutional repository. This study illustrates how difficult it is to manage electronic resources in a developing country like India, even though electronic resources are used more than print resources. Electronic resource management can be daunting, but with a systematic approach, various problems can be solved, and use of the materials will be enhanced.

  17. Electronic Properties of Red P-Type Tl2S5 Single Crystals

    Institute of Scientific and Technical Information of China (English)

    G. A. Gamal; M. Abou Zied; A. A. Ebnalwaled

    2005-01-01

    @@ Single crystals of red Tl2S5 were prepared by a special modified vertical Bridgman and Stockbarger technique.This growth was performed in our laboratory. The influences of temperature on the electrical conductivity, Hall mobility, carrier concentration, and thermoelectric power (TEP) were carried out in the temperature range 277-413 K. Throughout these measurements, various physical parameters such as effective mass of charge carriers,carrier mobility, diffusion coefficient, and the relaxation time for both majority and minority carriers were found.

  18. Facile synthesis of tin phosphite nanosheets via exfoliated bulk crystals: Electronic structure and piezoelectric property.

    Science.gov (United States)

    Song, Jun-Ling; Zhang, Xi-Rui; Lu, Rui-Feng

    2016-08-01

    Tin phosphite nanosheets were synthesized by a facile exfoliation method. SnHPO3 nanosheets with a thickness of ∼2.6nm readily form a stable colloidal suspension in ethanol using ultrasonic method. Structures and optical properties of the obtained nanosheets were investigated. The prepared SnHPO3 nanosheets exhibit an obvious blue-shift in UV absorbance compared with bulk SnHPO3 crystal materials. Moreover, the piezoelectric coefficients of SnHPO3 monolayer were calculated based on density functional theory, which are larger than that of h-BN monolayer, indicating this material could be a good candidate for designing electro-optical nano-devices.

  19. Print and Electronic Resources: Usage Statistics at Guru Gobind Singh Indraprastha University Library

    Science.gov (United States)

    Kapoor, Kanta

    2010-01-01

    Purpose: The purpose of this paper is to quantify the use of electronic journals in comparison with the print collections in the Guru Gobind Singh Indraprastha University Library. Design/methodology/approach: A detailed analysis was made of the use of lending services, the Xerox facility and usage of electronic journals such as Science Direct,…

  20. Print and Electronic Resources: Usage Statistics at Guru Gobind Singh Indraprastha University Library

    Science.gov (United States)

    Kapoor, Kanta

    2010-01-01

    Purpose: The purpose of this paper is to quantify the use of electronic journals in comparison with the print collections in the Guru Gobind Singh Indraprastha University Library. Design/methodology/approach: A detailed analysis was made of the use of lending services, the Xerox facility and usage of electronic journals such as Science Direct,…

  1. STUDIES ON PRIMARY CRYSTALLIZATION OF RAPIDLY QUENCHED Al-Ni-Cu-Nd METALLIC GLASS BY USING HIGH RESOLUTION TRASMISSION ELECTRON MICROSCOPY

    Institute of Scientific and Technical Information of China (English)

    Y.D. Xiao; W.X. Li; D. Jacovkis; N. Clavaguera; M.T. Clavaguera-Mora; J. Rodriguez- Viejo

    2003-01-01

    Rapidly solidified Al87Ni7Cu3Nd3 metallic glasses, prepared by using melt spinning,were treated under both isothermal and non-isothermal regime. The amorphous ribbon and the annealed samples were closely examined by means of differential scanning calorimetric, conventional X-ray diffraction and high resolution transmission electron microscopy with selected-area electron diffraction, with special interest in primary crystallization into α-Al nanocrystalline particles, in order to understand structural characteristics of Al-based amorphous/nanocrystalline alloys, and nucleation and grain growth mechanism on the nanometer scale during primary crystallization.The results show that, the as-prepared ribbons are fully amorphous and homogeneous in the micron scale, but contain high density of quenched-in clusters or crystallite embryos. Primary crystallization mainly leads to formation of two-phase mixture of α-Al crystal and residual amorphous phase. The annealed ribbons exposed isothermally at 110℃f or 5, 130 minutes and heated continuously up to less than 310℃ at 40℃/min consist of large amount of α-Al fcc crystal nanoparticles dispersed uniformly in an amorphous matrix. However, a very little amount of finer orthorhombie Al3Ni intermetalics particles exist in the annealed ribbons heated up to 310℃. During primary crystallization, the leading kinetic mechanics to impede growth of the α-Al crystal is soft impingement, instead of geometrie impingement.

  2. Electron irradiation effects on 4-amino-5-mercapto- 3-[1-(4-isobutylphenyl)ethyl]-1,2,4-triazole single crystal

    Indian Academy of Sciences (India)

    Vijayalakshmi Rao; K Naseema

    2010-09-01

    In this paper, we report the electron irradiation effects on the properties of an organic NLO single crystal of 4-amino-5-mercapto-3-[1-(4-isobutylphenyl)ethyl]-1,2,4-triazole. The crystal was irradiated with electron beam of different doses and was characterized by powder XRD, UV–Vis, FTIR, DSC, microhardness and SHG measurements. In XRD, the peaks are shifted due to irradiation. The SHG efficiency has been found to enhance rapidly with irradiation. The investigation of the influence of electron irradiation on the surface morphology of the grown crystal reveals the formation of craters on the surface. The laser damage threshold remains constant as the dose rate increases whereas refractive index increases after irradiation.

  3. Ionization Energies, Electron Affinities, and Polarization Energies of Organic Molecular Crystals: Quantitative Estimations from a Polarizable Continuum Model (PCM)–Tuned Range-Separated Density Functional Approach

    KAUST Repository

    Sun, Haitao

    2016-05-16

    We propose a new methodology for the first-principles description of the electronic properties relevant for charge transport in organic molecular crystals. This methodology, which is based on the combination of a non-empirical, optimally tuned range-separated hybrid functional with the polarizable continuum model, is applied to a series of eight representative molecular semiconductor crystals. We show that it provides ionization energies, electron affinities, and transport gaps in very good agreement with experimental values as well as with the results of many-body perturbation theory within the GW approximation at a fraction of the computational costs. Hence, this approach represents an easily applicable and computationally efficient tool to estimate the gas-to-crystal-phase shifts of the frontier-orbital quasiparticle energies in organic electronic materials.

  4. An electron spin double resonance study of x-ray irradiated phenacyl chloride single crystals

    Science.gov (United States)

    Hwang, J. S.; Wang, H. C.; Andersson, B.; Kispert, L. D.; Geoffroy, M.

    1981-10-01

    Single crystals of phenacyl chloride irradiated at room temperature give rise to an EPR spectrum that has been shown by ENDOR and ELDOR studies to be due to the radical The EPR spectra are complicated by the appearance of a large number of forbidden lines due to the presence of a chlorine quadrupole interaction similar in magnitude to the proton hyperfine coupling. Spectral assignment is not possible by considering the EPR spectra alone. Although ENDOR spectra are difficult to obtain, it is possible to obtain an ENDOR spectrum along one of the crystal axis that identifies the spectra as due to radical I. Furthermore, rather intense and highly resolved ELDOR spectra are obtained at -60 °C as a function of angle enabling the chlorine and proton magnetic hyperfine tensor components of the -ĊHCl fragment to be determined as -15.4, -8.3, +45.6 MHz and -26.5, -52.5, -80.0 MHz, respectively. The Qzz components of the chlorine quadrupole tensor is -11.2 MHz.

  5. Impurities and Electronic Property Variations of Natural MoS 2 Crystal Surfaces

    KAUST Repository

    Addou, Rafik

    2015-09-22

    Room temperature X-ray photoelectron spectroscopy (XPS), inductively coupled plasma mass spectrometry (ICPMS), high resolution Rutherford backscattering spectrometry (HR-RBS), Kelvin probe method, and scanning tunneling microscopy (STM) are employed to study the properties of a freshly exfoliated surface of geological MoS2 crystals. Our findings reveal that the semiconductor 2H-MoS2 exhibits both n- and p-type behavior, and the work function as measured by the Kelvin probe is found to vary from 4.4 to 5.3 eV. The presence of impurities in parts-per-million (ppm) and a surface defect density of up to 8% of the total area could explain the variation of the Fermi level position. High resolution RBS data also show a large variation in the MoSx composition (1.8 < x < 2.05) at the surface. Thus, the variation in the conductivity, the work function, and stoichiometry across small areas of MoS2 will have to be controlled during crystal growth in order to provide high quality uniform materials for future device fabrication. © 2015 American Chemical Society.

  6. Interstitial-related defect reactions in electron-irradiated oxygen-rich Ge crystals: A DLTS study

    Science.gov (United States)

    Markevich, V. P.; Peaker, A. R.; Lastovskii, S. B.; Murin, L. I.; Litvinov, V. V.; Emtsev, V. V.; Dobaczewski, L.

    2009-12-01

    Electrically active defects induced in oxygen-rich Ge:Sb crystals by irradiation with MeV electrons at 80 or 300 K have been studied by means of capacitance transient techniques. Transformations of the defects upon post-irradiation isochronal anneals have also been investigated. It is argued that a radiation-induced electron trap with an energy level at about 110 meV below the conduction band edge (E110) can be associated with electron emission from an energy level of the Ge self-interstitial (IGe). The E110 trap is eliminated in the temperature range 150-200 K upon 15 min isochronal annealing. No other traps in the upper half of the gap emerge simultaneously with the disappearance of the E110 trap. It is argued that Ge self-interstitials become mobile at temperatures higher than 150 K and in oxygen-rich Ge interact with interstitial oxygen atoms (Oi). The resulting IGeOi complexes do not have energy levels in the upper half of the Ge gap. Diffusion and interaction of the IGeOi defects with interstitial oxygen atoms at T>50 °C result in the formation of IGeO2i complexes. In the most stable configuration the IGeO2i complex has orthorhombic (C2v) symmetry.

  7. Interstitial-related defect reactions in electron-irradiated oxygen-rich Ge crystals: A DLTS study

    Energy Technology Data Exchange (ETDEWEB)

    Markevich, V.P., E-mail: V.Markevich@manchester.ac.u [School of Electrical and Electronic Engineering, University of Manchester, Sackville Str. Building, Manchester, M60 1QD (United Kingdom); Peaker, A.R. [School of Electrical and Electronic Engineering, University of Manchester, Sackville Str. Building, Manchester, M60 1QD (United Kingdom); Lastovskii, S.B.; Murin, L.I. [Scientific-Practical Materials Research Center of NAS of Belarus, Minsk 220072 (Belarus); Litvinov, V.V. [Belarusian State University, Minsk 220050 (Belarus); Emtsev, V.V. [Ioffe Physico-Technical Institute, St. Petersburg 194021 (Russian Federation); Dobaczewski, L. [Institute of Physics, Polish Academy of Sciences, 02-668 Warsaw (Poland)

    2009-12-15

    Electrically active defects induced in oxygen-rich Ge:Sb crystals by irradiation with MeV electrons at 80 or 300 K have been studied by means of capacitance transient techniques. Transformations of the defects upon post-irradiation isochronal anneals have also been investigated. It is argued that a radiation-induced electron trap with an energy level at about 110 meV below the conduction band edge (E{sub 110}) can be associated with electron emission from an energy level of the Ge self-interstitial (I{sub Ge}). The E{sub 110} trap is eliminated in the temperature range 150-200 K upon 15 min isochronal annealing. No other traps in the upper half of the gap emerge simultaneously with the disappearance of the E{sub 110} trap. It is argued that Ge self-interstitials become mobile at temperatures higher than 150 K and in oxygen-rich Ge interact with interstitial oxygen atoms (O{sub i}). The resulting I{sub Ge}O{sub i} complexes do not have energy levels in the upper half of the Ge gap. Diffusion and interaction of the I{sub Ge}O{sub i} defects with interstitial oxygen atoms at T>50 deg. C result in the formation of I{sub Ge}O{sub 2i} complexes. In the most stable configuration the I{sub Ge}O{sub 2i} complex has orthorhombic (C{sub 2v}) symmetry.

  8. Crystal structure and electronic properties of a thiolate-protected Au24 nanocluster

    Science.gov (United States)

    Das, Anindita; Li, Tao; Li, Gao; Nobusada, Katsuyuki; Zeng, Chenjie; Rosi, Nathaniel L.; Jin, Rongchao

    2014-05-01

    Solving the total structures of gold nanoclusters is of critical importance for understanding their electronic, optical and catalytic properties. Herein, we report the X-ray structure of a charge-neutral Au24(SCH2Ph-tBu)20 nanocluster. This structure features a bi-tetrahedral Au8 kernel protected by four tetrameric staple-like motifs. Electronic structure analysis is further carried out and the optical absorption spectrum is interpreted. The Au24(SCH2Ph-tBu)20, Au23(S-c-C6H11)16 and Au25(SCH2CH2Ph)18 nanoclusters constitute the first crystallographically characterized ``trio''.Solving the total structures of gold nanoclusters is of critical importance for understanding their electronic, optical and catalytic properties. Herein, we report the X-ray structure of a charge-neutral Au24(SCH2Ph-tBu)20 nanocluster. This structure features a bi-tetrahedral Au8 kernel protected by four tetrameric staple-like motifs. Electronic structure analysis is further carried out and the optical absorption spectrum is interpreted. The Au24(SCH2Ph-tBu)20, Au23(S-c-C6H11)16 and Au25(SCH2CH2Ph)18 nanoclusters constitute the first crystallographically characterized ``trio''. Electronic supplementary information (ESI) available: Experimental and supporting Fig. S1-S3. CCDC NUMBER(1000102). For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c4nr01350f

  9. Mechanism of red-luminescence flash in CdS single crystals irradiated by electrons

    Energy Technology Data Exchange (ETDEWEB)

    Bogdanyuk, N.S.; Galushka, A.P.; Ostapenko, S.S.; Shejnkman, M.K. (AN Ukrainskoj SSR, Kiev. Inst. Poluprovodnikov)

    1984-02-01

    Results of investigations into ''red''-luminescence flash (lambdasub(x)=720 nm) in cadmium sulfide, irradiated by electrons at 77 K, are presented. Measurement of spectra of stationary photoluminescence and its excitation, as well as flash luminescence, its pumping and stimulation along with temperature flash dependences enabled to suggest a new mechanism of optical luminescence stimulation, based on the model of complex center of flash luminescense. The mechanism consists in modulation of probabilities of intercenter electron transitions, when charge state of one of components of the complex center changes.

  10. The density functional study of electronic structure, electronic charge density, linear and nonlinear optical properties of single crystal alpha-LiAlTe{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Reshak, A.H. [New Technologies-Research Center, University of West Bohemia, Univerzitni 8, 306 14 Pilsen (Czech Republic); Center of Excellence Geopolymer and Green Technology, School of Material Engineering, University Malaysia Perlis, 01007 Kangar, Perlis (Malaysia); Khan, Wilayat, E-mail: walayat76@gmail.com [New Technologies-Research Center, University of West Bohemia, Univerzitni 8, 306 14 Pilsen (Czech Republic)

    2014-04-01

    Highlights: • FP-LAPW technique is used for calculating the electronic structure. • The band structure shows that the calculated compound is semiconductor. • The complex dielectric function has been calculated. • Nonlinear optical properties has also been calculated. • This compound can be used for molecular engineering of the crystals. - Abstract: Self-consistent calculations is performed using the full potential linear augmented plane wave (FP-LAPW) technique based on density functional theory (DFT) to investigate the electronic band structure, density of states, electronic charge density, linear and non-linear optical properties of α-LiAlTe{sub 2} compound having tetragonal symmetry with space group I4{sup ¯}2d. The electronic structure are calculated using the Ceperley Alder local density approach (CA-LDA), Perdew Burke and Ernzerhof generalize gradient approach (PBE-GGA), Engel–Vosko generalize gradient approach (EVGGA) and modified Becke Johnson approach (mBJ). Band structure calculations of (α-LiAlTe{sub 2}) depict semiconducting nature with direct band gap of 2.35 eV (LDA), 2.48 eV (GGA), 3.05 eV (EVGGA) and 3.13 eV (mBJ), which is comparable to experimental value. The calculated electronic charge density show ionic interaction between Te and Li atoms and polar covalent interaction between Al and Te atoms. Some optical susceptibilities like dielectric constants, refractive index, extension co-efficient, reflectivity and energy loss function have been calculated and analyzed on the basis of electronic structure. The compound α-LiAlTe{sub 2} provides a considerable negative value of birefringence of −0.01. Any anisotropy observed in the linear optical properties which are in favor to enhance the nonlinear optical properties. The symbol χ{sub abc}{sup (2)}(ω) represents the second order nonlinear optical susceptibilities, possess six non-zero components in this symmetry (tetragonal), called: 1 2 3, 2 1 3, 2 3 1, 1 3 2, 3 1 2 and 3 2 1

  11. Intention to use and actual use of electronic information resources: further exploring Technology Acceptance Model (TAM).

