WorldWideScience

Sample records for atomic energy institute

  1. Electromagnetic separation of stable isotopes at the Institute of Atomic Energy, Academia Sinica

    Science.gov (United States)

    Ming-da, Hua; Gong-pan, Li; Shi-jun, Su; Nai-feng, Mao; Hung-yung, Lu

    1981-07-01

    For almost 20 years the Institute of Atomic Energy, Academia Sinica has been separating stable isotopes of the elements by electromagnetic separators and supplying these materials to research work in many fields of our country. In this article we shall attempt to outline the growth of the effort and describe the present situation.

  2. Scaled-Down Moderator Circulation Test Facility at Korea Atomic Energy Research Institute

    OpenAIRE

    2016-01-01

    Korea Atomic Energy Research Institute (KAERI) started the experimental research on moderator circulation as one of a the national research and development programs from 2012. This research program includes the construction of the moderator circulation test (MCT) facility, production of the validation data for self-reliant computational fluid dynamics (CFD) tools, and development of optical measurement system using the particle image velocimetry (PIV). In the present paper we introduce the sc...

  3. Atomic energy

    CERN Multimedia

    1996-01-01

    Interviews following the 1991 co-operation Agreement between the Department of Atomic Energy (DAE) of the Government of India and the European Organization for Nuclear Research (CERN) concerning the participation in the Large Hadron Collider Project (LHC) . With Chidambaram, R, Chairman, Atomic Energy Commission and Secretary, Department of Atomic Energy, Department of Atomic Energy (DAE) of the Government of India and Professor Llewellyn-Smith, Christopher H, Director-General, CERN.

  4. Current and anticipated uses of thermal hydraulic codes at the Japan Atomic Energy Research Institute

    Energy Technology Data Exchange (ETDEWEB)

    Akimoto, Hajime; Kukita; Ohnuki, Akira [Japan Atomic Energy Research Institute, Ibaraki (Japan)

    1997-07-01

    The Japan Atomic Energy Research Institute (JAERI) is conducting several research programs related to thermal-hydraulic and neutronic behavior of light water reactors (LWRs). These include LWR safety research projects, which are conducted in accordance with the Nuclear Safety Commission`s research plan, and reactor engineering projects for the development of innovative reactor designs or core/fuel designs. Thermal-hydraulic and neutronic codes are used for various purposes including experimental analysis, nuclear power plant (NPP) safety analysis, and design assessment.

  5. Scaled-Down Moderator Circulation Test Facility at Korea Atomic Energy Research Institute

    Directory of Open Access Journals (Sweden)

    Hyoung Tae Kim

    2016-01-01

    Full Text Available Korea Atomic Energy Research Institute (KAERI started the experimental research on moderator circulation as one of a the national research and development programs from 2012. This research program includes the construction of the moderator circulation test (MCT facility, production of the validation data for self-reliant computational fluid dynamics (CFD tools, and development of optical measurement system using the particle image velocimetry (PIV. In the present paper we introduce the scaling analysis performed to extend the scaling criteria suitable for reproducing thermal-hydraulic phenomena in a scaled-down CANDU- (CANada Deuterium Uranium- 6 moderator tank, a manufacturing status of the 1/4 scale moderator tank. Also, preliminary CFD analysis results for the full-size and scaled-down moderator tanks are carried out to check whether the moderator flow and temperature patterns of both the full-size reactor and scaled-down facility are identical.

  6. Hot cell renovation in the spent fuel conditioning process facility at the Korea Atomic Energy Research Institute

    Energy Technology Data Exchange (ETDEWEB)

    Yu, Seung Nam; Lee, Jong Kwang; Park, Byung Suk; Cho, Il Je; Kim, Ki Ho [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of)

    2015-10-15

    The advanced spent fuel conditioning process facility (ACPF) of the irradiated materials examination facility (IMEF) at the Korea Atomic Energy Research Institute (KAERI) has been renovated to implement a lab scale electrolytic reduction process for pyroprocessing. The interior and exterior structures of the ACPF hot cell have been modified under the current renovation project for the experimentation of the electrolytic reduction process using spent nuclear fuel. The most important aspect of this renovation was the installation of the argon compartment within the hot cell. For the design and system implementation of the argon compartment system, a full-scale mock-up test and a three-dimensional (3D) simulation test were conducted in advance. The remodeling and repairing of the process cell (M8a), the maintenance cell (M8b), the isolation room, and their utilities were also planned through this simulation to accommodate the designed argon compartment system. Based on the considered refurbishment workflow, previous equipment in the M8 cell, including vessels and pipes, were removed and disposed of successfully after a zoning smear survey and decontamination, and new equipment with advanced functions and specifications were installed in the hot cell. Finally, the operating area and isolation room were also refurbished to meet the requirements of the improved hot cell facility.

  7. Great Lakes Energy Institute

    Energy Technology Data Exchange (ETDEWEB)

    Alexander, J. Iwan [Case Western Reserve Univ., Cleveland, OH (United States)

    2012-11-18

    The vision of the Great Lakes Energy Institute is to enable the transition to advanced, sustainable energy generation, storage, distribution and utilization through coordinated research, development, and education. The Institute will place emphasis on translating leading edge research into next generation energy technology. The Institute’s research thrusts focus on coordinated research in decentralized power generation devices (e.g. fuel cells, wind turbines, solar photovoltaic devices), management of electrical power transmission and distribution, energy storage, and energy efficiency.

  8. Visit of Mr. Susumu Yoda, Japanese Atomic Energy Commission, Mr. Nobuo Natsume, Vice-President, Central Research Institute of Electric Power Industry, Japan (CRIEPI), Mr. Nobuya Yoshiki, CRIEPI, Mrs. Seiko Ichikawa, Interpreter, with Mr. Taylor of CERN, visiting SM18

    CERN Multimedia

    Laurent Guiraud

    2000-01-01

    Visit of Mr. Susumu Yoda, Japanese Atomic Energy Commission, Mr. Nobuo Natsume, Vice-President, Central Research Institute of Electric Power Industry, Japan (CRIEPI), Mr. Nobuya Yoshiki, CRIEPI, Mrs. Seiko Ichikawa, Interpreter, with Mr. Taylor of CERN, visiting SM18

  9. Energy from the Atom.

    Science.gov (United States)

    Smith, Patricia L.

    This curriculum guide was written to supplement fifth and sixth grade science units on matter and energy. It was designed to provide more in-depth material on the atom. The first part, "Teacher Guide," contains background information, biographical sketches of persons in the history of nuclear energy, vocabulary, answer sheets, management sheets…

  10. Institute for Sustainable Energy

    Energy Technology Data Exchange (ETDEWEB)

    Agrawal, Ajay [Univ. of Alabama, Tuscaloosa, AL (United States)

    2016-03-28

    Alternate fuels offer unique challenges and opportunities as energy source for power generation, vehicular transportation, and industrial applications. Institute for Sustainable Energy (ISE) at UA conducts innovative research to utilize the complex mix of domestically-produced alternate fuels to achieve low-emissions, high energy-efficiency, and fuel-flexibility. ISE also provides educational and advancement opportunities to students and researchers in the energy field. Basic research probing the physics and chemistry of alternative fuels has generated practical concepts investigated in a burner and engine test platforms.