    Science.gov (United States)

    Tao, Donghua

    2009-11-14

    Following up a previous study that examined public health students' intention to use e-resources for completing research paper assignments, the present study proposed two models to investigate whether or not public health students actually used the e-resources they intended to use and whether or not the determinants of intention to use predict actual use of e-resources. Focus groups and pre- and post-questionnaires were used to collect data. Descriptive analysis, data screening, and Structural Equation Modeling (SEM) techniques were used for data analysis. The study found that the determinants of intention-to-use significantly predict actual use behavior. Direct impact of perceived usefulness and indirect impact of perceived ease of use to both behavior intention and actual behavior indicated the importance of ease of use at the early stage of technology acceptance. Non-significant intention-behavior relationship prompted thoughts on the measurement of actual behavior and multidimensional characteristics of the intention construct.

  12. Models for Copper Dynamic Behavior in Doped Cadmium dl-Histidine Crystals: Electron Paramagnetic Resonance and Crystallographic Analysis.

    Science.gov (United States)

    Colaneri, Michael J; Teat, Simon J; Vitali, Jacqueline

    2015-11-12

    Electron paramagnetic resonance and crystallographic studies of copper-doped cadmium dl-histidine, abbreviated as CdDLHis, were undertaken to gain further understanding on the relationship between site structure and dynamic behavior in biological model complexes. X-ray diffraction measurements determined the crystal structure of CdDLHis at 100 and 298 K. CdDLHis crystallizes in the monoclinic space group P21/c with two cadmium complexes per asymmetric unit. In each complex, the Cd is hexacoordinated to two histidine molecules. Both histidines are l in one complex and d in the other. Additionally, each complex contains multiple waters of varying disorder. Single crystal EPR spectroscopic splitting (g) and copper hyperfine (A(Cu)) tensors at room temperature (principal values: g = 2.249, 2.089, 2.050; A(Cu) = -453, -30.5, -0.08 MHz) were determined from rotational experiments. Alignments of the tensor directions with the host structure were used to position the copper unpaired dx(2)-y(2) orbital in an approximate plane made by four proposed ligand atoms: the N-imidazole and N-amino of one histidine, and the N-amino and O-carboxyl of the other. Each complex has two such planes related by noncrystallographic symmetry, which make an angle of 65° and have a 1.56 Å distance between their midpoints. These findings are consistent with three interpretations that can adequately explain previous temperature-dependent EPR powder spectra of this system: (1) a local structural distortion (static strain) at the copper site has a temperature dependence significant enough to affect the EPR pattern, (2) the copper can hop between the two sites in each complex at high temperature, and (3) there exists a dynamic Jahn-Teller effect involving the copper ligands.

  13. Calibration of the OHREX high-resolution imaging crystal spectrometer at the Livermore electron beam ion traps

    Science.gov (United States)

    Hell, N.; Beiersdorfer, P.; Magee, E. W.; Brown, G. V.

    2016-11-01

    We report the calibration of the Orion High-Resolution X-ray (OHREX) imaging crystal spectrometer at the EBIT-I electron beam ion trap at Livermore. Two such instruments, dubbed OHREX-1 and OHREX-2, are fielded for plasma diagnostics at the Orion laser facility in the United Kingdom. The OHREX spectrometer can simultaneously house two spherically bent crystals with a radius of curvature of r = 67.2 cm. The focusing properties of the spectrometer allow both for larger distance to the source due to the increase in collected light and for observation of extended sources. OHREX is designed to cover a 2.5°-3° spectral range at Bragg angles around 51.3°. The typically high resolving powers at these large Bragg angles are ideally suited for line shape diagnostics. For instance, the nominal resolving power of the instrument (>10 000) is much higher than the effective resolving power associated with the Doppler broadening due to the temperature of the trapped ions in EBIT-I. The effective resolving power is only around 3000 at typical EBIT-I conditions, which nevertheless is sufficient to set up and test the instrument's spectral characteristics. We have calibrated the spectral range for a number of crystals using well known reference lines in the first and second order and derived the ion temperatures from these lines. We have also made use of the 50 μm size of the EBIT-I source width to characterize the spatial focusing of the spectrometer.

  14. Calibration of the OHREX high-resolution imaging crystal spectrometer at the Livermore electron beam ion traps

    Energy Technology Data Exchange (ETDEWEB)

    Hell, N. [Lawrence Livermore National Laboratory, Livermore, California 94550 (United States); Dr. Remeis-Sternwarte and ECAP, Universität Erlangen-Nürnberg, Bamberg 96049 (Germany); Beiersdorfer, P.; Magee, E. W.; Brown, G. V. [Lawrence Livermore National Laboratory, Livermore, California 94550 (United States)

    2016-11-15

    We report the calibration of the Orion High-Resolution X-ray (OHREX) imaging crystal spectrometer at the EBIT-I electron beam ion trap at Livermore. Two such instruments, dubbed OHREX-1 and OHREX-2, are fielded for plasma diagnostics at the Orion laser facility in the United Kingdom. The OHREX spectrometer can simultaneously house two spherically bent crystals with a radius of curvature of r = 67.2 cm. The focusing properties of the spectrometer allow both for larger distance to the source due to the increase in collected light and for observation of extended sources. OHREX is designed to cover a 2.5°–3° spectral range at Bragg angles around 51.3°. The typically high resolving powers at these large Bragg angles are ideally suited for line shape diagnostics. For instance, the nominal resolving power of the instrument (>10 000) is much higher than the effective resolving power associated with the Doppler broadening due to the temperature of the trapped ions in EBIT-I. The effective resolving power is only around 3000 at typical EBIT-I conditions, which nevertheless is sufficient to set up and test the instrument’s spectral characteristics. We have calibrated the spectral range for a number of crystals using well known reference lines in the first and second order and derived the ion temperatures from these lines. We have also made use of the 50 μm size of the EBIT-I source width to characterize the spatial focusing of the spectrometer.

  15. Insights into the crystal chemistry of Earth materials rendered by electron density distributions: Pauling's rules revisited

    Energy Technology Data Exchange (ETDEWEB)

    Gibbs, Gerald V.; Ross, Nancy L.; Cox, David F.; Rosso, Kevin M.

    2014-05-20

    Pauling's first two rules are examined in terms of the accumulation of the electron density between bonded pairs of atoms for a relatively large number of oxide and silicate crystals and siloxane molecules. The distribution of the electron density shows that the radius of the oxygen atom is not fixed, but that it actually decreases systematically from ~1.40 Å to ~ 0.65 Å as the polarizing power and the electronegativity of the bonded metal atoms increase and the distribution of the O atom is progressively polarized and contracted along the bond vectors by the impact of the bonded interactions. The contractions result in an aspherical oxygen atom that displays as many different bonded “radii” as it has bonded interactions. The bonded radii for the metal atoms match the Shannon and Prewitt ionic radii for the more electropositive atoms like potassium and sodium, but they are systematically larger for the more electronegative atoms like aluminum, silicon and phosphorous. Pauling's first rule is based on the assumption that the radius of the oxide anion is fixed and that the radii of the cations are such that radius sum of the spherical oxide anion and a cation necessarily equals the separation between the cation-anion bonded pair with the coordination number of the cation being determined by the ratio of the radii of the cation and anion. In the case of the bonded radii, the sum of the bonded radii for the metal atoms and the oxide anion necessarily equals the bond lengths by virtue of the way that the bonded radii were determined in the partitioning of the electron density along the bond path into metal and O atom parts. But, the radius ratio for the O and M atoms is an unsatisfactory rule for determining the coordination number of the metal atom inasmuch as a bonded O atom is not, in general, spherical, and its size varies substantially along its bonded directions. But by counting the number of bond paths that radiate from a bonded atom, the

  16. Coherent bremsstrahlung and channeling radiation from 40 and 150 GeV electrons and positrons traversing Si and diamond single crystals near planar directions

    Energy Technology Data Exchange (ETDEWEB)

    Medenwaldt, R.; Moeller, S.P.; Soerensen, A.H.; Uggerhoej, E. (Aarhus Univ. (Denmark). Inst. for Synchrotron Radiation); Elsener, K. (European Organization for Nuclear Research, Geneva (Switzerland)); Hage-Ali, M.; Siffert, P.; Stoquert, J. (Strasbourg-1 Univ., 67 (France). Centre de Recherches Nucleaires); Sona, P. (Florence Univ. (Italy). Dipt. di Fisica Istituto Nazionale di Fisica Nucleare, Florence (Italy))

    1991-05-09

    Along planar directions in both Si and C single crystals the radiation yields from 150GeV electrons are enhanced 40 times or more and the data present the first use of C crystals in the multi-hundred GeV region. For channeled electrons in Si the experimental results agree with calculations using the constant field approximation (CFA). Increasing incident angles reduce rapidly soft photon yields as expected from first order corrections to CFA. The first Born approximation only describes experimental results for large incident angles to planes. (orig.).

  17. Coherent bremsstrahlung and channeling radiation from 40 and 150 GeV electrons and positrons traversing Si and diamond single crystals near planar directions

    Science.gov (United States)

    Medenwaldt, R.; Møller, S. P.; Sørensen, A. H.; Uggerhøj, E.; Elsener, K.; Hage-Ali, M.; Siffert, P.; Stoquert, J.; Sona, P.

    1991-05-01

    Along planar directions in both Si and C single crystals the radiation yields from 150 GeV electrons are enhanced 40 times or more and the data present the first use of C crystals in the multi-hundred GeV region. For channeled electrons in Si the experimental results agree with calculations using the constant field approximation (CFA). Increasing incident angles reduce rapidly soft photon yields as expected from first order corrections to CFA. The first born approximation only describes experimental results for large incident angles to planes.

  18. Electron diffraction study of {alpha}-AlMnSi crystals including non-crystallographic axes

    Energy Technology Data Exchange (ETDEWEB)

    Song, G.L.; Bursill, L.A.

    1997-06-01

    The structure of crystalline {alpha}-AlMnSi is examined by electron diffraction. Six distinct zone axes are examined, including both normal crystallographic and non-crystallographic zones axes, allowing the space group symmetry to be studied. Electron diffraction patterns characteristic of Pm3-bar were obtained for thicker specimens. However, for very thin specimens, as used for HRTEM imaging, the electron diffraction patterns were characteristic of Im3-bar space group symmetry. The structural basis of the Pm3-bar to Im3-bar transformation may be understood in terms of an analysis of the icosahedral structural elements located at the corners and body-centers of the cubic unit cell. A method for indexing the non-crystallographic zone axis diffraction patterns is described. An electron diffraction pattern of the 5-fold axis of the quasicrystalline phase i-AlMnSi is also included; this is compared with the experimental results and calculations for the [0{tau}1] axis of Pm3-bar and Im3-bar crystalline phases. 26 refs., 4 tabs., 7 figs.

  19. Electronic and atomic structures of the Sr3Ir4Sn13 single crystal: A possible charge density wave material

    Science.gov (United States)

    Wang, H.-T.; Srivastava, M. K.; Wu, C.-C.; Hsieh, S.-H.; Wang, Y.-F.; Shao, Y.-C.; Liang, Y.-H.; Du, C.-H.; Chiou, J.-W.; Cheng, C.-M.; Chen, J.-L.; Pao, C.-W.; Lee, J.-F.; Kuo, C. N.; Lue, C. S.; Wu, M.-K.; Pong, W.-F.

    2017-01-01

    X-ray scattering (XRS), x-ray absorption near-edge structure (XANES) and extended x-ray absorption fine structure (EXAFS) spectroscopic techniques were used to study the electronic and atomic structures of the high-quality Sr3Ir4Sn13 (SIS) single crystal below and above the transition temperature (T* ≈ 147 K). The evolution of a series of modulated satellite peaks below the transition temperature in the XRS experiment indicated the formation of a possible charge density wave (CDW) in the (110) plane. The EXAFS phase derivative analysis supports the CDW-like formation by revealing different bond distances [Sn1(2)-Sn2] below and above T* in the (110) plane. XANES spectra at the Ir L3-edge and Sn K-edge demonstrated an increase (decrease) in the unoccupied (occupied) density of Ir 5d-derived states and a nearly constant density of Sn 5p-derived states at temperatures T atomic structures and the CDW-like phase in the SIS single crystal. PMID:28106144

  20. Laboratory Investigation of the Growth and Crystal Structure of Nitric Acid Hydrates by Transmission Electron Microscopy (TEM)

    Science.gov (United States)

    Blake, David F.; Chang, Sherwood (Technical Monitor)

    1994-01-01

    A great deal of recent laboratory work has focussed on the characterization of the nitric acid hydrates, thought to be present in type I Polar Stratospheric Clouds (PSCs). Phase relationships and vapor pressure measurements (1-3) and infrared characterizations (4-5) have been made. However, the observed properties of crystalline solids (composition, melting point, vapor pressure, surface reactivity, thermodynamic stability, extent of solid solution with other components, etc.) are controlled by their crystal structure. The only means of unequivocal structural identification for crystalline solids is diffraction (using electrons, X-rays, neutrons, etc.). Other observed properties of crystalline solids, such as their infrared spectra, their vapor pressure as a function of temperature, etc. yield only indirect information about what phases are present, their relative proportions, or whether they are crystalline or amorphous.

  1. Electron Spin Resonance Study of Organic Interfaces in Ion Gel-Gated Rubrene Single-Crystal Transistors

    Science.gov (United States)

    Takahashi, Yuki; Tsuji, Masaki; Yomogida, Yohei; Takenobu, Taishi; Iwasa, Yoshihiro; Marumoto, Kazuhiro

    2013-04-01

    Organic interfaces of rubrene single crystals (RSCs) in ion gel-gated electric double-layer transistors (EDLTs) were investigated by electron spin resonance (ESR). The EDLTs were fabricated by laminating ion-gel films onto RSCs. Clear ESR signals due to field-injected holes in RSCs were successfully observed at low gate voltages, showing a high spin concentration due to the high capacitance of EDLTs. The analyses of anisotropic ESR signals and its gate-voltage dependence show that the bulk molecular orientation at RSCs' interfaces is preserved without forming deep trapping levels, which demonstrate that organic interfaces in RSC-EDLTs are clean and undamaged under a strong electric field in EDLTs.

  2. Development of a mass sensitive quartz crystal microbalance (QCM)-based DNA biosensor using a 50 MHz electronic oscillator circuit.