  11. Institutional analysis for energy policy

    Energy Technology Data Exchange (ETDEWEB)

    Morris, F.A.; Cole, R.J.

    1980-07-01

    This report summarizes principles, techniques, and other information for doing institutional analyses in the area of energy policy. The report was prepared to support DOE's Regional Issues Identification and Assessment (RIIA) program. RIIA identifies environmental, health, safety, socioeconomic, and institutional issues that could accompany hypothetical future scenarios for energy consumption and production on a regional basis. Chapter 1 provides some theoretical grounding in institutional analysis. Chapter 2 provides information on constructing institutional maps of the processes for bringing on line energy technologies and facilities contemplated in RIIA scenarios. Chapter 3 assesses the institutional constraints, opportunities, and impacts that affect whether these technologies and facilities would in fact be developed. Chapters 4 and 5 show how institutional analysis can support use of exercises such as RIIA in planning institutional change and making energy policy choices.

  12. High-energy atomic physics

    CERN Document Server

    Drukarev, Evgeny G

    2016-01-01

    This self-contained text introduces readers to the field of high-energy atomic physics - a new regime of photon-atom interactions in which the photon energies significantly exceed the atomic or molecular binding energies, and which opened up with the recent advent of new synchrotron sources. From a theoretical point of view, a small-parameter characteristic of the bound system emerged, making it possible to perform analytic perturbative calculations that can in turn serve as benchmarks for more powerful numerical computations. The first part of the book introduces readers to the foundations of this new regime and its theoretical treatment. In particular, the validity of the small-parameter perturbation expansion and of the lowest-order approximation is critically reviewed. The following chapters then apply these insights to various atomic processes, such as photoionization as a many-body problem, dominant mechanisms for the production of ions at higher energies, Compton scattering and ionization accompanied b...

  13. University of Delaware Energy Institute

    Energy Technology Data Exchange (ETDEWEB)

    Klein, Michael T

    2012-09-30

    The main goal of this project funded through this DOE grant is to help in the establishment of the University of Delaware Energy Institute (UDEI) which is designed to be a long-term, on-going project. The broad mission of UDEI is to develop collaborative programs encouraging research activities in the new and emerging energy technologies and to partner with industry and government in meeting the challenges posed by the nation's pressing energy needs.

  14. Atomic Batteries: Energy from Radioactivity

    OpenAIRE

    Kumar, Suhas

    2015-01-01

    With alternate, sustainable, natural sources of energy being sought after, there is new interest in energy from radioactivity, including natural and waste radioactive materials. A study of various atomic batteries is presented with perspectives of development and comparisons of performance parameters and cost. We discuss radioisotope thermal generators, indirect conversion batteries, direct conversion batteries, and direct charge batteries. We qualitatively describe their principles of operat...

  15. A Quantum Model of Atoms (the Energy Levels of Atoms).

    Science.gov (United States)

    Rafie, Francois

    2001-01-01

    Discusses the model for all atoms which was developed on the same basis as Bohr's model for the hydrogen atom. Calculates the radii and the energies of the orbits. Demonstrates how the model obeys the de Broglie's hypothesis that the moving electron exhibits both wave and particle properties. (Author/ASK)

  16. Atomic energy levels and Grotrian diagrams

    CERN Document Server

    Bashkin, Stanley

    1975-01-01

    Atomic Energy Levels and Grotrian Diagrams, Volume I: Hydrogen I - Phosphorus XV presents diagrams of various elements that show their energy level and electronic transitions. The book covers the first 15 elements according to their atomic number. The text will be of great use to researchers and practitioners of fields such as astrophysics that requires pictorial representation of the energy levels and electronic transitions of elements.

  17. An Institutional Approach to Understanding Energy Transitions

    Science.gov (United States)

    Koster, Auriane Magdalena

    Energy is a central concern of sustainability because how we produce and consume energy affects society, economy, and the environment. Sustainability scientists are interested in energy transitions away from fossil fuels because they are nonrenewable, increasingly expensive, have adverse health effects, and may be the main driver of climate change. They see an opportunity for developing countries to avoid the negative consequences fossil-fuel-based energy systems, and also to increase resilience, by leap-frogging-over the centralized energy grid systems that dominate the developed world. Energy transitions pose both challenges and opportunities. Obstacles to transitions include 1) an existing, centralized, complex energy-grid system, whose function is invisible to most users, 2) coordination and collective-action problems that are path dependent, and 3) difficulty in scaling up RE technologies. Because energy transitions rely on technological and social innovations, I am interested in how institutional factors can be leveraged to surmount these obstacles. The overarching question that underlies my research is: What constellation of institutional, biophysical, and social factors are essential for an energy transition? My objective is to derive a set of "design principles," that I term institutional drivers, for energy transitions analogous to Ostrom's institutional design principles. My dissertation research will analyze energy transitions using two approaches: applying the Institutional Analysis and Development Framework and a comparative case study analysis comprised of both primary and secondary sources. This dissertation includes: 1) an analysis of the world's energy portfolio; 2) a case study analysis of five countries; 3) a description of the institutional factors likely to promote a transition to renewable-energy use; and 4) an in-depth case study of Thailand's progress in replacing nonrenewable energy sources with renewable energy sources. My research will

  18. A History of the Atomic Energy Commission

    Science.gov (United States)

    Buck, Alice L.

    1983-07-01

    This pamphlet traces the history of the US Atomic Energy Commission's twenty-eight year stewardship of the Nation's nuclear energy program, from the signing of the Atomic Energy Act on August 1, 1946 to the signing of the Energy Reorganization Act on October 11, 1974. The Commission's early concentration on the military atom produced sophisticated nuclear weapons for the Nation's defense and made possible the creation of a fleet of nuclear submarines and surface ships. Extensive research in the nuclear sciences resulted in the widespread application of nuclear technology for scientific, medical and industrial purposes, while the passage of the Atomic Energy Act of 1954 made possible the development of a nuclear industry, and enabled the United States to share the new technology with other nations.

  19. Social Institutions and Nuclear Energy

    Science.gov (United States)

    Weinberg, Alvin M.

    1972-01-01

    Nuclear technologists can offer an all but infinite source of relatively cheap and clean energy" but society must decide whether the price of eternal vigilance needed to ensure proper and safe operation of its nuclear energy system" is worth the benefits. (Author/AL)

  20. Why? The nuclear and atomic energy

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Kwangwoong

    2009-01-15

    This book is a science comic book for students in elementary school, which contains energy and life such as our body and energy, animal and energy, plant and energy, kinetic energy, potential energy and the principle of the conservation of energy in the first part. The second part explains fossil fuel like coal, petroleum and natural gas. Next it deals with electric power, nuclear energy such as atom and molecule, nuclear fusion and energy for future like solar cell and black hole power plant.

  1. Institutional aspects of the energy centers concept

    Energy Technology Data Exchange (ETDEWEB)

    Esser, George H.

    1977-03-01

    Information is presented concerning the socio-economic impacts of nuclear energy centers; equity considerations relating to taxation and revenue distribution; report on jurisdictional authorities of state and local government related to centralized and decentralized alternative energy systems; federal-state conflicts and cooperation in the siting of nuclear energy facilities; the energy park experience in Pennsylvania; and a socio-economic institution summary of energy centers in Washington State.