    Science.gov (United States)

    García-Martinez, Gonzalo; Bustabad, Enrique Alonso; Perrot, Hubert; Gabrielli, Claude; Bucur, Bogdan; Lazerges, Mathieu; Rose, Daniel; Rodriguez-Pardo, Loreto; Fariña, Jose; Compère, Chantal; Vives, Antonio Arnau

    2011-01-01

    This work deals with the design of a high sensitivity DNA sequence detector using a 50 MHz quartz crystal microbalance (QCM) electronic oscillator circuit. The oscillator circuitry is based on Miller topology, which is able to work in damping media. Calibration and experimental study of frequency noise are carried out, finding that the designed sensor has a resolution of 7.1 ng/cm(2) in dynamic conditions (with circulation of liquid). Then the oscillator is proved as DNA biosensor. Results show that the system is able to detect the presence of complementary target DNAs in a solution with high selectivity and sensitivity. DNA target concentrations higher of 50 ng/mL can be detected.

  3. Development of a Mass Sensitive Quartz Crystal Microbalance (QCM-Based DNA Biosensor Using a 50 MHz Electronic Oscillator Circuit

    Directory of Open Access Journals (Sweden)

    Claude Gabrielli

    2011-08-01

    Full Text Available This work deals with the design of a high sensitivity DNA sequence detector using a 50 MHz quartz crystal microbalance (QCM electronic oscillator circuit. The oscillator circuitry is based on Miller topology, which is able to work in damping media. Calibration and experimental study of frequency noise are carried out, finding that the designed sensor has a resolution of 7.1 ng/cm2 in dynamic conditions (with circulation of liquid. Then the oscillator is proved as DNA biosensor. Results show that the system is able to detect the presence of complementary target DNAs in a solution with high selectivity and sensitivity. DNA target concentrations higher of 50 ng/mL can be detected.

  4. Crystal structure of Au₂₅(SePh)₁₈ nanoclusters and insights into their electronic, optical and catalytic properties.

    Science.gov (United States)

    Song, Yongbo; Zhong, Juan; Yang, Sha; Wang, Shuxin; Cao, Tiantian; Zhang, Jun; Li, Peng; Hu, Daqiao; Pei, Yong; Zhu, Manzhou

    2014-11-21

    The crystal structure of selenolate-capped Au25(SePh)18(-) nanoclusters has been unambiguously determined for the first time, and provides a solid basis for a deeper understanding of the structure-property relationships. The selenolate-capped Au25 cluster shows noticeable differences from the previously reported Au25(SCH2CH2Ph)18(-) counterpart, albeit both share the icosahedral Au13 core and semi-ring Au2(SeR)3 or Au2(SR)3 motifs. Distinct differences in the electronic structure and optical, catalytic and electrochemical properties are revealed by the coupling experiments with density functional theory (TD-DFT) calculations. Overall, the successful determination of the Au25(SePh)18(-) structure removes any ambiguity about its structure, and comparison with the thiolated Au25 counterpart helps us to further understand how the ligands affect the properties of the nanocluster.

  5. In-Plane Electronic Anisotropy of Underdoped ___122___ Fe-Arsenide Superconductors Revealed by Measurements of Detwinned Single Crystals

    Energy Technology Data Exchange (ETDEWEB)

    Fisher, Ian Randal

    2012-05-08

    The parent phases of the Fe-arsenide superconductors harbor an antiferromagnetic ground state. Significantly, the Neel transition is either preceded or accompanied by a structural transition that breaks the four fold symmetry of the high-temperature lattice. Borrowing language from the field of soft condensed matter physics, this broken discrete rotational symmetry is widely referred to as an Ising nematic phase transition. Understanding the origin of this effect is a key component of a complete theoretical description of the occurrence of superconductivity in this family of compounds, motivating both theoretical and experimental investigation of the nematic transition and the associated in-plane anisotropy. Here we review recent experimental progress in determining the intrinsic in-plane electronic anisotropy as revealed by resistivity, reflectivity and ARPES measurements of detwinned single crystals of underdoped Fe arsenide superconductors in the '122' family of compounds.

  6. Multi-Beam Interference Advances and Applications: Nano-Electronics, Photonic Crystals, Metamaterials, Subwavelength Structures, Optical Trapping, and Biomedical Structures

    Directory of Open Access Journals (Sweden)

    Thomas K. Gaylord

    2011-06-01

    Full Text Available Research in recent years has greatly advanced the understanding and capabilities of multi-beam interference (MBI. With this technology it is now possible to generate a wide range of one-, two-, and three-dimensional periodic optical-intensity distributions at the micro- and nano-scale over a large length/area/volume. These patterns may be used directly or recorded in photo-sensitive materials using multi-beam interference lithography (MBIL to accomplish subwavelength patterning. Advances in MBI and MBIL and a very wide range of applications areas including nano-electronics, photonic crystals, metamaterials, subwavelength structures, optical trapping, and biomedical structures are reviewed and put into a unified perspective.

  7. Molecular, crystal, and electronic structure of the cobalt(II) complex with 10-(2-benzothiazolylazo)-9-phenanthrol

    Energy Technology Data Exchange (ETDEWEB)

    Linko, R. V., E-mail: rlinko@mail.ru [Peoples' Friendship University of Russia (Russian Federation); Sokol, V. I. [Russian Academy of Sciences, Kurnakov Institute of General and Inorganic Chemistry (Russian Federation); Polyanskaya, N. A.; Ryabov, M. A.; Strashnov, P. V.; Davydov, V. V. [Peoples' Friendship University of Russia (Russian Federation); Sergienko, V. S. [Russian Academy of Sciences, Kurnakov Institute of General and Inorganic Chemistry (Russian Federation)

    2013-05-15

    The reaction of 10-(2-benzothiazolylazo)-9-phenanthrol (HL) with cobalt(II) acetate gives the coordination compound [CoL{sub 2}] {center_dot} CHCl{sub 3} (I). The molecular and crystal structure of I is determined by X-ray diffraction. The coordination polyhedron of the Co atom in complex I is an octahedron. The anion L acts as a tridentate chelating ligand and is coordinated to the Co atom through the phenanthrenequinone O1 atom and the benzothiazole N1 atom of the moieties L and the N3 atom of the azo group to form two five-membered metallocycles. The molecular and electronic structures of the compounds HL, L, and CoL{sub 2} are studied at the density functional theory level. The results of the quantum-chemical calculations are in good agreement with the values determined by X-ray diffraction.

  8. Numerical design of SiC bulk crystal growth for electronic applications

    Science.gov (United States)

    Wejrzanowski, T.; Grybczuk, M.; Tymicki, E.; Kurzydlowski, K. J.

    2014-10-01

    Presented study concerns numerical simulation of Physical Vapor Transport (PVT) growth of bulk Silicon Carbide (SiC) crystals. Silicon Carbide is a wide band gap semiconductor, with numerous applications due to its unique properties. Wider application of SiC is limited by high price and insufficient quality of the product. Those problems can be overcame by optimizing SiC production methods. Experimental optimization of SiC production is expensive because it is time consuming and requires large amounts of energy. Numerical modeling allows to learn more about conditions inside the reactor and helps to optimize the process at much lower cost. In this study several simulations of processes with different reactor geometries were presented along with discussion of reactor geometry influence on obtained monocrystal shape and size.

  9. Abnormal Dielectric Response in an Optical Range Based on Electronic Transition in Rare-Earth-Ion-Doped Crystals

    Institute of Scientific and Technical Information of China (English)

    FU Xiao-Jian; XU Yuan-Da; ZHOU Ji

    2012-01-01

    A new scheme to realize an abnormal dielectric response at optical wavelength is developed on the basis of twolevel electronic transition of rare-earth ion doped crystals.Based on the semi-classical theory and the Judd-Ofelt theory,the electric dipole transition under a weak field is analyzed,and a general expression for the frequencydependent dielectric constant is obtained.As an example,the permittivity of (Erx Y1-x)3Al5O12 is calculated numerically in consideration of the transition between 4I15/2and 4F9/2.An optimized dielectric property with a negative real part and low absorption is achieved.This proposes a new mechanism for building extraordinary electromagnetic media at optical frequencies by using a quantum process.%A new scheme to realize an abnormal dielectric response at optical wavelength is developed on the basis of two-level electronic transition of rare-earth ion doped crystals. Based on the semi-classical theory and the Judd-Ofelt theory, the electric dipole transition under a weak Reid is analyzed, and a general expression for the frequency-dependent dielectric constant is obtained. As an example, the permittivity of (ErxY1-x)3A15O12 is calculated numerically in consideration of the transition between 4I15/2 and 4F9/2. An optimized dielectric property with a negative real part and low absorption is achieved. This proposes a new mechanism for building extraordinary electromagnetic media at optical frequencies by using a quantum process.

  10. MendelWeb: An Electronic Science/Math/History Resource for the WWW.

    Science.gov (United States)

    Blumberg, Roger B.

    This paper describes a hypermedia resource, called MendelWeb that integrates elementary biology, discrete mathematics, and the history of science. MendelWeb is constructed from Gregor Menders 1865 paper, "Experiments in Plant Hybridization". An English translation of Mendel's paper, which is considered to mark the birth of classical and…

  11. QR Codes as Finding Aides: Linking Electronic and Print Library Resources

    Science.gov (United States)

    Kane, Danielle; Schneidewind, Jeff

    2011-01-01

    As part of a focused, methodical, and evaluative approach to emerging technologies, QR codes are one of many new technologies being used by the UC Irvine Libraries. QR codes provide simple connections between print and virtual resources. In summer 2010, a small task force began to investigate how QR codes could be used to provide information and…

  12. Electron spin echo of Cu(2+) in the triglycine sulfate crystal family (TGS, TGSe, TGFB): electron spin-lattice relaxation, Debye temperature and spin-phonon coupling.

    Science.gov (United States)

    Lijewski, S; Goslar, J; Hoffmann, S K

    2006-07-05

    The electron spin-lattice relaxation of Cu(2+) has been studied by the electron spin echo technique in the temperature range 4.2-115 K in triglycine sulfate (TGS) family crystals. Assuming that the relaxation is due to Raman relaxation processes the Debye temperature Θ(D) was determined as 190 K for TGS, 168 K for triglycine selenate (TGSe) and 179 K for triglycine fluoroberyllate (TGFB). We also calculated the Θ(D) values from the sound velocities derived from available elastic constants. The elastic Debye temperatures were found as 348 K for TGS, 288 K for TGSe and 372 K for TGFB. The results shown good agreement with specific heat data for TGS. The elastic Θ(D) are considerably larger than those determined from the Raman spin-lattice relaxation. The possible reasons for this discrepancy are discussed. We propose to use a modified expression describing two-phonon Raman relaxation with a single variable only (Θ(D)) after elimination of the sound velocity. Moreover, we show that the relaxation data can be fitted using the elastic Debye temperature value as a constant with an additional relaxation process contributing at low temperatures. This mechanism can be related to a local mode of the Cu(2+) defect in the host lattice. Electron paramagnetic resonance g-factors and hyperfine splitting were analysed in terms of the molecular orbital theory and the d-orbital energies and covalency factors of the Cu(gly)(2) complexes were found. Using the structural data and calculated orbital energies the spin-phonon coupling matrix element of the second-order Raman process was calculated as 553 cm(-1) for TGS, 742 cm(-1) for TGSe and 569 cm(-1) for TGFB.

  13. Electronic resources at the University of Sharjah medical library: an investigation of students' information-seeking behavior.

    Science.gov (United States)

    Boumarafi, Behdja

    2010-10-01

    Electronic information is becoming prevalent worldwide, and its use is growing exponentially as more and more users are recognizing the potential that it offers in terms of access and delivery. However, with the introduction of new tools for e-information searching and retrieval, users have to readjust their information-seeking behavior to cope with the corresponding changes. The University of Sharjah library is steadily increasing its investment in e-resources to offer ubiquitous access to the growing body of literature in areas that interest the community it serves. This study reports the findings of a survey conducted to investigate the information-seeking behavior of medical students at the medical library. Results showed evidence of use of e-resources, but they did not explicitly establish that some of the major problems mentioned by participants did hinder the information searches of the respondents. An extensive literature review sets the background for the study.

  14. NATO Advanced Study Institute on Electron and Magnetization Densities in Molecules and Crystals

    CERN Document Server

    1980-01-01

    The interest of describing the ground state properties of a system in terms of one electron density (or its two spin components) is obvious, in particular due to the simple physical significance of this function. Recent experimental progress in diffraction made the measurement of charge and magnetization densities in crystalline solids possible, with an accuracy at least as good as theoretical accuracy. Theoretical developments of the many-body problem have proved the extreme importance of the one electron density function and presently, accurate methods of band structure determination become available. Parallel to the diffraction techniques, other domains of research (inelastic scattering, resonance, molecular spectroscopy) deal with quantities directly related to the one particle density. But the two types of studies do not interfere enough and one should obviously gain more information by interpreting all experiments that are related to the density together. It became necessary to have an International Sch...

  15. Crystal and electronic structure of PbTe/CdTe nanostructures

    Directory of Open Access Journals (Sweden)

    Sankowski Piotr

    2011-01-01

    Full Text Available Abstract In this article, the authors reported a theoretical study of structural and electronic properties of PbTe inclusions in CdTe matrix as well as CdTe nano-clusters in PbTe matrix. The structural properties are studied by ab initio methods. A tight-binding model is constructed to calculate the electron density of states (DOS of the systems. In contrast to the ab initio methods, the latter allows studying nanostructures with diameters comparable to the real ones. The calculations show that both kinds of inclusions lead to changes of the DOS of the carriers near the Fermi level, which may affect optical, electrical and thermoelectric properties of the material. These changes depend on the size, shape, and concentration of inclusions.

  16. Intregrating metallic wiring with three-dimensional polystyrene colloidal crystals using electron-beam lithography and three-dimensional laser lithography

    Science.gov (United States)

    Tian, Yaolan; Isotalo, Tero J.; Konttinen, Mikko P.; Li, Jiawei; Heiskanen, Samuli; Geng, Zhuoran; Maasilta, Ilari J.

    2017-02-01

    We demonstrate a method to fabricate narrow, down to a few micron wide metallic leads on top of a three-dimensional (3D) colloidal crystal self-assembled from polystyrene (PS) nanospheres of diameter 260 nm, using electron-beam lithography. This fabrication is not straightforward due to the fact that PS nanospheres cannot usually survive the harsh chemical treatments required in the development and lift-off steps of electron-beam lithography. We solve this problem by increasing the chemical resistance of the PS nanospheres using an additional electron-beam irradiation step, which allows the spheres to retain their shape and their self-assembled structure, even after baking to a temperature of 160 °C, the exposure to the resist developer and the exposure to acetone, all of which are required for the electron-beam lithography step. Moreover, we show that by depositing an aluminum oxide capping layer on top of the colloidal crystal after the e-beam irradiation, the surface is smooth enough so that continuous metal wiring can be deposited by the electron-beam lithography. Finally, we also demonstrate a way to self-assemble PS colloidal crystals into a microscale container, which was fabricated using direct-write 3D laser-lithography. Metallic wiring was also successfully integrated with the combination of a container structure and a PS colloidal crystal. Our goal is to make a device for studies of thermal transport in 3D phononic crystals, but other phononic or photonic crystal applications could also be envisioned.

  17. 3D Micro-topography of Transferred Laboratory and Natural Ice Crystal Surfaces Imaged by Cryo and Environmental Scanning Electron Microscopy

    Science.gov (United States)

    Magee, N. B.; Boaggio, K.; Bancroft, L.; Bandamede, M.

    2015-12-01

    Recent work has highlighted micro-scale roughness on the surfaces of ice crystals grown and imaged in-situ within the chambers of environmental scanning electron microscopes (ESEM). These observations appear to align with theoretical and satellite observations that suggest a prevalence of rough ice in cirrus clouds. However, the atmospheric application of the lab observations are indeterminate because the observations have been based only on crystals grown on substrates and in pure-water vapor environments. In this work, we present details and results from the development of a transfer technique which allows natural and lab-grown ice and snow crystals to be captured, preserved, and transferred into the ESEM for 3D imaging. Ice crystals were gathered from 1) natural snow, 2) a balloon-borne cirrus particle capture device, and 3) lab-grown ice crystals from a diffusion chamber. Ice crystals were captured in a pre-conditioned small-volume (~1 cm3) cryo-containment cell. The cell was then sealed closed and transferred to a specially-designed cryogenic dewer (filled with liquid nitrogen or crushed dry ice) for transport to a new Hitachi Field Emission, Variable Pressure SEM (SU-5000). The cryo-cell was then removed from the dewer and quickly placed onto the pre-conditioned cryo transfer stage attached to the ESEM (Quorum 3010T). Quantitative 3D topographical digital elevation models of ice surfaces are reported from SEM for the first time, including a variety of objective measures of statistical surface roughness. The surfaces of the transported crystals clearly exhibit signatures of mesoscopic roughening that are similar to examples of roughness seen in ESEM-grown crystals. For most transported crystals, the habits and crystal edges are more intricate that those observed for ice grown directly on substrates within the ESEM chamber. Portions of some crystals do appear smooth even at magnification greater than 1000x, a rare observation in our ESEM-grown crystals. The

  18. 图书馆电子信息资源利用效果评价研究%Study on Utilization Effect Evaluation of Library Electronic Information Resources

    Institute of Scientific and Technical Information of China (English)

    晋晓强; 贺培风; 何忠印

    2012-01-01

    This paper discusses utilization effect of electronic information resources combining with the characteristics of electronic information resources, makes evaluation system of library electronic information resource utilization effect from three aspects : the library, the users and the data providers, hoping for providing valuable reference for the efficient use of library electronic resources.%本文结合电子信息资源的特性对电子信息资源的利用进行初步探讨,从图书馆、用户和数据服务商三个角度构建图书馆电子信息资源利用效果的评价体系,希望能为图书馆电子信息资源的高效利用提供参考。

  19. Hard photon yields from (70-240) GeV electrons incident near axial directions on Si, Ge and W single crystals with a large thickness variation

    Science.gov (United States)

    Medenwaldt, R.; Møller, S. P.; Tang-Petersen, S.; Uggerhøj, E.; Elsener, K.; Hage-Ali, M.; Siffert, P.; Stoquert, J.; Sona, P.; Maier, K.

    1990-06-01

    The dramatic peak found in photon spectra from 150 GeV channelled electrons has for the first time been investigated for 70, 150, and 240 GeV electrons incident on crystals with thickness from 100μ (Si). Very pronounced variations for the high energy part of the photon spectra are found. In Si the photon peak is not found for lower energies and thin crystals. For well-aligned electrons in Si the yield is more than 160 times the Bethe-Heitler one. In general the peak in the photon spectra disaapears for incident angles larger than half the critical angle for channeling. Dramatic radiative energy losses are found along axial directions - in 0.6 mm Ge a 150 GeV electron loses more than 60% of its total energy.

  20. Hard photon yields from (70-240) GeV electrons incident near axial directions on Si, Ge and W single crystals with a large thickness variation

    Energy Technology Data Exchange (ETDEWEB)

    Medenwaldt, R.; Moeller, S.P.; Tang-Petersen, S.; Uggerhoej, E. (Aarhus Univ. (Denmark). Inst. of Physics); Elsener, K. (European Organization for Nuclear Research, Geneva (Switzerland)); Hage-Ali, M.; Siffert, P.; Stoquert, J. (Strasbourg-1 Univ., 67 (France). Centre de Recherches Nucleaires); Sona, P. (Florence Univ. (Italy). Dipt. di Fisica Istituto Nazionale di Fisica Nucleare, Florence (Italy)); Maier, K. (Max-Planck-Institut fuer Metallforschung, Stuttgart (Germany, F.R.))

    1990-06-14

    The dramatic peak found in photon spectra from 150 GeV channelled electrons has for the first time been investigated for 70, 150, and 240 GeV electrons incident on crystals with thicknesses from 100 {mu}m to 1400 {mu}m (Si). Very pronounced variations for the high energy part of the photon spectra are found. In Si the photon peak is not found for lower energies and thin crystals. For well-aligned electrons in Si the yield is more than 160 times the Bethe-Heitler one. In general the peak in the photon spectra disappears for incident angles larger than half the critical angle for channelling. Dramatic radiative energy losses are found along axial directions - in 0.6 mm <110> Ge a 150 GeV electron loses more than 60% of its total energy. (orig.).

  1. EELS and electron diffraction studies on possible bonaccordite crystals in pressurized water reactor fuel CRUD and in oxide films of alloy 600 material

    Energy Technology Data Exchange (ETDEWEB)

    Chen, Jiaxin [Studsvik Nuclear AB, Nykoping (Sweden); Lindberg, Fredrik [Swerea KIMAB AB, Kista (Sweden); Wells, Daniel [Electric Power Research Institute, Charlotte (United States); Bengysson, Bernt [Ringhals AB, Ringhalsverket, Varobacka (Sweden)

    2017-06-15

    Experimental verification of boron species in fuel CRUD (Chalk River Unidentified Deposit) would provide essential and important information about the root cause of CRUD-induced power shifts (CIPS). To date, only bonaccordite and elemental boron were reported to exist in fuel CRUD in CIPS-troubled pressurized water reactor (PWR) cores and lithium tetraborate to exist in simulated PWR fuel CRUD from some autoclave tests. We have reevaluated previous analysis of similar threadlike crystals along with examining some similar threadlike crystals from CRUD samples collected from a PWR cycle that had no indications of CIPS. These threadlike crystals have a typical [Ni]/[Fe] atomic ratio of ⁓2 and similar crystal morphology as the one (bonaccordite) reported previously. In addition to electron diffraction study, we have applied electron energy loss spectroscopy to determine boron content in such a crystal and found a good agreement with that of bonaccordite. Surprisingly, such crystals seem to appear also on corroded surfaces of Alloy 600 that was exposed to simulated PWR primary water with a dissolved hydrogen level of 5 mL H{sub 2}/kg H{sub 2}O, but absent when exposed under 75 mL H{sub 2}/kg H{sub 2}O condition. It remains to be verified as to what extent and in which chemical environment this phase would be formed in PWR primary systems.

  2. EELS and electron diffraction studies on possible bonaccordite crystals in pressurized water reactor fuel CRUD and in oxide films of alloy 600 material

    Directory of Open Access Journals (Sweden)

    Jiaxin Chen

    2017-06-01

    Full Text Available Experimental verification of boron species in fuel CRUD (Chalk River Unidentified Deposit would provide essential and important information about the root cause of CRUD-induced power shifts (CIPS. To date, only bonaccordite and elemental boron were reported to exist in fuel CRUD in CIPS-troubled pressurized water reactor (PWR cores and lithium tetraborate to exist in simulated PWR fuel CRUD from some autoclave tests. We have reevaluated previous analysis of similar threadlike crystals along with examining some similar threadlike crystals from CRUD samples collected from a PWR cycle that had no indications of CIPS. These threadlike crystals have a typical [Ni]/[Fe] atomic ratio of ∼2 and similar crystal morphology as the one (bonaccordite reported previously. In addition to electron diffraction study, we have applied electron energy loss spectroscopy to determine boron content in such a crystal and found a good agreement with that of bonaccordite. Surprisingly, such crystals seem to appear also on corroded surfaces of Alloy 600 that was exposed to simulated PWR primary water with a dissolved hydrogen level of 5 mL H2/kg H2O, but absent when exposed under 75 mL H2/kg H2O condition. It remains to be verified as to what extent and in which chemical environment this phase would be formed in PWR primary systems.

  3. Crystal structure of CD155 and electron microscopic studies of its complexes with polioviruses.

    Science.gov (United States)

    Zhang, Ping; Mueller, Steffen; Morais, Marc C; Bator, Carol M; Bowman, Valorie D; Hafenstein, Susan; Wimmer, Eckard; Rossmann, Michael G

    2008-11-25

    When poliovirus (PV) recognizes its receptor, CD155, the virus changes from a 160S to a 135S particle before releasing its genome into the cytoplasm. CD155 is a transmembrane protein with 3 Ig-like extracellular domains, D1-D3, where D1 is recognized by the virus. The crystal structure of D1D2 has been determined to 3.5-A resolution and fitted into approximately 8.5-A resolution cryoelectron microscopy reconstructions of the virus-receptor complexes for the 3 PV serotypes. These structures show that, compared with human rhinoviruses, the virus-receptor interactions for PVs have a greater dependence on hydrophobic interactions, as might be required for a virus that can inhabit environments of different pH. The pocket factor was shown to remain in the virus during the first recognition stage. The present structures, when combined with earlier mutational investigations, show that in the subsequent entry stage the receptor moves further into the canyon when at a physiological temperature, thereby expelling the pocket factor and separating the viral subunits to form 135S particles. These results provide a detailed analysis of how a nonenveloped virus can enter its host cell.

  4. Synthesis, crystal structure, electronic structure, and photoelectric response properties of KCu2SbS3.

    Science.gov (United States)

    Wang, Ruiqi; Zhang, Xian; He, Jianqiao; Zheng, Chong; Lin, Jianhua; Huang, Fuqiang

    2016-02-28

    Copper thioantimonates have received enormous attention due to their potential for applications in photovoltaic devices. In this work, a new layered compound KCu2SbS3 was synthesized via a reactive flux method using thiourea as a reactive flux. The compound crystallizes in the triclinic space group P1[combining macron]. The structure features two-dimensional [Cu2SbS3](-) layers stacking along the c axis with K(+) ions intercalated between the layers. Each [Cu2SbS3](-) layer is composed of two single graphene-like layers connected via interlayer Cu-S bonds and CuSb contacts. The optical measurements indicate that the compound has a band gap of 1.7 eV. The Hall effect measurement shows that KCu2SbS3 is a p-type semiconductor with a carrier concentration of 7 × 10(16) cm(-3). First-principles calculations reveal that the direct transition occurs between Cu-3d-S-3p orbitals (VBM) to Sb-5p-S-3p orbitals (CBM). The photoelectric response properties of KCu2SbS3 under visible light irradiation were analyzed. The photocurrent is 3.7 μA cm(-2) at 10 V bias, demonstrating its potential for applications in photoelectric devices.

  5. Crystal structure of CD155 and electron microscopic studies of its complexes with polioviruses

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Ping; Mueller, Steffen; Morais, Marc C.; Bator, Carol M.; Bowman, Valorie D.; Hafenstein, Susan; Wimmer, Eckard; Rossmann, Michael G. (SBU); (Purdue)

    2010-11-02

    When poliovirus (PV) recognizes its receptor, CD155, the virus changes from a 160S to a 135S particle before releasing its genome into the cytoplasm. CD155 is a transmembrane protein with 3 Ig-like extracellular domains, D1-D3, where D1 is recognized by the virus. The crystal structure of D1D2 has been determined to 3.5-{angstrom} resolution and fitted into {approx}8.5-{angstrom} resolution cryoelectron microscopy reconstructions of the virus-receptor complexes for the 3 PV serotypes. These structures show that, compared with human rhinoviruses, the virus-receptor interactions for PVs have a greater dependence on hydrophobic interactions, as might be required for a virus that can inhabit environments of different pH. The pocket factor was shown to remain in the virus during the first recognition stage. The present structures, when combined with earlier mutational investigations, show that in the subsequent entry stage the receptor moves further into the canyon when at a physiological temperature, thereby expelling the pocket factor and separating the viral subunits to form 135S particles. These results provide a detailed analysis of how a nonenveloped virus can enter its host cell.

  6. Solution processed deposition of electron transport layers on perovskite crystal surface-A modeling based study

    Science.gov (United States)

    Mortuza, S. M.; Taufique, M. F. N.; Banerjee, Soumik

    2017-02-01

    The power conversion efficiency (PCE) of planar perovskite solar cells (PSCs) has reached up to ∼20%. However, structural and chemicals defects that lead to hysteresis in the perovskite based thin film pose challenges. Recent work has shown that thin films of [6,6]-phenyl-C61-butyric acid methyl ester (PCBM) deposited on the photo absorption layer, using solution processing techniques, minimize surface pin holes and defects thereby increasing the PCE. We developed and employed a multiscale model based on molecular dynamics (MD) and kinetic Monte Carlo (kMC) to establish a relationship between deposition rate and surface coverage on perovskite surface. The MD simulations of PCBMs dispersed in chlorobenzene, sandwiched between (110) perovskite substrates, indicate that PCBMs are deposited through anchoring of the oxygen atom of carbonyl group to the exposed lead (Pb) atom of (110) perovskite surface. Based on rates of distinct deposition events calculated from MD, kMC simulations were run to determine surface coverage at much larger time and length scales than accessible by MD alone. Based on the model, a generic relationship is established between deposition rate of PCBMs and surface coverage on perovskite crystal. The study also provides detailed insights into the morphology of the deposited film.

  7. Gap states in the electronic structure of SnO2 single crystals and amorphous SnOx thin films

    Science.gov (United States)

    Haeberle, J.; Machulik, S.; Janowitz, C.; Manzke, R.; Gaspar, D.; Barquinha, P.; Schmeißer, D.

    2016-09-01

    The electronic structure of a SnO2 single crystal is determined by employing resonant photoelectron spectroscopy. We determine the core level, valence band, and X-ray absorption (XAS) data and compare these with those of amorphous SnOx thin films. We find similar properties concerning the data of the core levels, the valence band features, and the absorption data at the O1s edge. We find strong signals arising from intrinsic in-gap states and discuss their origin in terms of polaronic and charge-transfer defects. We deduce from the XAS data recorded at the Sn3d edge that the Sn4d10 ground state has contributions of 4d9 and 4d8 states due to configuration interaction. We identify localized electronic states depending on the strength of the 4d-5s5p interaction and of the O2p-to-Sn4d charge-transfer processes, both appear separated from the extended band-like states of the conduction band. For the amorphous SnOx thin films, significant differences are found only in the absorption data at the Sn3d-edge due to a stronger localization of the in-gap states.

  8. Final Report: The Impact of Carbonate on Surface Protonation, Electron Transfer and Crystallization Reactions in Iron Oxide Nanoparticles and Colloids

    Energy Technology Data Exchange (ETDEWEB)

    Dixon, David Adams [The University of Alabama

    2013-07-02

    This project addresses key issues of importance in the geochemical behavior of iron oxides and in the geochemical cycling of carbon and iron. For Fe, we are specifically studying the influence of carbonate on electron transfer reactions, solid phase transformations, and the binding of carbonate to reactive sites on the edges of particles. The emphasis on carbonate arises because it is widely present in the natural environment, is known to bind strongly to oxide surfaces, is reactive on the time scales of interest, and has a speciation driven by acid-base reactions. The geochemical behavior of carbonate strongly influences global climate change and CO{sub 2} sequestration technologies. Our goal is to answer key questions with regards to specific site binding, electron transfer reactions, and crystallization reactions of iron oxides that impact both the geochemical cycling of iron and CO{sub 2} species. Our work is focused on the molecular level description of carbonate chemistry in solution including the prediction of isotope fractionation factors. We have also done work on critical atmospheric species.