  2. Energy Wave Model of Atom

    Institute of Scientific and Technical Information of China (English)

    伍细如

    2015-01-01

    proton emits energy wave, electron could sits any position away from nucleus, but be the most stable just when it sits at the trough of energy wave, and this position accords with Bohr radius and Schr?dinger equation.

  3. The Future of Atomic Energy

    Science.gov (United States)

    Fermi, E.

    1946-05-27

    There is definitely a technical possibility that atomic power may gradually develop into one of the principal sources of useful power. If this expectation will prove correct, great advantages can be expected to come from the fact that the weight of the fuel is almost negligible. This feature may be particularly valuable for making power available to regions of difficult access and far from deposits of coal. It also may prove a great asset in mobile power units for example in a power plant for ship propulsion. On the negative side there are some technical limitations to be applicability of atomic power of which perhaps the most serious is the impossibility of constructing light power units; also there will be some peculiar difficulties in operating atomic plants, as for example the necessity of handling highly radioactive substances which will necessitate, at least for some considerable period, the use of specially skilled personnel for the operation. But the chief obstacle in the way of developing atomic power will be the difficulty of organizing a large scale industrial development in an internationally safe way. This presents actually problems much more difficult to solve than any of the technical developments that are necessary, It will require an unusual amount of statesmanship to balance properly the necessity of allaying the international suspicion that arises from withholding technical secrets against the obvious danger of dumping the details of the procedures for an extremely dangerous new method of warfare on a world that may not yet be prepared to renounce war. Furthermore, the proper balance should be found in the relatively short time that will elapse before the 'secrets' will naturally become open knowledge by rediscovery on part of the scientists and engineers of other countries.

  4. Low Energy Atomic Photodesorption from Organic Coatings

    Directory of Open Access Journals (Sweden)

    Alessandro Lucchesini

    2016-10-01

    Full Text Available Organic coatings have been widely used in atomic physics during the last 50 years because of their mechanical properties, allowing preservation of atomic spins after collisions. Nevertheless, this did not produce detailed insight into the characteristics of the coatings and their dynamical interaction with atomic vapors. This has changed since the 1990s, when their adsorption and desorption properties triggered a renewed interest in organic coatings. In particular, a novel class of phenomena produced by non-destructive light-induced desorption of atoms embedded in the coating surface was observed and later applied in different fields. Nowadays, low energy non-resonant atomic photodesorption from organic coatings can be considered an almost standard technique whenever large densities of atomic vapors or fast modulation of their concentration are required. In this paper, we review the steps that led to this widespread diffusion, from the preliminary observations to some of the most recent applications in fundamental and applied physics.

  5. The mean excitation energy of atomic ions

    DEFF Research Database (Denmark)

    Sauer, Stephan P. A.; Oddershede, Jens; Sabin, John R.

    2015-01-01

    A method for calculation of the mean excitation energies of atomic ions is presented, making the calculation of the energy deposition of fast ions to plasmas, warm, dense matter, and complex biological systems possible. Results are reported to all ions of helium, lithium, carbon, neon, aluminum...

  6. The Harnessed Atom: Nuclear Energy & Electricity.

    Science.gov (United States)

    Department of Energy, Washington, DC. Nuclear Energy Office.

    This document is part of a nuclear energy curriculum designed for grades six through eight. The complete kit includes a written text, review exercises, activities for the students, and a teachers guide. The 19 lessons in the curriculum are divided into four units including: (1) "Energy and Electricity"; (2) "Understanding Atoms and Radiation"; (3)…

  7. ATOMIZATION CAUSED BY BOTTOM FLOW ENERGY DISSIPATION

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    Bottom flow energy dissipation is one of the common energydissipation methods for flood-releasing structures with high water head. Measures of this energy dissipation depend mainly on the turbulent action of hydraulic jump.In this paper, the physical process and the calculating methods of the atomization caused by bottom flow energy dissipation were studied, the computation models of atomization quantity for the self-aerated flow in overflow and hydraulic jump regions are presented, and the main results are of theoretical and practical significance for the hydraulic and electric engineering.

  8. NATO Advanced Study Institute on Atoms in Strong Fields

    CERN Document Server

    Clark, Charles; Nayfeh, Munir

    1990-01-01

    This book collects the lectures given at the NATO Advanced Study Institute on "Atoms in Strong Fields", which took place on the island of Kos, Greece, during the two weeks of October 9-21,1988. The designation "strong field" applies here to an external electromagnetic field that is sufficiently strong to cause highly nonlinear alterations in atomic or molecular struc­ ture and dynamics. The specific topics treated in this volume fall into two general cater­ gories, which are those for which strong field effects can be studied in detail in terrestrial laboratories: the dynamics of excited states in static or quasi-static electric and magnetic fields; and the interaction of atoms and molecules with intense laser radiation. In both areas there exist promising opportunities for research of a fundamental nature. An electric field of even a few volts per centimeter can be very strong on the atom­ ic scale, if it acts upon a weakly bound state. The study of Rydberg states with high reso­ lution laser spectroscop...

  9. Atomic orbital self-energy and electronegativity

    CERN Document Server

    Ribeiro, Mauro

    2016-01-01

    In this work, atomic calculations were performed within the local-density and generalized-gradient approximations of exchange and correlation density functionals within density-functional theory to provide accurate periodic trends of first ionization energies and electron affinities of the atomic series from hydrogen to xenon. Electronegativities were determined directly from Mulliken's formula and were shown to be equivalently calculated rather by using Slater-Janak's transition state or by calculating the electrostatic self-energies of the orbitals involved in the transition to ions. Finally, comparisons were made with other theoretical and experimental results, including Mulliken-Jaff\\'e's electronegativity scale.

  10. Summer institute of sustainability and energy

    Energy Technology Data Exchange (ETDEWEB)

    Crabtree, George W. [Univ. of Illinois, Chicago, IL (United States); Argonne National Lab. (ANL), Argonne, IL (United States)

    2012-08-01

    The vision for the Summer Institute on Sustainability and Energy (SISE) is to integrate advancements in basic energy sciences with innovative energy technologies to train the next generation of interdisciplinary scientists and policy makers for both government and industry. Through BES related research, these future leaders will be equipped to make educated decisions about energy at the personal, civic, and global levels in energy related fields including science, technology, entrepreneurship, economics, policy, planning, and behavior. This vision explicitly supports the 2008 report by the Department of Energy’s Basic Energy Science Advisory Committee (2), which outlines scientific opportunities and challenges to achieve energy security, lower CO2 emissions, reduce reliance on foreign oil and create enduring economic growth through discovery, development and the marketing of new technologies for sustainable energy production, delivery, and use (3).

  11. Institute for High Energy Density Science

    Energy Technology Data Exchange (ETDEWEB)

    Wootton, Alan [Univ. of Texas, Austin, TX (United States)

    2017-01-13

    The project objective was for the Institute of High Energy Density Science (IHEDS) at the University of Texas at Austin to help grow the High Energy Density (HED) science community, by connecting academia with the Z Facility (Z) and associated staff at Sandia National Laboratories (SNL). IHEDS was originally motivated by common interests and complementary capabilities at SNL and the University of Texas System (UTX), in 2008.

  12. Probing Dark Energy with Atom Interferometry

    CERN Document Server

    Burrage, Clare; Hinds, E A

    2015-01-01

    Theories of dark energy require a screening mechanism to explain why the associated scalar fields do not mediate observable long range fifth forces. The archetype of this is the chameleon field. Here we show that individual atoms are too small to screen the chameleon field inside a large high-vacuum chamber, and therefore can detect the field with high sensitivity. We derive new limits on the chameleon parameters from existing experiments, and show that most of the remaining chameleon parameter space is readily accessible using atom interferometry.

  13. Mid-Atlantic Regional Wind Energy Institute

    Energy Technology Data Exchange (ETDEWEB)

    Courtney Lane

    2011-12-20

    As the Department of Energy stated in its 20% Wind Energy by 2030 report, there will need to be enhanced outreach efforts on a national, state, regional, and local level to communicate wind development opportunities, benefits and challenges to a diverse set of stakeholders. To help address this need, PennFuture was awarded funding to create the Mid-Atlantic Regional Wind Energy Institute to provide general education and outreach on wind energy development across Maryland, Virginia, Delaware, Pennsylvania and West Virginia. Over the course of the two-year grant period, PennFuture used its expertise on wind energy policy and development in Pennsylvania and expanded it to other states in the Mid-Atlantic region. PennFuture accomplished this through reaching out and establishing connections with policy makers, local environmental groups, health and economic development organizations, and educational institutions and wind energy developers throughout the Mid-Atlantic region. PennFuture conducted two regional wind educational forums that brought together wind industry representatives and public interest organizations from across the region to discuss and address wind development in the Mid-Atlantic region. PennFuture developed the agenda and speakers in collaboration with experts on the ground in each state to help determine the critical issue to wind energy in each location. The sessions focused on topics ranging from the basics of wind development; model ordinance and tax issues; anti-wind arguments and counter points; wildlife issues and coalition building. In addition to in-person events, PennFuture held three webinars on (1) Generating Jobs with Wind Energy; (2) Reviving American Manufacturing with Wind Power; and (3) Wind and Transmission. PennFuture also created a web page for the institute (http://www.midatlanticwind.org) that contains an online database of fact sheets, research reports, sample advocacy letters, top anti-wind claims and information on how to

  14. Atomic Interferometry Test of Dark Energy

    CERN Document Server

    Brax, Philippe

    2016-01-01

    Atomic interferometry can be used to probe dark energy models coupled to matter. We consider the constraints coming from recent experimental results on models generalising the inverse power law chameleons such as $f(R)$ gravity in the large curvature regime, the environmentally dependent dilaton and symmetrons. Using the tomographic description of these models, we find that only symmetrons with masses smaller than the dark energy scale can be efficiently tested. In this regime, the resulting constraints complement the bounds from the E\\"otwash experiment and exclude small values of the symmetron self-coupling.

  15. Atomic displacement energy in amorphous compounds

    Science.gov (United States)

    Sanditov, D. S.; Mashanov, A. A.

    2016-12-01

    Atomic displacement energy Δɛe in multicomponent sheet and lead-silicate glasses is calculated from the free activation energy of a viscous flow. The value of Δɛe is shown to remain constant in a rather wide range of temperatures in the glass transition region. Satisfactory agreement with calculations of Δɛe using the current formula incorporating the glass transition temperature and the fluctuation volume fraction frozen at this temperature is obtained. The validity of the above formula not only at the glass transition temperature but also in the temperature region adjacent to it is confirmed.

  16. On the energy of electric field in hydrogen atom

    OpenAIRE

    Kornyushin, Yuri

    2009-01-01

    It is shown that hydrogen atom is a unique object in physics having negative energy of electric field, which is present in the atom. This refers also to some hydrogen-type atoms: hydrogen anti-atom, atom composed of proton and antiproton, and positronium.

  17. Atomic Mass and Nuclear Binding Energy for F-35 (Fluorine)

    Science.gov (United States)

    Sukhoruchkin, S. I.; Soroko, Z. N.

    This document is part of the Supplement containing the complete sets of data of Subvolume A `Nuclei with Z = 1 - 54' of Volume 22 `Nuclear Binding Energies and Atomic Masses' of Landolt-Börnstein - Group I `Elementary Particles, Nuclei and Atoms'. It provides atomic mass, mass excess, nuclear binding energy, nucleon separation energies, Q-values, and nucleon residual interaction parameters for atomic nuclei of the isotope F-35 (Fluorine, atomic number Z = 9, mass number A = 35).

  18. Ground Levels and Ionization Energies for the Neutral Atoms

    Science.gov (United States)

    SRD 111 Ground Levels and Ionization Energies for the Neutral Atoms (Web, free access)   Data for ground state electron configurations and ionization energies for the neutral atoms (Z = 1-104) including references.

  19. 32 CFR 2400.4 - Atomic Energy Material.

    Science.gov (United States)

    2010-07-01

    ... 32 National Defense 6 2010-07-01 2010-07-01 false Atomic Energy Material. 2400.4 Section 2400.4... General Provisions § 2400.4 Atomic Energy Material. Nothing in this Regulation supersedes any requirement made by or under the Atomic Energy act of 1954, as amended. “Restricted Data” and...

  20. Atom-interferometry constraints on dark energy

    CERN Document Server

    Hamilton, Paul; Haslinger, Philipp; Simmons, Quinn; Müller, Holger; Khoury, Justin

    2015-01-01

    If dark energy---which drives the accelerated expansion of the universe---consists of a new light scalar field, it might be detectable as a "fifth force" between normal-matter objects, in potential conflict with precision tests of gravity. There has, however, been much theoretical progress in developing theories with screening mechanisms, which can evade detection by suppressing forces in regions of high density, such as the laboratory. One prominent example is the chameleon field. We reduce the effect of this screening mechanism by probing the chameleon with individual atoms rather than bulk matter. Using a cesium matter-wave interferometer near a spherical mass in an ultra-high vacuum chamber, we constrain a wide class of dynamical dark energy theories. Our experiment excludes a range of chameleon theories that reproduce the observed cosmic acceleration.

  1. Atom-Interferometry Constraints on Dark Energy

    Science.gov (United States)

    Mueller, Holger

    2016-03-01

    If dark energy is a light scalar field, it might interact with normal matter. The interactions, however, are suppressed in some leading models, which are thus compatible with current cosmological observations as well as solar-system and laboratory studies. Such suppression typically relies on the scalar's interaction with macroscopic amounts of ordinary matter, but can be bypassed by studying the interaction with individual particles. Using an atom interferometer, we have placed tight constraints on so-called chameleon models, ruling out interaction parameters βM > 4 ×104 . This limit is improved by 2.5 orders of magnitude relative to previous experiments. We have already increased the sensitivity of our interferometer hundredfold and are expecting a new constraint soon. Purpose-built experiments in the lab or on the international space station will completely close the gap and rule out out chameleons and other theories, such as axions, dark photons, symmetrons or f (R) gravity.