  9. First-principles study of electronic, elastic, and optical properties of Yb:CaF{sub 2} crystals

    Energy Technology Data Exchange (ETDEWEB)

    Qi, Yuan-Yuan; Li, Zhi-Guo; Chen, Xiang-Rong [Sichuan Univ., Chengdu (China). Inst. of Atomic and Molecular Physics; Cheng, Yan [Sichuan Univ., Chengdu (China). Inst. of Atomic and Molecular Physics; Sichuan Univ., Chengdu (China). Key Lab. of High Energy Density Physics and Technology of Ministry of Education; Ji, Guang-Fu [Chinese Academy of Engineering Physics, Mianyang (China). National Key Lab. for Shock Wave and Detonation Physics Research

    2015-07-01

    The electronic structure, elastic, and optical properties of CaF{sub 2} and Yb-doped CaF{sub 2} are investigated by the first-principles calculations. The obtained lattice parameters, band structure, density of state, elastic constants, and imaginary part of dielectric function ε{sub 2} for CaF{sub 2} agree well with the experimental and other theoretical results. A good comparison of the properties is made between CaF{sub 2} and Yb:CaF{sub 2}, and it is found that: firstly, Yb doping leads to the crystal structure distortion of CaF{sub 2} and reduction of the elastic constants. Secondly, an impurity band is found at the top of valence band in the band structure of Yb:CaF{sub 2} and contributes to the bandgap narrowing. Thirdly, the peaks at about 26 eV in the optical curves disappear after Yb doping, and the remaining two peaks shift towards the longer-wavelength side, with the peak intensities drop down, indicating that Yb doping makes the ultraviolet transmittance of the system improve and the range of light in the UV region widen. Furthermore, Yb doping induces new peaks in the optical curves, which may be caused by 4f electron transitions of Yb atom. Finally, the transmittance of the doped system increases when the Yb-doped proportion decreases.

  10. Crystallization from amorphous structure to hexagonal quantum dots induced by an electron beam on CdTe thin films

    Science.gov (United States)

    Becerril, M.; Zelaya-Angel, O.; Medina-Torres, A. C.; Aguilar-Hernández, J. R.; Ramírez-Bon, R.; Espinoza-Beltran, F. J.

    2009-02-01

    Amorphous cadmium-telluride films were prepared by rf sputtering on Corning 7059 glass substrates at room temperature. The deposition time was 10 and 12 h with a thickness of 400 and 480 (±40 nm), respectively. As-prepared films were amorphous according to X-ray diffraction (XRD) patterns, but a win-fit-software analysis of the main XRD broad band suggests a wurtzite structure at short range. Transmission electron microscopy (TEM) at 200 keV produces crystallization of the amorphous CdTe. The TEM-electron beam induces the formation of CdTe quantum dots with the wurtzite hexagonal structure (the metastable structure of CdTe) and with ˜6 nm of average grain size. As effect of a probable distortion of the CdTe crystalline lattice, the unit cell volume (UCV) shrinks to about 30% with respect to the bulk-UCV of CdTe. Besides, the energy band gap increases as expected, according to literature data on quantum confinement.

  11. Synthesis, electronic transport and optical properties of Si:α-Fe 2 O 3 single crystals

    Energy Technology Data Exchange (ETDEWEB)

    Rettie, Alexander J. E.; Chemelewski, William D.; Wygant, Bryan R.; Lindemuth, Jeffrey; Lin, Jung-Fu; Eisenberg, David; Brauer, Carolyn S.; Johnson, Timothy J.; Beiswenger, Toya N.; Ash, Richard D.; Li, Xiang; Zhou, Jianshi; Mullins, C. Buddie

    2016-01-01

    We report the synthesis of silicon-doped hematite (Si:α-Fe2O3) single crystals via chemical vapor transport, with Si incorporation on the order of 1019 cm-3. The conductivity, Seebeck and Hall effect were measured in the basal plane between 200 and 400 K. Distinct differences in electron transport were observed above and below the magnetic transition temperature of hematite at ~265 K (the Morin transition, TM). Above 265 K, transport was found to agree with the adia-batic small-polaron model, the conductivity was characterized by an activation energy of ~100 meV and the Hall effect was dominated by the weak ferromagnetism of the material. A room temperature electron drift mobility of ~10-2 cm2 V-1 s-1 was estimated. Below TM, the activation energy increased to ~160 meV and a conventional Hall coefficient could be de-termined. In this regime, the Hall coefficient was negative and the corresponding Hall mobility was temperature-independent with a value of ~10-1 cm2 V-1 s-1. Seebeck coefficient measurements indicated that the silicon donors were fully ionized in the temperature range studied. Finally, in the doped species we observe a very broad infrared absorption fea-ture centered near 0.4 eV that does not appear to be hydroxyl related but is tentatively assigned to photon-assisted small-polaron hops. These results are discussed in the context of existing hematite transport studies.

  12. Crystal structure of the electron transfer complex rubredoxin rubredoxin reductase of Pseudomonas aeruginosa.

    OpenAIRE

    2007-01-01

    Crude oil spills represent a major ecological threat because of the chemical inertness of the constituent n-alkanes. The Gram-negative bacterium Pseudomonas aeruginosa is one of the few bacterial species able to metabolize such compounds. Three chromosomal genes, rubB, rubA1, and rubA2 coding for an NAD(P)H:rubredoxin reductase (RdxR) and two rubredoxins (Rdxs) are indispensable for this ability. They constitute an electron transport (ET) pathway that shuttles reducing equivalents from carbon...

  13. Crystal structure of the electron transfer complex rubredoxin–rubredoxin reductase of Pseudomonas aeruginosa

    OpenAIRE

    2007-01-01

    Crude oil spills represent a major ecological threat because of the chemical inertness of the constituent n-alkanes. The Gram-negative bacterium Pseudomonas aeruginosa is one of the few bacterial species able to metabolize such compounds. Three chromosomal genes, rubB, rubA1, and rubA2 coding for an NAD(P)H:rubredoxin reductase (RdxR) and two rubredoxins (Rdxs) are indispensable for this ability. They constitute an electron transport (ET) pathway that shuttles reducing equivalents from carbon...

  14. Electronic structure and optical properties of Sb{sub 2}S{sub 3} crystal

    Energy Technology Data Exchange (ETDEWEB)

    Ben Nasr, T., E-mail: tarek.ben-nasr@laposte.ne [Laboratoire de Physique de la Matiere Condensee, Faculte des Sciences de Tunis, Campus Universitaire, 2092 Tunis El Manar (Tunisia); Maghraoui-Meherzi, H. [Laboratoire de Chimie Analytique et Electrochimie, Faculte des Sciences de Tunis, Campus Universitaire, 2092 Tunis El Manar (Tunisia); Ben Abdallah, H.; Bennaceur, R. [Laboratoire de Physique de la Matiere Condensee, Faculte des Sciences de Tunis, Campus Universitaire, 2092 Tunis El Manar (Tunisia)

    2011-01-15

    The electronic and optical properties of Sb{sub 2}S{sub 3} are studied using the full potential linearized augmented plane wave (FP-LAPW) method as implemented in Wien2k. In this approach, the alternative form of the generalized gradient approximation (GGA) proposed by Engel and Vosko (EV-GGA) was used for the exchange correlation potential. The calculated band structure shows a direct band gap. The contribution of different bands was analyzed from total and partial density of states curves. Moreover, the optical properties, including the dielectric function, absorption spectrum, refractive index, extinction coefficient, reflectivity and energy-loss spectrum are all obtained and analyzed in detail.

  15. Zero-order crystallization in the Bethe-Fermi homework and electron gas problems

    Science.gov (United States)

    Cambiaggio, M. C.; De Llano, M.; Plastino, A.; Szybisz, L.; Ramírez, S.

    1980-04-01

    Single-determinantal states consisting of localized, non-overlapping single-particle orbitals are used in comparison with those made up of plane wave ones to show that neutron matter prefers a "crystalline" configuration beyond a density of around 0.07 fm -3 for the ν0 homework potential. The total energy is not too high above the best Jastrow-correlated calculations. No such effect is found for the ν1 homework potential. The analogous question for the electron gas is also studied.

  16. Imaging of surface spin textures on bulk crystals by scanning electron microscopy

    OpenAIRE

    Hiroshi Akamine; So Okumura; Sahar Farjami; Yasukazu Murakami; Minoru Nishida

    2016-01-01

    Direct observation of magnetic microstructures is vital for advancing spintronics and other technologies. Here we report a method for imaging surface domain structures on bulk samples by scanning electron microscopy (SEM). Complex magnetic domains, referred to as the maze state in CoPt/FePt alloys, were observed at a spatial resolution of less than 100 nm by using an in-lens annular detector. The method allows for imaging almost all the domain walls in the mazy structure, whereas the visualis...

  17. An Exploratory study on the use of LibAnswers to Resolve, Track and Monitor Electronic Resources Issues: The KAUST Library experience

    KAUST Repository

    Ramli, Rindra M.

    2017-05-03

    An Exploratory study on KAUST library use of LibAnswers in resolving electronic resources questions received in LibAnswers. It describes the findings of the questions received in LibAnswers. The author made suggestions based on the findings to improve the reference services in responding to e-resources questions.

  18. Eavesdropping on Electronic Guidebooks: Observing Learning Resources in Shared Listening Environments.

    Science.gov (United States)

    Woodruff, Allison; Aoki, Paul M.; Grinter, Rebecca E.; Hurst, Amy; Szymanski, Margaret H.; Thornton, James D.

    This paper describes an electronic guidebook, "Sotto Voce," that enables visitors to share audio information by eavesdropping on each others guidebook activity. The first section discusses the design and implementation of the guidebook device, key aspects of its user interface, the design goals for the audio environment, the eavesdropping…

  19. Electronic Resources in a Next-Generation Catalog: The Case of WorldCat Local

    Science.gov (United States)

    Shadle, Steve

    2009-01-01

    In April 2007, the University of Washington Libraries debuted WorldCat Local (WCL), a localized version of the WorldCat database that interoperates with a library's integrated library system and fulfillment services to provide a single-search interface for a library's physical and electronic content. This brief will describe how WCL incorporates a…

  20. Equalizing Access to Electronic Networked Resources: A Model for Rural Libraries in the United States.

    Science.gov (United States)

    Senkevitch, Judith J.; Wolfram, Dietmar

    1994-01-01

    Provides an overview of the current state of networking technology in rural libraries and describes a model for educating rural librarians in accessing electronic networks. Topics discussed include information needs in rural libraries; telecommunications technology access in rural areas; and examples of services to enhance information access.…

  1. Temperature dependent behavior of localized and delocalized electrons in nitrogen-doped 6H SiC crystals as studied by electron spin resonance

    Energy Technology Data Exchange (ETDEWEB)

    Savchenko, D., E-mail: dariyasavchenko@gmail.com [Institute of Physics AS CR, Prague 182 21 (Czech Republic); National Technical University of Ukraine “Kyiv Polytechnic Institute”, Kyiv 03056 (Ukraine); Kalabukhova, E.; Shanina, B.; Kiselov, V. [V.E. Lashkaryov Institute of Semiconductor Physics, NAS of Ukraine, Kyiv 03028 (Ukraine); Cichoň, S.; Honolka, J. [Institute of Physics AS CR, Prague 182 21 (Czech Republic); Mokhov, E. [A.F. Ioffe Physical Technical Institute, RAS, St. Petersburg 194021 (Russian Federation); Saint-Petersburg National Research University of Information Technologies, Mechanics and Optics, St. Petersburg 19710 (Russian Federation)

    2016-01-28

    We have studied the temperature behavior of the electron spin resonance (ESR) spectra of nitrogen (N) donors in n-type 6H SiC crystals grown by Lely and sublimation sandwich methods (SSM) with donor concentration of 10{sup 17 }cm{sup −3} at T = 60–150 K. A broad signal in the ESR spectrum was observed at T ≥ 80 K with Lorentzian lineshape and g{sub ||} = 2.0043(3), g{sub ⊥} = 2.0030(3), which was previously assigned in the literature to the N donors in the 1s(E) excited state. Based on the analysis of the ESR lineshape, linewidth and g-tensor we attribute this signal to the conduction electrons (CE). The emergence of the CE ESR signal at T > 80 K was explained by the ionization of electrons from the 1s(A{sub 1}) ground and 1s(E) excited states of N donors to the conduction band while the observed reduction of the hyperfine (hf) splitting for the N{sub k1,k2} donors with the temperature increase is attributed to the motional narrowing effect of the hf splitting. The temperature dependence of CE ESR linewidth is described by an exponential law (Orbach process) with the activation energy corresponding to the energy separation between 1s(A{sub 1}) and 1s(E) energy levels for N residing at quasi-cubic sites (N{sub k1,k2}). The theoretical analysis of the temperature dependence of microwave conductivity measured by the contact-free method shows that due to the different position of the Fermi level in two samples the ionization of free electrons occurs from the energy levels of N{sub k1,k2} donors in Lely grown samples and from the energy level of N{sub h} residing at hexagonal position in 6H SiC grown by SSM.

  2. Two-dimensional crystal CuS—electronic and structural properties

    Science.gov (United States)

    Soares, Antonio L., Jr.; Dos Santos, Egon C.; Morales-García, A.; Heine, Thomas; De Abreu, Heitor A.; Duarte, Hélio A.

    2017-03-01

    Covellite is a metallic layered mineral with rather strong interlayer interaction. Recently, synthesis of covellite nanosheets of 3.2 nm thickness was reported (Du et al 2012 Nat. Commun. 3 1177), which raises the question: ‘What is the thinnest possible covellite nanosheet?’ Based on density functional/plane waves calculations, we have shown that graphene-like structure CuS (1L-CuS) is unstable but can be stabilized on a support. Here, however, we demonstrate that the three layered CuS (3L-CuS) with thickness of 0.773 nm (including the atomic radius of the outer plans atoms) is predicted to be intrinsically stable, as confirmed by phonon analysis and Born-Oppenheimer molecular dynamics simulations, with 3L-CuS about 0.15 eV per CuS less stable than the bulk. Interestingly, the electronic band structure shows metallic character with four bands crossing the Fermi level. The nature of chemical bonding is confirmed by a detailed topological analysis of the electron density.

  3. Structural and magnetic properties of inverse opal photonic crystals studied by x-ray diffraction, scanning electron microscopy, and small-angle neutron scattering

    NARCIS (Netherlands)

    Grigoriev, S.V.; Napolskii, K.S.; Grigoryeva, N.A.; Vasilieva, A.V.; Mistonov, A.A.; Chernyshov, D.Y.; Petukhov, A.V.; Belov, D.V.; Eliseev, A.A.; Lukashin, A.V.; Tretyakov, Y.D.; Sinitskii, A.S.; Eckerlebe, H.

    2009-01-01

    The structural and magnetic properties of nickel inverse opal photonic crystal have been studied by complementary experimental techniques, including scanning electron microscopy, wide-angle and small-angle diffraction of synchrotron radiation, and polarized neutrons. The sample was fabricated by ele

  4. Electron transport and recombination in dye-sensitized solar cells made from single-crystal rutile TiO2 nanowires.

    Science.gov (United States)

    Enache-Pommer, Emil; Liu, Bin; Aydil, Eray S

    2009-11-14

    Contrary to expectations, the electron transport rate in dye-sensitized solar cells made from single-crystal rutile titanium dioxide nanowires is found to be similar to that measured in dye-sensitized solar cells made from titanium dioxide nanoparticles.

  5. Preference and Use of Electronic Information and Resources by Blind/Visually Impaired in NCR Libraries in India

    Directory of Open Access Journals (Sweden)

    Shailendra Kumar

    2013-06-01

    Full Text Available This paper aims to determine the preference and use of electronic information and resources by blind/visually impaired users in the leading National Capital Region (NCR libraries of India. Survey methodology has been used as the basic research tool for data collection with the help of questionnaires. The 125 in total users surveyed in all the five libraries were selected randomly on the basis of willingness of the users with experience of working in digital environments to participate in the survey. The survey results were tabulated and analyzed with descriptive statistics methods using Excel software and 'Stata version 11'. The findings reveal that ICT have a positive impact in the lives of people with disabilities as it helps them to work independently and increases the level of confidence among them. The Internet is the most preferred medium of access to information among the majority of blind/visually impaired users. The 'Complexity of content available on the net' is found as the major challenge faced during Internet use by blind users of NCR libraries. 'Audio books on CDs/DVDs and DAISY books' are the most preferred electronic resources among the majority of blind/visually impaired users. This study will help the library professionals and organizations/institutions serving people with disabilities to develop effective library services for blind/visually impaired users in the digital environment on the basis of findings on information usage behavior in the study.