  2. Atomic Mass and Nuclear Binding Energy for Ra-226 (Radium)

    Science.gov (United States)

    Sukhoruchkin, S. I.; Soroko, Z. N.

    This document is part of the Supplement containing the complete sets of data of Subvolume B `Nuclei with Z = 55 - 100' of Volume 22 `Nuclear Binding Energies and Atomic Masses' of Landolt-Börnstein - Group I `Elementary Particles, Nuclei and Atoms', and additionally including data for nuclei with Z = 101 - 130. It provides atomic mass, mass excess, nuclear binding energy, nucleon separation energies, Q-values, and nucleon residual interaction parameters for atomic nuclei of the isotope Ra-226 (Radium, atomic number Z = 88, mass number A = 226).

  3. NATO Advanced Study Institute on Atoms in Unusual Situations

    CERN Document Server

    1986-01-01

    Atomic Physics is certainly the oldest field in which Quantum Mechanics has been used and has provided the most significant proofs of this new theory. Most of the basic concepts, except those more recently developed in field quantization, have been understood for quite a time. Atomic Physics began to serve as a basis for other fields such as molecu­ lar, solid state or nuclear physics. A renewal of interest in Atomic Physics began in the sixties, after the discovery of Quantum Electro­ dynamics, and later when it provided some basic tests of fundamental questions like parity violation, time reversal or Dirac theory. More recently the development of new technologies led to the ex­ ploration of very extreme cases in which the most secrete aspects of atoms have been observed. - Rydberg states where the atoms are so big that they can be described by classical theories; - Heavy or super-heavy ions or exotic atoms where unknown QED or relativistic effects can be observed (very heavy hydrogenlike or heliu...

  4. A liquid drop model for embedded atom method cluster energies

    Science.gov (United States)

    Finley, C. W.; Abel, P. B.; Ferrante, J.

    1996-01-01

    Minimum energy configurations for homonuclear clusters containing from two to twenty-two atoms of six metals, Ag, Au, Cu, Ni, Pd, and Pt have been calculated using the Embedded Atom Method (EAM). The average energy per atom as a function of cluster size has been fit to a liquid drop model, giving estimates of the surface and curvature energies. The liquid drop model gives a good representation of the relationship between average energy and cluster size. As a test the resulting surface energies are compared to EAM surface energy calculations for various low-index crystal faces with reasonable agreement.

  5. Determination of Atomic Data Pertinent to the Fusion Energy Program

    Energy Technology Data Exchange (ETDEWEB)

    Reader, J.

    2013-06-11

    We summarize progress that has been made on the determination of atomic data pertinent to the fusion energy program. Work is reported on the identification of spectral lines of impurity ions, spectroscopic data assessment and compilations, expansion and upgrade of the NIST atomic databases, collision and spectroscopy experiments with highly charged ions on EBIT, and atomic structure calculations and modeling of plasma spectra.

  6. Solar and Geothermal Energy: New Competition for the Atom

    Science.gov (United States)

    Carter, Luther J.

    1974-01-01

    Describes new emphasis on research into solar and geothermal energy resources by governmental action and recent legislation and the decreased emphasis on atomic power in supplementing current energy shortages. (BR)

  7. Books on Atomic Energy for Adults and Children

    Energy Technology Data Exchange (ETDEWEB)

    None

    1969-01-01

    This booklet contains two lists of atomic energy books, one for students and one for adults. The student list has grade annotations. The lists are not all-inclusive but comprise selected basic books on atomic energy and closely related subjects.

  8. Hawaii Natural Energy Institute annual report, 1984

    Energy Technology Data Exchange (ETDEWEB)

    1984-01-01

    This tenth anniversary special reviews each project over the past 10 years, with research in progress included for FY83-84 for biomass, geothermal, ocean energy, solar energy, wind research and other renewable energy research. (PSB)

  9. Positronium-alkali atom scattering at medium energies

    Energy Technology Data Exchange (ETDEWEB)

    Chakraborty, Ajoy [Laban Hrad Vidyapith, AD-369, Salt Lake City, Kolkata 700 064 (India); Basu, Arindam [Department of Physics, Maheshtala College, Chandannagar, South 24 Parganas, Kolkata 700 140 (India); Sarkar, Nirmal K [Sodepur Chandrachur Vidyapith, 1, Desh Bandhu Nagar, Sodepur, 743 174 (India); Sinha, Prabal K [Department of Physics, Bangabasi College, 19, Raj Kumar Chakravorty Sarani, Kolkata 700 009 (India)

    2004-04-28

    We investigate the scattering of orthopositronium (o-Ps) atom off different atomic alkali targets (Na to Cs) at low and medium energies (up to 120 eV). Projectile-elastic and target-elastic close-coupling models have been employed to investigate the systems in addition to the static-exchange model. Elastic, excitation and total cross sections have been reported for all four systems. The magnitude of the alkali excitation cross section increases with increasing atomic number of the target atom while the position of the peak value shifts towards lower incident energies. The magnitudes of the Ps excitation and ionization cross sections increase steadily with atomic number with no change in the peak position. The reported results show regular behaviour with increasing atomic number of the target atom. Scattering parameters for the Ps-Rb and Ps-Cs systems are being reported for the first time.

  10. Atomic level spatial variations of energy states along graphene edges.

    Science.gov (United States)

    Warner, Jamie H; Lin, Yung-Chang; He, Kuang; Koshino, Masanori; Suenaga, Kazu

    2014-11-12

    The local atomic bonding of carbon atoms around the edge of graphene is examined by aberration-corrected scanning transmission electron microscopy (STEM) combined with electron energy loss spectroscopy (EELS). High-resolution 2D maps of the EELS combined with atomic resolution annular dark field STEM images enables correlations between the carbon K-edge EELS and the atomic structure. We show that energy states of graphene edges vary across individual atoms along the edge according to their specific C-C bonding, as well as perpendicular to the edge. Unique spectroscopic peaks from the EELS are assigned to specific C atoms, which enables unambiguous spectroscopic fingerprint identification for the atomic structure of graphene edges with unprecedented detail.

  11. Energy spectrum of fermionized bosonic atoms in optical lattices

    Institute of Scientific and Technical Information of China (English)

    Jiurong Han; Haichao Zhang; Yuzhu Wang

    2005-01-01

    We investigate the energy spectrum of fermionized bosonic atoms, which behave very much like spinless noninteracting fermions, in optical lattices by means of the perturbation expansion and the retarded Green's function method. The results show that the energy spectrum splits into two energy bands with single-occupation; the fermionized bosonic atom occupies nonvanishing energy state and left hole has a vanishing energy at any given momentum, and the system is in Mott-insulating state with a energy gap.Using the characteristic of energy spectra we obtained a criterion with which one can judge whether the Tonks-Girardeau (TG) gas is achieved or not.

  12. Streaming current of a rotary atomizer for energy harvesting

    NARCIS (Netherlands)

    Nguyen, Trieu; Boer, de H.; Tran, T.; Berg, van den A.; Eijkel, J.C.T.; Zengerle, R.

    2013-01-01

    We present the experimental results of an energy conversion system based on a rotary atomizer and the streaming current phenomenon. The advantage of using a rotary atomizer instead of a channel or membrane micropore as in conventional pressure-driven approached is that the centrifugal force exerted

  13. Energy scaling of cold atom-atom-ion three-body recombination

    CERN Document Server

    Krükow, Artjom; Härter, Arne; Denschlag, Johannes Hecker; Pérez-Ríos, Jesús; Greene, Chris H

    2015-01-01

    We study three-body recombination of Ba$^+$ + Rb + Rb in the mK regime where a single $^{138}$Ba$^{+}$ ion in a Paul trap is immersed into a cloud of ultracold $^{87}$Rb atoms. We measure the energy dependence of the three-body rate coefficient $k_3$ and compare the results to the theoretical prediction, $k_3 \\propto E_{\\textrm{col}}^{-3/4}$ where $E_{\\textrm{col}}$ is the collision energy. We find agreement if we assume that the non-thermal ion energy distribution is determined by at least two different micro-motion induced energy scales. Furthermore, using classical trajectory calculations we predict how the median binding energy of the formed molecules scales with the collision energy. Our studies give new insights into the kinetics of an ion immersed into an ultracold atom cloud and yield important prospects for atom-ion experiments targeting the s-wave regime.

  14. Analysis of energy use at US institutional buildings

    Science.gov (United States)

    Hirst, E.; Trimble, J.; Goelitz, R.

    1981-11-01

    The Federal Institutional Conservation Program includes collection of energy use and energy related data from individual institutional buildings. Data were obtained from ten states (Massachusetts, New Hampshire, Vermont, New Jersey, Florida, Minnesota, Wisconsin, Texas, Kansas, and Oregon) on almost fifteen thousand schools, hospitals, local government buildings, and public care institutions. After the data were carefully examined, organized, and validated (i.e., outliers that might be errors were deleted), regression equations were developed for each of the four institutional building types. Because so many of the data elements were either missing or outliers, techniques were applied that allow incorporation of observations with missing data in the regression analysis. These equations explain annual energy use as functions of average energy price, floor area, year of construction, occupancy, air conditioning, primary heating fuel, owner, location, and building function.

  15. Determination of Surface Exciton Energies by Velocity Resolved Atomic Desorption

    Energy Technology Data Exchange (ETDEWEB)

    Hess, Wayne P.; Joly, Alan G.; Beck, Kenneth M.; Sushko, Petr V.; Shluger, Alexander L.

    2004-08-20

    We have developed a new method for determining surface exciton band energies in alkali halides based on velocity-resolved atomic desorption (VRAD). Using this new method, we predict the surface exciton energies for K1, KBr, KC1, and NaC1 within +0.15 eV. Our data, combined with the available EELS data for alkali fluorides, demonstrate a universal linear correlation with the inverse inter-atomic distance in these materials. The results suggest that surface excitons exist in all alkali halides and their excitation energies can be predicted from the known bulk exciton energies and the obtained correlation plot.

  16. An informational approach about energy and temperature in atoms

    Science.gov (United States)

    Flores-Gallegos, N.

    2016-08-01

    In this letter, we introduce new definitions of energy and temperature based on the information theory model, and we show that our definition of informational energy is related to the kinetic energy of the Thomas-Fermi model, meanwhile the definition of informational temperature proposed, permit identify 'hot' and 'cold' zones of an atom, such zones are related to the changes in the local electron energy wherein the chemical and physical changes can occur; informational temperature also can reproduce the shell structure of an atom.

  17. CPT Magnetometer with Atomic Energy Level Modulation

    Institute of Scientific and Technical Information of China (English)

    LIU Guo-Bin; DU Run-Chang; LIU Chao-Yang; GU Si-Hong

    2008-01-01

    We propose and experimentally investigate a coherent population trapping state based magnetometer prototype with87 Rb atoms.Through modulating Zeeman sublevels with an ac magnetic field,not only a phase sensitive detection scheme suitable for miniature magnetometer is realized,but also the detection resolution of magnetic field intensity could be improved by a factor of two.Our study result indicates that it is a promising low power consumption miniature sensitive low magnetic field sensor offering spatially resolved measurement at the sub-millimetre level.

  18. Two atoms scattering at low and cold energies

    Indian Academy of Sciences (India)

    Hasi Ray

    2014-12-01

    A modified static-exchange model is developed to study the collision of an atom with another atom. It includes the effect of long-range dipole–dipole van der Waals interaction between two atoms in addition to the exact effect of short-range force due to Coulomb exchange between two system electrons. Both these interactions dominate at colder energies. The system is treated as a four-centre problem in the centre-of-mass frame. The present ab-initio model is useful to study the two-atomic collisions at low energies, as well as cold energies. The new code is applied to study the scattering of positronium (Ps) by hydrogen (H), both in their ground states.

  19. Kyiv institutional buildings sector energy efficiency program: Technical assessment

    Energy Technology Data Exchange (ETDEWEB)

    Secrest, T.J.; Freeman, S.L. [Pacific Northwest National Lab., Richland, WA (United States); Popelka, A. [Tysak Engineering, Acton, MA (United States); Shestopal, P.A.; Gagurin, E.V. [Agency for Rational Energy Use and Ecology, Kyiv (Ukraine)

    1997-08-01

    The purpose of this assessment is to characterize the economic energy efficiency potential and investment requirements for space heating and hot water provided by district heat in the stock of state and municipal institutional buildings in the city of Kyiv. The assessment involves three activities. The first is a survey of state and municipal institutions to characterize the stock of institutional buildings. The second is to develop an estimate of the cost-effective efficiency potential. The third is to estimate the investment requirements to acquire the efficiency resource. Institutional buildings are defined as nonresidential buildings owned and occupied by state and municipal organizations. General categories of institutional buildings are education, healthcare, and cultural. The characterization activity provides information about the number of buildings, building floorspace, and consumption of space heating and hot water energy provided by the district system.

  20. Chameleon dark energy and atom interferometry

    Science.gov (United States)

    Elder, Benjamin; Khoury, Justin; Haslinger, Philipp; Jaffe, Matt; Müller, Holger; Hamilton, Paul

    2016-08-01

    Atom interferometry experiments are searching for evidence of chameleon scalar fields with ever-increasing precision. As experiments become more precise, so too must theoretical predictions. Previous work has made numerous approximations to simplify the calculation, which in general requires solving a three-dimensional nonlinear partial differential equation. This paper calculates the chameleonic force using a numerical relaxation scheme on a uniform grid. This technique is more general than previous work, which assumed spherical symmetry to reduce the partial differential equation to a one-dimensional ordinary differential equation. We examine the effects of approximations made in previous efforts on this subject and calculate the chameleonic force in a setup that closely mimics the recent experiment of Hamilton et al. Specifically, we simulate the vacuum chamber as a cylinder with dimensions matching those of the experiment, taking into account the backreaction of the source mass, its offset from the center, and the effects of the chamber walls. Remarkably, the acceleration on a test atomic particle is found to differ by only 20% from the approximate analytical treatment. These results allow us to place rigorous constraints on the parameter space of chameleon field theories, although ultimately the constraint we find is the same as the one we reported in Hamilton et al. because we had slightly underestimated the size of the vacuum chamber. This computational technique will continue to be useful as experiments become even more precise and will also be a valuable tool in optimizing future searches for chameleon fields and related theories.