  6. Imaging of surface spin textures on bulk crystals by scanning electron microscopy.

    Science.gov (United States)

    Akamine, Hiroshi; Okumura, So; Farjami, Sahar; Murakami, Yasukazu; Nishida, Minoru

    2016-11-22

    Direct observation of magnetic microstructures is vital for advancing spintronics and other technologies. Here we report a method for imaging surface domain structures on bulk samples by scanning electron microscopy (SEM). Complex magnetic domains, referred to as the maze state in CoPt/FePt alloys, were observed at a spatial resolution of less than 100 nm by using an in-lens annular detector. The method allows for imaging almost all the domain walls in the mazy structure, whereas the visualisation of the domain walls with the classical SEM method was limited. Our method provides a simple way to analyse surface domain structures in the bulk state that can be used in combination with SEM functions such as orientation or composition analysis. Thus, the method extends applications of SEM-based magnetic imaging, and is promising for resolving various problems at the forefront of fields including physics, magnetics, materials science, engineering, and chemistry.

  7. Collaboration in electronic resource provision in university libraries: SHEDL, a Scottish case study

    OpenAIRE

    Kidd, T

    2009-01-01

    This case study examines the growth of collaboration among Scottish higher education institutions. Following a summary of the work of the Scottish Confederation of University and Research Libraries (SCURL), more detailed information is provided on collaboration in the fields of acquisition, licensing, selection, and purchasing. Some of the UK background is outlined, relating to NESLi2 in particular, in order to illuminate the options within Scotland. The origins of negotiations on electronic ...

  8. Internet and electronic resources for inflammatory bowel disease: a primer for providers and patients.

    Science.gov (United States)

    Fortinsky, Kyle J; Fournier, Marc R; Benchimol, Eric I

    2012-06-01

    Patients with inflammatory bowel disease (IBD) are increasingly turning to the Internet to research their condition and engage in discourse on their experiences. This has resulted in new dynamics in the relationship between providers and their patients, with misinformation and advertising potentially presenting barriers to the cooperative patient-provider partnership. This article addresses important issues of online IBD-related health information and social media activity, such as quality, reliability, objectivity, and privacy. We reviewed the medical literature on the quality of online information provided to IBD patients, and summarized the most commonly accessed Websites related to IBD. We also assessed the activity on popular social media sites (such as Facebook, Twitter, and YouTube), and evaluated currently available applications for use by IBD patients and providers on mobile phones and tablets. Through our review of the literature and currently available resources, we developed a list of recommended online resources to strengthen patient participation in their care by providing reliable, comprehensive educational material.

  9. Crystal structure and electronic properties of the new structure dinitride-nitride N{sub 2}MN (M: Cu, Ag)

    Energy Technology Data Exchange (ETDEWEB)

    Zhuravlev, Yuriy [Physical Faculty, Department of General Physics, Kemerovo State University, Red st. 6, 650043 Kemerovo (Russian Federation); Lisitsyn, Viktor; Morozova, Yelena [Department of Lasers and Lighting Engineering, Institute of High Technology Physics, National Research Tomsk Polytechnic University, Lenin av. 30, 634030 Tomsk (Russian Federation)

    2012-11-15

    Copper and nitrogen compounds and silver and nitrogen compounds have been researched with the first-principle linear combination of the atomic orbitals in full-screen basis with the local gradient and hybrid potential of the density functional theory (DFT) realized in the CRYSTAL09 program code. We have found the structural N{sub 2}MN (M: Cu, Ag) dinitride-nitride phase having an orthorhombic structure, the spatial group of the Ibam symmetry and four formula units in the primitive cell that have not been reported before. The structure was found to be layered, the metal atoms are linearly circled by the nitride N atoms, whereas, the other two atoms make a molecule with a small negative charge of {proportional_to}0.02 e. The volume elastic modules in N{sub 2}CuN, N{sub 2}AgN crystals are equal to 4.3 and 6.6 GPa, respectively, and their pressure derivatives are equal to 6.7 and 5.3, respectively. The electron energy spectrum makes a superposition of weakly interacting molecular states of N{sub 2} and metal states of MN. The bandgap width equals {proportional_to}0.05 eV. The estimations of the enthalpy energies show that N{sub 2}MN possess large energy content and in its decomposition into metal and gaseous nitride the energy release can reach 8 eV cell{sup -1}, which appears to be higher than that in the known metal azides. Thus, the new structure of the dinitride-nitride N{sub 2}MN combines the properties of molecular and semiconductor crystals: high compressibility, strong mechanical anisotropy, localized vacant states in the zone spectrum, and small bandgap. The unique physical properties can ensure their application as energy materials, the source of chemically pure nitride, and in semiconductor and optical material science. (Copyright copyright 2012 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  10. Low Thermal Gradient Czochralski growth of large CdWO{sub 4} crystals and electronic properties of (010) cleaved surface

    Energy Technology Data Exchange (ETDEWEB)

    Atuchin, V.V., E-mail: atuchin@isp.nsc.ru [Laboratory of Optical Materials and Structures, Institute of Semiconductor Physics, SB RAS, Novosibirsk 90 630090 (Russian Federation); Functional Electronics Laboratory, Tomsk State University, Tomsk 634050 (Russian Federation); Laboratory of Semiconductor and Dielectric Materials, Novosibirsk State University, Novosibirsk 630090 (Russian Federation); Galashov, E.N. [Department of Applied Physics, Novosibirsk State University, Novosibirsk 630090 (Russian Federation); Khyzhun, O.Y.; Bekenev, V.L. [Frantsevich Institute for Problems of Materials Science, NAS of Ukraine, 3 Krzhyzhanivsky Street, Kyiv UA-03142 (Ukraine); Pokrovsky, L.D. [Laboratory of Optical Materials and Structures, Institute of Semiconductor Physics, SB RAS, Novosibirsk 90 630090 (Russian Federation); Borovlev, Yu.A. [Laboratory of Crystal Growth, Nikolaev Institute of Inorganic Chemistry, SB RAS, Novosibirsk 90 630090 (Russian Federation); Zhdankov, V.N. [CML Ltd., 3 Lavrentiev Avenue, Novosibirsk 90 630090 (Russian Federation)

    2016-04-15

    The crystal growth of large high-quality inclusion-free CdWO4 crystals, 110 mm in diameter and mass up to 20 kg, has been carried out by the Low Thermal Gradient Czochralski (LTG Cz) technique. The high-purity CdWO{sub 4}(010) surface has been prepared by cleavage and high structural quality of the surface has been verified by RHEED, revealing a system of Kikuchi lines. The chemical state and electronic structure of the surface have been studied using X-ray photoelectron spectroscopy (XPS) and X-ray emission spectroscopy (XES). The total and partial densities of states of the CdWO{sub 4} tungstate were calculated employing the first-principles full potential linearized augmented plane wave (FP-LAPW) method. The results indicate that the principal contributors to the valence band of CdWO{sub 4} are the Cd 4d, W 5d and O 2p states which contribute mainly at the bottom, in the central portion and at the top of the valence band, respectively, with also significant contributions of the mentioned states throughout the whole CdWO{sub 4} valence-band region. With respect to the occupation of the O 2p states, the results of the FP-LAPW calculations are confirmed by comparison on a common energy scale of the XPS valence-band spectrum and the XES band representing the energy distribution of the O 2p states in this compound. Additionally, the FP-LAPW data allow us to conclude that the CdWO{sub 4} tungstate is a non-direct semiconductor. - Highlights: • Large high-quality CdWO{sub 4} crystals, up to 115 mm in diameter and mass up to 20 kg, have been grown. • The high-purity cleaved CdWO{sub 4}(010) surface has been studied by the XPS and XES methods. • The principal contributors to the CdWO{sub 4} valence band are the Cd 4d, W 5d and O 2p states.

  11. Chlorophyll J-aggregates: from bioinspired dye stacks to nanotubes, liquid crystals, and biosupramolecular electronics.

    Science.gov (United States)

    Sengupta, Sanchita; Würthner, Frank

    2013-11-19

    Among the natural light-harvesting (LH) systems, those of green sulfur and nonsulfur photosynthetic bacteria are exceptional because they lack the support of a protein matrix. Instead, these so-called chlorosomes are based solely on "pigments". These are self-assembled bacteriochlorophyll c, d, and e derivatives, which consist of a chlorophyll skeleton bearing a 3(1)-hydroxy functional group. Chemists consider the latter as an essential structural unit to direct the formation of light-harvesting self-assembled dye aggregates with J-type excitonic coupling. The intriguing properties of chlorosomal J-type aggregates, particularly narrow red-shifted absorption bands, compared with monomers and their ability to delocalize and migrate excitons, have inspired intense research activities toward synthetic analogues in this field. The ultimate goal of this research field is the development of (opto-)electronic devices based on the architectural principle of chlorosomal LH systems. In this regard, the challenge is to develop small, functional building blocks with appropriate substituents that are preprogrammed to self-assemble across different length scales and to emulate functions of natural LH systems or to realize entirely new functions beyond those found in nature. In this Account, we highlight our achievements in the past decade with semisynthetic zinc chlorins (ZnChls) as model compounds of bacteriochlorophylls obtained from the naturally most abundant chlorin precursor: chlorophyll a. To begin, we explore how supramolecular strategies involving π-stacking, hydrogen bonding, and metal-oxygen coordination can be used to design ZnChl-based molecular stack, tube, and liquid crystalline assemblies conducive to charge and energy transport. Our design principle is based on the bioinspired functionalization of the 3(1)-position of ZnChl with a hydroxy or methoxy group; the former gives rise to tubular assemblies, whereas the latter induces stack assemblies. Functionalization

  12. Theoretical explanation of electron paramagnetic resonance and optical parameters for Cu2+ ion in LiNbO3 crystal

    Indian Academy of Sciences (India)

    S Ravi; P Subramanian

    2007-08-01

    The EPR parameters, anisotropic -factors , and for Cu2+ ion and hyperfine structure constants , and for Cu2+ in LiNbO3 crystal are calculated by the method of diagonalizing the full Hamiltonian matrix. The crystal-field parameters contact with the crystal structure by the aid of the superposition model. The optical transition parameters are calculated using Zhao crystal-field model. The calculated results are in good agreement with the observed values. The results are discussed.

  13. Surface Electronic Structure of Hybrid Organo Lead Bromide Perovskite Single Crystals

    KAUST Repository

    Komesu, Takashi

    2016-08-24

    The electronic structure and band dispersion of methylammonium lead bromide, CH3NH3PbBr3, has been investigated through a combination of angle-resolved photoemission spectroscopy (ARPES) and inverse photoemission spectroscopy (IPES), as well as theoretical modeling based on density functional theory. The experimental band structures are consistent with the density functional calculations. The results demonstrate the presence of a dispersive valence band in MAPbBr3 that peaks at the M point of the surface Brillouin zone. The results also indicate that the surface termination of the CH3NH3PbBr3 is the methylammonium bromide (CH3NH3Br) layer. We find our results support models that predict a heavier hole effective mass in the region of -0.23 to -0.26 me, along the Γ (surface Brillouin center) to M point of the surface Brillouin zone. The surface appears to be n-type as a result of an excess of lead in the surface region. © 2016 American Chemical Society.

  14. Formation of interstitial-vacancy pairs by electronic excitation in pure ionic crystals

    Energy Technology Data Exchange (ETDEWEB)

    Itoh, Noriaki; Tanimura, Katsumi (Nagoya Univ. (Japan). Dept. of Physics)

    1990-01-01

    We review experiments and theories on defect formation induced by electronic excitation. Emphasis is placed on the microscopic mechanism of F-H pair formation in alkali halides and relevant phenomena in other systems such as alkaline earth fluorides, amorphous silicon dioxide and alkali halide surfaces. Dynamic and thermally-activated formation of the F-H pairs are discussed separately and it is pointed out that these two processes involve relaxation on different adiabatic potential surfaces. The mechanism of the temperature dependence is discussed in some detail. The significance of the value of S/D for the defect formation process in alkali halides, where S is the space between the halogen ion and D is the diameter of a halogen atom, is also discussed. Although understanding of the defect formation processes in systems other than alkali halides is not as deep as in alkali halides, the similarities and differences in the processes in alkali halides and other materials are discussed. Defect formation and sputtering of alkali halides are also compared. (author).

  15. Ternary mixed crystal effects on electron-interface optical phonon interactions in In{sub x}Ga{sub 1-x}N/GaN quantum wells

    Energy Technology Data Exchange (ETDEWEB)

    Huang Wendeng, E-mail: wdhuang2005@163.com [MOE Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter, School of Science, Xi' an Jiaotong University, Xi' an, 710049 (China) and School of Physics and Telecommunication Engineering, Shaanxi University of Technology, Hanzhong 723001 (China); Chen Guangde; Ye Honggang [MOE Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter, School of Science, Xi' an Jiaotong University, Xi' an, 710049 (China); Ren Yajie [School of Physics and Telecommunication Engineering, Shaanxi University of Technology, Hanzhong 723001 (China)

    2013-02-01

    Based on the modified random-element isodisplacement model and dielectric continuum model, the dispersions of interface optical phonons, electron-interface phonon interaction and ternary mixed crystal effect on interface optical phonons in In{sub x}Ga{sub 1-x}N/GaN quantum wells are studied in a fully numerical manner. The results indicate that there are two indium concentration intervals that interface optical phonons exist. The indium concentration has important effects on the dispersions and electron-phonon interactions of interface optical phonons. The electron-IO phonon interactions in higher indium concentration are more important than that in lower indium concentration.

  16. Evaluation of super-resolution performance of the K2 electron-counting camera using 2D crystals of aquaporin-0.

    Science.gov (United States)

    Chiu, Po-Lin; Li, Xueming; Li, Zongli; Beckett, Brian; Brilot, Axel F; Grigorieff, Nikolaus; Agard, David A; Cheng, Yifan; Walz, Thomas

    2015-11-01

    The K2 Summit camera was initially the only commercially available direct electron detection camera that was optimized for high-speed counting of primary electrons and was also the only one that implemented centroiding so that the resolution of the camera can be extended beyond the Nyquist limit set by the physical pixel size. In this study, we used well-characterized two-dimensional crystals of the membrane protein aquaporin-0 to characterize the performance of the camera below and beyond the physical Nyquist limit and to measure the influence of electron dose rate on image amplitudes and phases.

  17. Electronic liquid crystal state in the high-temperature superconductor YBa{sub 2}Cu{sub 3}O{sub 6.45}

    Energy Technology Data Exchange (ETDEWEB)

    Hinkov, V.; Haug, D.; Lin, C.T.; Keimer, B. [Max Planck Inst Festkorperforsch, D-70569 Stuttgart, (Germany); Fauque, B.; Bourges, P.; Sidis, Y. [CEA Saclay, CNRS, Lab Leon Brillouin, F-91191 Gif Sur Yvette, (France); Ivanov, A. [Inst Max Von Laue Paul Langevin, F-38042 Grenoble, (France); Bernhard, C. [Univ Fribourg, Dept Phys, CH-1700 Fribourg, (Switzerland); Bernhard, C. [Univ Fribourg, FriMat Ctr Nanomat, CH-1700 Fribourg, (Switzerland)

    2008-07-01

    Electronic phases with symmetry properties matching those of conventional liquid crystals have recently been discovered in transport experiments on semiconductor heterostructures and metal oxides at milli-kelvin temperatures. We report the spontaneous onset of a one- dimensional, incommensurate modulation of the spin system in the high-transition-temperature superconductor YBa{sub 2}Cu{sub 3}O{sub 6.45} upon cooling below similar to 150 kelvin, whereas static magnetic order is absent above 2 kelvin. The evolution of this modulation with temperature and doping parallels that of the in-plane anisotropy of the resistivity, indicating an electronic nematic phase that is stable over a wide temperature range. The results suggest that soft spin fluctuations are a microscopic route toward electronic liquid crystals and that nematic order can coexist with high-temperature superconductivity in under-doped cuprates. (authors)

  18. Study of a prototype high quantum efficiency thick scintillation crystal video-electronic portal imaging device.

    Science.gov (United States)

    Samant, Sanjiv S; Gopal, Arun

    2006-08-01

    Image quality in portal imaging suffers significantly from the loss in contrast and spatial resolution that results from the excessive Compton scatter associated with megavoltage x rays. In addition, portal image quality is further reduced due to the poor quantum efficiency (QE) of current electronic portal imaging devices (EPIDs). Commercial video-camera-based EPIDs or VEPIDs that utilize a thin phosphor screen in conjunction with a metal buildup plate to convert the incident x rays to light suffer from reduced light production due to low QE (quantum efficiency (DQE). A theoretical expression of DQE(0) was developed to be used as a predictive model to propose improvements in the optics associated with the light detection. The prototype TSC provides DQE(0)=0.02 with its current imaging geometry, which is an order of magnitude greater than that for commercial VEPID systems and comparable to flat-panel imaging systems. Following optimization in the imaging geometry and the use of a high-end, cooled charge-coupled-device (CCD) camera system, the performance of the TSC is expected to improve even further. Based on our theoretical model, the expected DQE(0)=0.12 for the TSC system with the proposed improvements, which exceeds the performance of current flat-panel EPIDs. The prototype TSC provides high quality imaging even at subMU exposures (typical imaging dose is 0.2 MU per image), which offers the potential for daily patient localization imaging without increasing the weekly dose to the patient. Currently, the TSC is capable of limited frame-rate fluoroscopy for intratreatment visualization of patient motion at approximately 3 frames/second, since the achievable frame rate is significantly reduced by the limitations of the camera-control processor. With optimized processor control, the TSC is expected to be capable of intratreatment imaging exceeding 10 frames/second to monitor patient motion.

  19. The crystal and electronic structures of the Li{sub 2-x}Ag{sub 1+x}In{sub 3} (x=0.05) indide

    Energy Technology Data Exchange (ETDEWEB)

    Chumak, Ihor, E-mail: ihor.chumak@kit.edu [Institute for Applied Materials (IAM), Karlsruhe Institute of Technology (KIT), Hermann-von-Helmholtz-Platz 1, D-76344 Eggenstein-Leopoldshafen (Germany); Pavlyuk, Volodymyr [Department of Inorganic Chemistry, Ivan Franko Lviv National University, Kyryla and Mefodiya Street, 6, 79005 Lviv (Ukraine); Institute of Chemistry, Environment Protection and Biotechnology, Jan Dlugosz University, al. Armii Krajowej 13/15, 42-200 Czestochowa (Poland); Dmytriv, Grygoriy [Department of Inorganic Chemistry, Ivan Franko Lviv National University, Kyryla and Mefodiya Street, 6, 79005 Lviv (Ukraine); Pauly, Hermann [Materials Science, Darmstadt University of Technology, Petersenstrasse 23, D-64287 Darmstadt (Germany); Ehrenberg, Helmut [Institute for Applied Materials (IAM), Karlsruhe Institute of Technology (KIT), Hermann-von-Helmholtz-Platz 1, D-76344 Eggenstein-Leopoldshafen (Germany); Institute of Inorganic Chemistry, Karlsruhe Institute of Technology (KIT), Engesserstr. 15, 76131 Karlsruhe (Germany)

    2013-01-15

    The crystal structure of Li{sub 2-x}Ag{sub 1+x}In{sub 3} (x=0.05) has been determined on a single crystal synthesized from the elements in a tantalum crucible. The compound crystallizes in orthorhombic space group Pmma (a=9.325 (3) A, b=3.198 (1) A, c=8.043 (3) A at 296 K) with 12 atoms per unit cell and represents a new structure type. The structure of Li{sub 2-x}Ag{sub 1+x}In{sub 3} is closely related to the LaCoAl{sub 4} structure and belongs to the structural family, the representative members of which may be derived from the hexagonal AlB{sub 2} structure type by a combination of internal deformation and substitution. The strong In-In interaction and close to zero electrons concentration around Li and Ag atoms, calculated by LTMO, allow to suggest high mobility of lithium atoms located within the channels formed by the strongly waved [-In-In-] polyanionic chains. - Graphical abstract: The crystal structure of Li{sub 2-x}Ag{sub 1+x}In{sub 3} (x=0.05) indide. Highlights: Black-Right-Pointing-Pointer The crystal structure of Li{sub 2-x}Ag{sub 1+x}In{sub 3} has been determined on a single crystal. Black-Right-Pointing-Pointer A detailed crystal chemical analysis of Li{sub 2-x}Ag{sub 1+x}In{sub 3} was performed. Black-Right-Pointing-Pointer The electronic structure of the title compound was calculated.

  20. Electronic structure and optical properties of the single crystal and two-dimensional structure of CdWO{sub 4} from first principles

    Energy Technology Data Exchange (ETDEWEB)

    Babamoradi, Mohsen, E-mail: babamoradi@iust.ac.ir [Department of Physics, Iran University of Science and Technology, Narmak, 16846-13114 Tehran (Iran, Islamic Republic of); Liyai, Mohammad Reza [Department of Physics, Iran University of Science and Technology, Narmak, 16846-13114 Tehran (Iran, Islamic Republic of); Azimirad, Rouhollah, E-mail: azimirad@yahoo.com [Malek-Ashtar University of Technology, Tehran (Iran, Islamic Republic of); Salehi, Hamdollah, E-mail: salehi_h@scu.ac.ir [Department of Physics, Faculty of Science, Shahid Chamran University of Ahvaz, Ahvaz (Iran, Islamic Republic of)

    2017-04-15

    In this paper, we have investigated the electronic structure and optical properties of the single crystal and two-dimensional (2D) structure of cadmium tungstate (CdWO{sub 4}). This investigation includes calculation of the density of states (DOS), dielectric tensor elements and reflectivity. All the calculations have been done by full potential augmented plane waves plus local orbitals (FP-APW+lo) with Wien2k code. The calculated band gaps for the single crystal and 2D structure along [010] direction are 4.2 and 5.02 eV, respectively. The results show that in the 2D structure of CdWO{sub 4}, the electron density of the surface oxygen atoms is much more than the electron density of the inside oxygen atoms. This difference in the density has the main role in the optical properties. The results of the dielectric tensor elements and reflectivity for the single crystal are in good agreement with the experimental values. The results of the dielectric tensor elements and reflectivity for the 2D structure in comparison with the single crystal have shown that the intensity and place of the calculated peaks reduced and shifted, respectively. These results can be related to the surface oxygen atoms and thickness of the 2D structure.

  1. Electron transfer from NADH bound to horse liver alcohol dehydrogenase (NAD+ dependent dehydrogenase): visualisation of the activity in the enzyme crystals and adsorption of formazan derivatives by these crystals.

    Science.gov (United States)

    Pacaud-Mercier, Karine; Blaghen, Mohamed; Lee, Kang Min; Tritsch, Denis; Biellmann, Jean-François

    2007-02-01

    The crystals of holoenzyme from native and cross-linked alcohol dehydrogenase exhibit electron transfer from NADH to phenazinium methosulfate (PMS), and then to the tetrazolium salt sodium 3,3'-{1-[(phenylamino)carbonyl]-3,4-tetrazolium}-bis(4-methoxy-6-nitro)benzenesulfonate (XXT). The slow dissociation of the cofactor and/or the conformational change associated can now be bypassed. The reduction product, formazan, did not diffuse out of the crystals in buffer and the crystals turned colored. In the presence of dimethyl sulfoxide or dimethoxyethane, the formazan diffused out to the solution. The reaction rates were found to be, respectively, 18% and 15% of the redox reaction rate of ethanol with cinnamaldehyde, close to the activity determined for the enzyme in solution in the presence of dimethoxyethane. The use of system PMS-tetrazolium salt is a useful tool to visualize the activity of dehydrogenases and other electron transferring systems in the crystalline state. The adsorption of formazan by the alcohol dehydrogenase crystals occurs in solution.

  2. Effect of Electron Beam on the Structure and Crystallization Features of BaO-SrO-TiO2-SiO2 Glass

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    Glasses of BaO-SrO-TiO2-SiO2 after electronic radiation treatment of 50-1000 kgy were studied by means of IR spectra, DTA and visible light absorption method.The result shows that the glass structure is changed due to the formation of structure defect from oxygen vacancy and E′ color center,which resultsd in the crystallization process and new precursors,and decreasement of Tg temperature and crystallization peaks by 20-50℃.

  3. Calculations of the electronic levels, spin-Hamiltonian parameters and vibrational spectra for the CrCl3 layered crystals

    Science.gov (United States)

    Avram, C. N.; Gruia, A. S.; Brik, M. G.; Barb, A. M.

    2015-12-01

    Calculations of the Cr3+ energy levels, spin-Hamiltonian parameters and vibrational spectra for the layered CrCl3 crystals are reported for the first time. The crystal field parameters and the energy level scheme were calculated in the framework of the Exchange Charge Model of crystal field. The spin-Hamiltonian parameters (zero-field splitting parameter D and g-factors) for Cr3+ ion in CrCl3 crystals were obtained using two independent techniques: i) semi-empirical crystal field theory and ii) density functional theory (DFT)-based model. In the first approach, the spin-Hamiltonian parameters were calculated from the perturbation theory method and the complete diagonalization (of energy matrix) method. The infrared (IR) and Raman frequencies were calculated for both experimental and fully optimized geometry of the crystal structure, using CRYSTAL09 software. The obtained results are discussed and compared with the experimental available data.

  4. Granulometric composition study of mineral resources using opto-electronic devices and Elsieve software system

    Directory of Open Access Journals (Sweden)

    Kaminski Stanislaw

    2016-01-01

    Full Text Available The use of mechanical sieves has a great impact on measurement results because occurrence of anisometric particles causes undercounting the average size. Such errors can be avoided by using opto-electronic measuring devices that enable measurement of particles from 10 μm up to a few dozen millimetres in size. The results of measurement of each particle size fraction are summed up proportionally to its weight with the use of Elsieve software system and for every type of material particle-size distribution can be obtained. The software allows further statistical interpretation of the results. Beam of infrared radiation identifies size of particles and counts them precisely. Every particle is represented by an electronic impulse proportional to its size. Measurement of particles in aqueous suspension that replaces the hydrometer method can be carried out by using the IPS L analyser (range from 0.2 to 600 μm. The IPS UA analyser (range from 0.5 to 2000 μm is designed for measurement in the air. An ultrasonic adapter enables performing measurements of moist and aggregated particles from 0.5 to 1000 μm. The construction and software system allow to determine second dimension of the particle, its shape coefficient and specific surface area. The AWK 3D analyser (range from 0.2 to 31.5 mm is devoted to measurement of various powdery materials with subsequent determination of particle shape. The AWK B analyser (range from 1 to 130 mm measures materials of thick granulation and shape of the grains. The presented method of measurement repeatedly accelerates and facilitates study of granulometric composition.

  5. Flare plasma dynamics obseved with the YOHKOH Bragg crystal spectrometer. III. Spectral signatures of electron-beam-heated atmospheres.

    Science.gov (United States)

    Marriska, John. T.

    1995-05-01

    Using numerical simulations of an electon-beam-heated solar flare, we investigate the observational consequences of variations in the electron beam total energy flux and the low-energy cut off value for models with both low and high initial densities. To do this we use the evolution of the physical parameters of the simulated flares to synthesize the time evolution of the spectrum in the wavelength region surrounding tha Ca xix resonance line. These spectra are then summed over a 9 s time interval to simulate typical spectra from the Yohkoh Bragg crystal spectometer and the first three moments are computed for comparison with observational results. This comparison shows that no single low or high initial density model satisfies the observed average behavior of the Ca xix resonance line. Low initial density models produce too large a blue shift velocity, while high initial density model have lines that are too narrow. Comparison of these models with the Yohkok data suggests that the key problem for models of the impulsive phase ofa solar flare is producing significant amounts of stationary hot plasma early in the flare.

  6. Site occupation, phase stability, crystal and electronic structures of the doped S phase (Al2CuMg)

    Science.gov (United States)

    Gu, Jianglong; Gu, Huimin; Zhai, Yuchun; Ma, Peihua

    2016-07-01

    The S phase (Al2CuMg) is an important strengthening phase for the Al-Cu-Mg alloys, which are widely used in the aerospace and transportation industries. The commonly added alloying elements (Mn, Ti, Zr) and the impurity elements (Fe and Si) in the Al-Cu-Mg alloys are always found in the S phase. First-principles calculations based on the density functional theory (DFT) were used to investigate the influence of doping Mn, Ti, Zr, Fe and Si elements on the S phase. Key findings demonstrated that these elements prefer to occupy different atomic sites in the S phase. Ti and Zr improved the structural stability of the S phase. The bulk modulus of the Fe, Si, Ti and Zr doped S phases becomes larger than that of the pure S phase. Both the crystal and electronic structures of the S phase are affected by the dopants. The results of this study provide a better theoretical understanding of the S phase, providing guidance for improved composition design and performance optimization of Al-Cu-Mg alloys.

  7. Automatic recovery of missing amplitudes and phases in tilt-limited electron crystallography of two-dimensional crystals

    Science.gov (United States)

    Gipson, Bryant R.; Masiel, Daniel J.; Browning, Nigel D.; Spence, John; Mitsuoka, Kaoru; Stahlberg, Henning

    2011-07-01

    Electron crystallography of 2D protein crystals provides a powerful tool for the determination of membrane protein structure. In this method, data is acquired in the Fourier domain as randomly sampled, uncoupled, amplitudes and phases. Due to physical constraints on specimen tilting, those Fourier data show a vast un-sampled “missing cone” of information, producing resolution loss in the direction perpendicular to the membrane plane. Based on the flexible language of projection onto sets, we provide a full solution for these problems with a projective constraint optimization algorithm that, for sufficiently oversampled data, produces complete recovery of unmeasured data in the missing cone. We apply this method to an experimental data set of Bacteriorhodopsin and show that, in addition to producing superior results compared to traditional reconstruction methods, full, reproducible, recovery of the missing cone from noisy data is possible. Finally, we present an automatic implementation of the refinement routine as open source, freely distributed, software that will be included in our 2dx software package.

  8. Effect of (1010) crystal orientation on electronic properties of wurtzite GaN/AlGaN quantum-well

    CERN Document Server

    Park, S H

    2000-01-01

    The electronic properties of a (1010)-oriented wurtzite (WZ) GaN/AlGaN quantum well (QW) are investigated using the multiband effective-mass theory. These results are compared with those of a (0001)-oriented WZ GaN/AlGaN QW with the piezoelectric (PZ) effect taken into account. For the (0001)-oriented structure, the optical matrix element is significantly reduced with increasing the well thickness due to the PZ electric field. This means that, in the (0001)-oriented structure, a QW structure with a thinner well thickness is desirable to obtain better laser characteristics. For the (1010)-oriented structure, it is found that the average hole effective masses are largely reduced compared to those for the (0001)-oriented structure. Also, the (1010)-oriented structure shows a much larger optical matrix element for g'-polarization due to the crystal orientation effect. These results suggest that the (1010)-oriented QW structures show improved characteristic compared to the (0001)-oriented QW structure with the PZ ...

  9. Soliton assisted control of source to drain electron transport along natural channels - crystallographic axes - in two-dimensional triangular crystal lattices

    Science.gov (United States)

    Chetverikov, A. P.; Ebeling, W.; Velarde, M. G.