  1. American Institute of Beamed Energy Propulsion: An Introduction

    Science.gov (United States)

    Pakhomov, Andrew V.

    2008-04-01

    To date ISBEP remains the main forum addressing the science and engineering of beamed energy propulsion. Hopefully, it will continue to serve BEP community in this capacity for years to come. The need for organization acting beyond ISBEP was discussed since the second symposium. This paper will address the following question: if our community is ready for having its own organization, a BEP institute, what new it should bring comparing to already existing conference. Such organization, an American Institute on Beamed Energy Propulsion (AIBEP) was recently established. The institute is designed as a nonprofit corporation serving the purpose "to promote the ideas, concepts and benefits of beamed-energy propulsion to research community, industry and society at large". The goals of the institute, expected outcomes and benefits of the organization and its membership will be discussed.

  2. Chameleon Dark Energy and Atom Interferometry

    CERN Document Server

    Elder, Benjamin; Haslinger, Philipp; Jaffe, Matt; Müller, Holger; Hamilton, Paul

    2016-01-01

    Atom interferometry experiments are searching for evidence of chameleon scalar fields with ever-increasing precision. As experiments become more precise, so too must theoretical predictions. Previous work has made numerous approximations to simplify the calculation, which in general requires solving a 3-dimensional nonlinear partial differential equation (PDE). In this paper, we introduce a new technique for calculating the chameleonic force, using a numerical relaxation scheme on a uniform grid. This technique is more general than previous work, which assumed spherical symmetry to reduce the PDE to a 1-dimensional ordinary differential equation (ODE). We examine the effects of approximations made in previous efforts on this subject, and calculate the chameleonic force in a set-up that closely mimics the recent experiment of Hamilton et al. Specifically, we simulate the vacuum chamber as a cylinder with dimensions matching those of the experiment, taking into account the backreaction of the source mass, its o...

  3. Institute for Energy Technology - Annual report 1997

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    1998-12-31

    Most of the nuclear-related work at Kjeller is based on the JEEP II research reactor, the operation of which is a prerequisite for Kjeller`s activities. The work includes basic research in physics, the production of radiopharmaceuticals, the irradiation of materials for various technical applications, neutron radiography, activation analyses and silicon doping. 1997 was the first year of the 1997-1999 research period for the international OECD Halden Reactor Project. With the National Nuclear Regulatory Board (CNEN) of Brazil becoming a member late last year, the Project now include organizations from 20 countries. A membership agreement was also signed with the Institut de Protection et de Surete Nucleaire (IPSN) of France in 1997. The Project is operation by a staff of 280. In the fuel safety area, work focused chiefly on concerns arising at high burn-up in normal operation and in transient conditions. The unique Halden instrumentation has been extremely valuable for obtaining high relevance data. In respect of core materials, work has concentrated on corrosion issues, including in-core measurements of crack propagation rates in stainless steels. These data are used to estimate the expected lifetime of materials and to learn how effective measures are in improving the materials`s performance. In the man-machine are the Halden Man-Machine Laboratory (HAMMLAB) is being upgraded and expanded. Modern, powerful simulators for PWR, BWR and WER reactors began to be installed during the year, and a Virtua Reality centre was set up to complement the HAMMLAB. As the infrastructure was build up, activities dwelt on human factors studies, encompassing situation awareness, the development and assessment of operator support systems, and the validation of software.

  4. Positron impact ionization of atomic hydrogen at low energies

    Indian Academy of Sciences (India)

    K Chakrabarti

    2001-04-01

    Low energy positron impact ionization of atomic hydrogen is studies theoretically using the hyperspherical partial wave method of Das [1] in constant 12, equal energy sharing geometry. The TDCS reveal considerable differences in physics compared to electron impact ionization under the same geometry.

  5. Collective institutional entrepreneurship and contestations in wind energy in India

    NARCIS (Netherlands)

    Jolly, Suyash; Raven, Rob

    2015-01-01

    With 21,136MW of wind energy installed in 2014, India is considered a success story in terms of net installed capacity. Few existing studies on Indian wind energy have highlighted the important role of institutions, and how they stemmed from the work of advocacy groups; studies also tend to focus on

  6. An atomic clockwork using phase dependent energy shifts

    CERN Document Server

    De Munshi, D; Mukherjee, M

    2011-01-01

    A frequency stabilized laser referenced to an unperturbed atomic two level system acts as the most accurate clock with femtosecond clock ticks. For any meaningful use, a Femtosecond Laser Frequency Comb (FLFC) is used to transfer the atomic clock accuracy to electronically countable nanosecond clock ticks. Here we propose an alternative clockwork based on the phenomenon that when an atomic system is slowly evolved in a cyclic path, the atomic energy levels gather some phase called the geometric phase. This geometric phase dependent energy shift has been used here to couple the two frequency regimes in a phase coherent manner. It has also been shown that such a technique can be implemented experimentally, bypassing the highly involved setup of a FLFC.

  7. Hawaii Natural Energy Institute: Annual report, 1992

    Energy Technology Data Exchange (ETDEWEB)

    1992-01-01

    This progress report from the University of Hawaii at Manoa's School of Ocean and Earth Science and Technology describes state of the art research in tapping the energy in and around the Hawaiian Islands. Researchers are seeking new ways of generating electricity and producing methanol from sugarcane waste and other biomass. They are finding ways to encourage the expanded use of methanol as a transportation fuel. They are creating innovative and cost-efficient methods of producing and storing hydrogen gas, considered the fuel of the future''. Researchers are also developing the techniques and technologies that will enable us to tap the unlimited mineral resources of the surrounding ocean. they are testing methods of using the oceans to reduce the carbon dioxide being discharged to the atmosphere. And they are mapping the strategies by which the seas can become a major source of food, precious metals, and space for living and for industry. The achievements described in this annual report can be attributed to the experience, creativity, painstaking study, perseverance, and sacrifices of our the dedicated corps of researchers.

  8. General engineering ethics and multiple stress of atomic energy engineering

    Energy Technology Data Exchange (ETDEWEB)

    Takeda, Kunihiko [Shibaura Inst. of Tech., Tokyo (Japan)

    1999-08-01

    The factors, by which the modern engineering ethics has been profoundly affected, were classified to three categories, namely mental blow, the destruction of human function and environment damage. The role of atomic energy engineering in the ethic field has been shown in the first place. It is pointed out that it has brought about the mental blow by the elucidation of universal truth and discipline and the functional disorder by the power supply. However, the direct effect of radiation to the human kinds is only a part of the stresses comparing to the accumulation of the social stress which should be taken into account of by the possibility of disaster and the suspicion of the atomic energy politics. An increase in the multiple stresses as well as the restriction of criticism will place obstacles on the promotion of atomic energy. (author)

  9. Institutional and Policy Assessment of Renewable Energy Sector in Afghanistan

    Directory of Open Access Journals (Sweden)

    Ahmad Murtaza Ershad

    2017-01-01

    Full Text Available Renewable energy resources could play a vital role in the sustainable economic, social, and environmental development of Afghanistan. Heavy reliance of rural households on firewood, rising costs of fossil fuels, outdoor and indoor air pollution, and climate change are some of the challenges that can be addressed by diversifying our power production fuel inputs and adopting renewable energy technologies. In order to deploy and scale up renewable energy technologies and improve access to sustainable energy, clear policies and targets and dedicated institutions are crucial. Fortunately, Afghan government with the support of international community is setting ambitious targets for the renewable energy sector and is encouraging national and international investors to take part in the generation, transmission, and distribution of renewable energy especially electricity through Power Purchase Agreements or very cheap land leases. Thus, the objectives of this report are (I to review the existing institutions in the field of renewable energy, (II to review renewable energy policies and targets in Afghanistan, and (III to identify institutional and policy gaps and recommend solutions.