    2016-09-01

    We present computational evidence of the possibility of fast, supersonic or subsonic, nearly loss-free ballistic-like transport of electrons bound to lattice solitons (a form of electron surfing on acoustic waves) along crystallographic axes in two-dimensional anharmonic crystal lattices. First we study the structural changes a soliton creates in the lattice and the time lapse of recovery of the lattice. Then we study the behavior of one electron in the polarization field of one and two solitons with crossing pathways with suitably monitored delay. We show how an electron surfing on a lattice soliton may switch to surf on the second soliton and hence changing accordingly the direction of its path. Finally we discuss the possibility to control the way an excess electron proceeds from a source at a border of the lattice to a selected drain at another border by following appropriate straight pathways on crystallographic axes.

  10. Radiation emission and its influence on the motion of multi-GeV electrons and positrons incident on a single diamond crystal

    Energy Technology Data Exchange (ETDEWEB)

    Kirsebom, K.; Mikkelsen, U.; Uggerhoej, E. E-mail: ugh@ifa.au.dk; Elsener, K.; Ballestrero, S.; Sona, P.; Connell, S.H.; Sellschop, J.P.F.; Vilakazi, Z.Z

    2001-04-01

    A few years ago the CERN NA-43 collaboration installed an upgraded detector system which allows a detailed analysis of the particle motion before, during and after penetration of a crystal. Also, essentially perfect diamond crystals were produced by the collaborators from Schonland Research Centre. These facts have led to new and very detailed investigations of QED-processes in strong crystalline fields. Along axial directions the radiation emission is enhanced by more than two orders of magnitude. For incidence on a 0.7 mm thick diamond crystal of well-aligned 149 GeV electrons, 35% give rise to a high energy photon peak at {approx_equal}120 GeV. For 243 GeV electrons and {approx_equal}200 GeV photons, this number decreases to 25% - which may be an indication of quantum suppression. Different measurements of the photon multiplicities show that in most cases positrons and electrons emit equal number of photons. The dramatic radiation emission leads to a strong reduction in transverse energy and all electrons incident within the critical angle are captured to high lying channeling states and exit at channeling angles corresponding to their final energy - a completely new result for negatively charged particles. For the first time, we present an analysis where the photon is used as a 'messenger' for the transverse energy of the electron during the formation time and we conclude that the more energetic photons are created closer to the string and emitted in the axial direction - in contrast to earlier calculations using the Dirac equation. The strongly enhanced radiation emission leads to angular cooling for electrons but angular heating for positrons and we show that at higher electron energies the cooling becomes stronger as expected from theory. For electrons, the radiative cooling gives rise to a capture of above-barrier particles into the channeled beam. The total radiative energy loss is shown as not to follow the {gamma}{sup 2}-law expected from

  11. Radiation emission and its influence on the motion of multi-GeV electrons and positrons incident on a single diamond crystal

    Science.gov (United States)

    Kirsebom, K.; Mikkelsen, U.; Uggerhøj, E.; Elsener, K.; Ballestrero, S.; Sona, P.; Connell, S. H.; Sellschop, J. P. F.; Vilakazi, Z. Z.

    2001-04-01

    A few years ago the CERN NA-43 collaboration installed an upgraded detector system which allows a detailed analysis of the particle motion before, during and after penetration of a crystal. Also, essentially perfect diamond crystals were produced by the collaborators from Schonland Research Centre. These facts have led to new and very detailed investigations of QED-processes in strong crystalline fields. Along axial directions the radiation emission is enhanced by more than two orders of magnitude. For incidence on a 0.7 mm thick diamond crystal of well-aligned 149 GeV electrons, 35% give rise to a high energy photon peak at ≃120 GeV. For 243 GeV electrons and ≃200 GeV photons, this number decreases to 25% - which may be an indication of quantum suppression. Different measurements of the photon multiplicities show that in most cases positrons and electrons emit equal number of photons. The dramatic radiation emission leads to a strong reduction in transverse energy and all electrons incident within the critical angle are captured to high lying channeling states and exit at channeling angles corresponding to their final energy - a completely new result for negatively charged particles. For the first time, we present an analysis where the photon is used as a `messenger' for the transverse energy of the electron during the formation time and we conclude that the more energetic photons are created closer to the string and emitted in the axial direction - in contrast to earlier calculations using the Dirac equation. The strongly enhanced radiation emission leads to angular cooling for electrons but angular heating for positrons and we show that at higher electron energies the cooling becomes stronger as expected from theory. For electrons, the radiative cooling gives rise to a capture of above-barrier particles into the channeled beam. The total radiative energy loss is shown as not to follow the γ2-law expected from classical electrodynamics, but turns over

  12. 试论图书馆电子资源与纸本资源的协调发展%The coordinated development of library electronic resources and paper resources

    Institute of Scientific and Technical Information of China (English)

    冯雷

    2012-01-01

      纸本资源和电子资源属于公共图书馆文献资源中两个非常重要的资源类型,纸本资源和电子资源的协调发展在图书馆的可持续发展过程中起着非常重要的作用。本文对如何实现图书馆电子资源和纸本资源之间的协调发展进行了探讨,希望能够为图书馆文献资源的管理提供一些参考。%  The paper and electronic resources are two very important types of literature resources of public libraries, the coordinated development of the paper and electronic resources play a very important role in the sustainable development process of the library. This article discusses how to realize the coordinated development of library electronic resources and paper resources, hope to provide some reference for library literature resource management.

  13. Fast crystallization of amorphous Gd{sub 2}Zr{sub 2}O{sub 7} induced by thermally activated electron-beam irradiation

    Energy Technology Data Exchange (ETDEWEB)

    Huang, Zhangyi; Qi, Jianqi, E-mail: qijianqi@scu.edu.cn; Zhou, Li; Feng, Zhao; Yu, Xiaohe [College of Physical Science and Technology, Sichuan University, Chengdu 610064 (China); Key Laboratory of Radiation Physics and Technology of Ministry of Education, Sichuan University, Chengdu 610064 (China); Gong, Yichao [College of Materials Science and Engineering, Sichuan University, Chengdu 610064 (China); Yang, Mao; Wei, Nian [College of Physical Science and Technology, Sichuan University, Chengdu 610064 (China); Key Laboratory of High Energy Density Physics of Ministry of Education, Sichuan University, Chengdu 610064 (China); Shi, Qiwu [College of Physical Science and Technology, Sichuan University, Chengdu 610064 (China); College of Materials Science and Engineering, Sichuan University, Chengdu 610064 (China); Lu, Tiecheng, E-mail: lutiecheng@scu.edu.cn [College of Physical Science and Technology, Sichuan University, Chengdu 610064 (China); Key Laboratory of Radiation Physics and Technology of Ministry of Education, Sichuan University, Chengdu 610064 (China); Key Laboratory of High Energy Density Physics of Ministry of Education, Sichuan University, Chengdu 610064 (China)

    2015-12-07

    We investigate the ionization and displacement effects of an electron-beam (e-beam) on amorphous Gd{sub 2}Zr{sub 2}O{sub 7} synthesized by the co-precipitation and calcination methods. The as-received amorphous specimens were irradiated under electron beams at different energies (80 keV, 120 keV, and 2 MeV) and then characterized by X-ray diffraction and transmission electron microscopy. A metastable fluorite phase was observed in nanocrystalline Gd{sub 2}Zr{sub 2}O{sub 7} and is proposed to arise from the relatively lower surface and interface energy compared with the pyrochlore phase. Fast crystallization could be induced by 120 keV e-beam irradiation (beam current = 0.47 mA/cm{sup 2}). The crystallization occurred on the nanoscale upon ionization irradiation at 400 °C after a dose of less than 10{sup 17} electrons/cm{sup 2}. Under e-beam irradiation, the activation energy for the grain growth process was approximately 10 kJ/mol, but the activation energy was 135 kJ/mol by calcination in a furnace. The thermally activated ionization process was considered the fast crystallization mechanism.

  14. Radiation emission and its influence on the motion of multi-GeV electrons and positrons incident on a single diamond crystal

    CERN Document Server

    Kirsebom, K; Uggerhøj, Erik; Elsener, K; Ballestrero, S; Sona, P; Connell, S H; Sellschop, J P Friedel; Vilakazi, Z Z

    2001-01-01

    A few years ago the CERN NA-43 collaboration installed an upgraded detector system which allows a detailed analysis of the particle motion before, during and after penetration of a crystal. Also, essentially perfect diamond crystals were produced by the collaborators from Schonland Research Centre. These facts have led to new and very detailed investigations of QED-processes in strong crystalline fields. Along axial directions the radiation emission is enhanced by more than two orders of magnitude. For incidence on a 0.7 mm thick diamond crystal of well-aligned 149 GeV electrons, 35% give rise to a high energy photon peak at approximately=120 GeV. For 243 GeV electrons and approximately=200 GeV photons, this number decreases to 25%-which may be an indication of quantum suppression. Different measurements of the photon multiplicities show that in most cases positrons and electrons emit equal number of photons. The dramatic radiation emission leads to a strong reduction in transverse energy and all electrons in...

  15. On the Development of Electronic Resources and Paper Resources%关于电子资源与纸本资源协调发展的思考和建议

    Institute of Scientific and Technical Information of China (English)

    王军武

    2012-01-01

    In recent years, a large number of electronic resources was introduced to the libraries, which has become an im- portant component of library resource system. However, there are also a lot of hot debates about the following issues, such as how to build a traditional paper resources, how to deal with the relationship between paper resources and electronic resources, how to build a library resources development system, etc. These problems also confused many librarians who are building resources in the library. With the combination with the opinions from some experts, research scholars, the paper proposed some guiding principles to deal with the relationship between electronic resources and paper resources. Taking all the aspects into consideration, such as the concepts of the library, the funding of the resources, the policies and structure of the library, cooperative development, the paper also proposes some measures for the development of electronic resources and paper resources.%在复合图书馆环境下,如何协调发展电子资源与纸本资源是图书馆界专家、学者研究和探讨的热点问题,也是许多图书馆工作者在文献资源建设实践中十分困惑的问题。文章结合有关专家、学者的研究成果及图书馆的相关案例,概述了电子资源与纸本资源协调发展应遵循的指导性原则,并从馆藏理念、经费投入、馆藏政策、馆藏结构、合作发展、服务利用等几个方面提出了协调发展电子资源与纸本资源的若干举措。

  16. In situ direct observation of photocorrosion in ZnO crystals in ionic liquid using a laser-equipped high-voltage electron microscope

    Directory of Open Access Journals (Sweden)

    J. Ishioka

    2017-03-01

    Full Text Available ZnO photocatalysts in water react with environmental water molecules and corrode under illumination. ZnO nanorods in water can also grow because of water splitting induced by UV irradiation. To investigate their morphological behavior caused by crystal growth and corrosion, here we developed a new laser-equipped high-voltage electron microscope and observed crystal ZnO nanorods immersed in ionic liquid. Exposing the specimen holder to a laser with a wavelength of 325 nm, we observed the photocorrosion in situ at the atomic scale for the first time. This experiment revealed that Zn and O atoms near the interface between the ZnO nanorods and the ionic liquid tended to dissolve into the liquid. The polarity and facet of the nanorods were strongly related to photocorrosion and crystal growth.

  17. Electron microscopic analysis of surface damaged layer in Pb(Mg1/3Nb2/3)O3-PbTiO3 single crystal

    Science.gov (United States)

    Kasuya, Yusuke; Sato, Yukio; Urakami, Ryosuke; Yamada, Kazuhiro; Teranishi, Ryo; Kaneko, Kenji

    2017-01-01

    Single crystals of lead magnesium niobate-lead titanate, Pb(Mg1/3Nb2/3)O3-PbTiO3 (PMN-PT), have superior dielectric and piezoelectric properties suitable for medical ultrasound imaging. Imaging devices with superior performance can be manufactured from thinner PMN-PT single crystals by mechanical dicing and/or polishing. Although it is often a concern that a damaged layer may form during the mechanical dicing and/or thinning process, the microscopic characteristics of the damaged layer have not yet been investigated in detail. In this study, the microstructural characterization of a damaged layer was investigated by transmission electron microscopy. It was found that mechanical polishing introduced dislocation near the surface of the crystal. It was also found that the domain structure was affected by the introduction of dislocation.

  18. Green Supply Chain Collaboration for Fashionable Consumer Electronics Products under Third-Party Power Intervention—A Resource Dependence Perspective

    Directory of Open Access Journals (Sweden)

    Jiuh-Biing Sheu

    2014-05-01

    Full Text Available Under third-party power intervention (TPPI, which increases uncertainty in task environments, complex channel power interplays and restructuring are indispensable among green supply chain members as they move toward sustainable collaborative relationships for increased viability and competitive advantage. From the resource dependence perspective, this work presents a novel conceptual model to investigate the influence of political and social power on channel power restructuring and induced green supply chain collaboration in brander-retailer bidirectional green supply chains of fashionable consumer electronics products (FCEPs. An FCEP refers to the consumer electronics product (e.g., personal computers, mobile phones, computer notebooks, and game consoles with the features of a well-known brand associated, a short product lifecycle, timely and fashionable design fit for market trends, and quick responsiveness to the variations of market demands. The proposed model is tested empirically using questionnaire data obtained from retailers in the FCEP brander-retailer distribution channels. Analytical results reveal that as an extension of political and social power, TPPI positively affects the reciprocal interdependence of dyadic members and reduces power asymmetry, thereby enhancing the collaborative relationship of dyadic members and leading to improved green supply chain performance. Therein, reciprocal interdependence underlying collaborative relationship is the key to reducing the external environmental uncertainties in the TPPI context.

  19. Effects of Side-Chain and Electron Exchange Correlation on the Band Structure of Perylene Diimide Liquid Crystals: A Density Functional Study

    Energy Technology Data Exchange (ETDEWEB)

    Arantes, J. T.; Lima, M. P.; Fazzio, A.; Xiang, H.; Wei, S. H.; Dalpian, G. M.

    2009-04-01

    The structural and electronic properties of perylene diimide liquid crystal PPEEB are studied using ab initio methods based on the density functional theory (DFT). Using available experimental crystallographic data as a guide, we propose a detailed structural model for the packing of solid PPEEB. We find that due to the localized nature of the band edge wave function, theoretical approaches beyond the standard method, such as hybrid functional (PBE0), are required to correctly characterize the band structure of this material. Moreover, unlike previous assumptions, we observe the formation of hydrogen bonds between the side chains of different molecules, which leads to a dispersion of the energy levels. This result indicates that the side chains of the molecular crystal not only are responsible for its structural conformation but also can be used for tuning the electronic and optical properties of these materials.

  20. Electronic Raman scattering in heavily overdoped (Y,Ca)Ba{sub 2}Cu{sub 3}O{sub 7-{delta}} crystals

    Energy Technology Data Exchange (ETDEWEB)

    Limonov, M.; Masui, T.; Uchiyama, H.; Lee, S.; Tajima, S.; Yamanaka, A

    2003-10-15

    In order to get insight into the overdoped electronic state, Raman scattering in heavily overdoped detwinned (Y,Ca)Ba{sub 2}Cu{sub 3}O{sub 7-{delta}} crystals (T{sub c}=65 K) has been investigated. In the A{sub 1g} and B{sub 1g} polarizations, the electronic pair-breaking peak is located at nearly the same energy of about 220 cm{sup -1}, in contrast to the polarization dependent position of the peak in optimally doped YBa{sub 2}Cu{sub 3} O{sub 7-{delta}} crystals. The result is in favor of d + s-pairing symmetry in this overdoped material. The spectra also show the strong superconductivity induced XY-anisotropy in intensity of the pair-breaking peak, which indicates the existence of quantum interference between CuO{sub 2} planes and CuO-chains in this compound.