  10. Atomic-powered democracy: Policy against politics in the quest for American nuclear energy

    Energy Technology Data Exchange (ETDEWEB)

    Williams, R.W.

    1993-01-01

    This dissertation focuses on the relationship of American nuclear energy to democracy. It examines whether the nuclear policy processes have furthered the legitimacy-government accountability and citizen participation-which the democratic institutes are based. Nuclear policy and its institutions have placed severe limitations on democratic practices. Contravened democracy is seen most clearly in the decoupling of policy from politics. Decoupling refers to the weakening of institutional linkages between citizens and government, and to the erosion of the norms that ground liberal democracy. Decoupling is manifested in policy centralization, procedural biases, technical rationality, and the spatial displacement of conflict. Decoupling has normative implications: While federal accountability was limited and citizen participation was shackled, other major groups enjoyed privileged access to policy making. The decoupling of nuclear policy from politics arose within the context of US liberal-democratic capitalism. The federal government pursued its own goals of defense and world leadership. Yet, it was not structurally autonomous from the hegemony of the political-economic context. Economically, the Atomic Energy Act did not permit federal agencies to directly invest in power plant construction, and did not authorize them to commercially generate electricity. Private industry was structurally placed to domesticate the atom. Politically, the liberal-democratic system hampered an unquestioning pursuit of atomic energy. Federal institutions have been forced to heed some of the anti-nuclear concerns. The pervasive influence of the US political economy on nuclear policy has come to transgress democracy. Nuclear power's growth faltered during the 1970s. The political and economic constraints on federal actions have limited the means available to revive a becalmed nuclear industry; this has exerted strong pressure on federal institutions to decouple policy from

  11. Automatic generation of reaction energy databases from highly accurate atomization energy benchmark sets.

    Science.gov (United States)

    Margraf, Johannes T; Ranasinghe, Duminda S; Bartlett, Rodney J

    2017-03-31

    In this contribution, we discuss how reaction energy benchmark sets can automatically be created from arbitrary atomization energy databases. As an example, over 11 000 reaction energies derived from the W4-11 database, as well as some relevant subsets are reported. Importantly, there is only very modest computational overhead involved in computing >11 000 reaction energies compared to 140 atomization energies, since the rate-determining step for either benchmark is performing the same 140 quantum chemical calculations. The performance of commonly used electronic structure methods for the new database is analyzed. This allows investigating the relationship between the performances for atomization and reaction energy benchmarks based on an identical set of molecules. The atomization energy is found to be a weak predictor for the overall usefulness of a method. The performance of density functional approximations in light of the number of empirically optimized parameters used in their design is also discussed.

  12. Understanding Atomic Structure: Is There a More Direct and Compelling Connection between Atomic Line Spectra and the Quantization of an Atom's Energy?

    Science.gov (United States)

    Rittenhouse, Robert C.

    2015-01-01

    The "atoms first" philosophy, adopted by a growing number of General Chemistry textbook authors, places greater emphasis on atomic structure as a key to a deeper understanding of the field of chemistry. A pivotal concept needed to understand the behavior of atoms is the restriction of an atom's energy to specific allowed values. However,…

  13. Correlated energy transfer between two ultracold atomic species

    Science.gov (United States)

    Krönke, Sven; Knörzer, Johannes; Schmelcher, Peter

    2015-05-01

    We study a single atom as an open quantum system, which is initially prepared in a coherent state of low energy and oscillates in a one-dimensional harmonic trap through an interacting ensemble of NA bosons, held in a displaced trap [arXiv:1410.8676]. The non-equilibrium quantum dynamics of the total system is simulated by means of an ab-initio method, giving us access to all properties of the open system and its finite environment. In this talk, we focus on unraveling the interplay of energy exchange and correlations between the subsystems, which are coupled in such a spatio-temporally localized manner. We show that an inter-species interaction-induced level splitting accelerates the energy transfer between the atomic species for larger NA, which becomes less complete at the same time. System-environment correlations prove to be significant except for times when the excess energy distribution among the subsystems is highly imbalanced. These correlations result in incoherent energy transfer processes, which accelerate the early energy donation of the single atom. By analyzing correlations between intra-subsystem excitations, certain energy transfer channels are shown to be (dis-)favored depending on the instantaneous direction of transfer.

  14. Non—conservation of energy arising from atomic dipole interactions and its effects on light field and coupled atoms

    Institute of Scientific and Technical Information of China (English)

    DongChuan-Hua

    2003-01-01

    The interactions between coulpled atoms and a single mode of a quantized electromagnetic field, which involve the terms originating from the dipole interactions, are discussed. In the usual Jaynes-Cummings model for coupled atoms, the terms of non-conservation of energy originating from dipole interactions are neglected, however, we take them into consideration in this paper. The effects of these terms on the evolutions of quantum statistic properties and squeezing of the field, the squeezing of atomic dipole moments and atomic population inversion are investigated. It has been shown that the coupling between atoms modulates these evolutions of fields and atoms. The terms of non-conservation of energy affect these evolutions of field and atoms slightly. They also have effects on the squeezing of the field, the squeezing of atomic dipole and atomic population inversions. The initial states of atoms also affect these properties.

  15. Non-conservation of energy arising from atomic dipole interactions and its effects on light field and coupled atoms

    Institute of Scientific and Technical Information of China (English)

    董传华

    2003-01-01

    The interactions between coupled atoms and a single mode of a quantized electromagnetic field, which involve the terms originating from the dipole interactions, are discussed. In the usual Jaynes Cummings model for coupled atoms,the terms of non-conservation of energy originating from dipole interactions are neglected, however, we take them into consideration in this paper. The effects of these terms on the evolutions of quantum statistic properties and squeezing of the field, the squeezing of atomic dipole moments and atomic population inversion are investigated. It has been shown that the coupling between atoms modulates these evolutions of fields and atoms. The terms of non-conservation of energy affect these evolutions of fields and atoms slightly. They also have effects on the squeezing of the field, the squeezing of atomic dipole and atomic population inversions. The initial states of atoms also affect these properties.

  16. Correlation Between Energy Transfer Rate and Atomization Energy of Some Trinitro Aromatic Explosive Molecules

    Institute of Scientific and Technical Information of China (English)

    Su-hong Ge; Xin-lu Cheng; Zheng-lai Liu; Xiang-dong Yang; Fang-fang Dong

    2008-01-01

    An assumptive theoretical relationship is suggested to describe the property of molecular atomization energy and energy transfer rate in the initiation of explosions. To investigate the relationship between atomization energy and energy transfer rate, the number of doorway modes of explosives is estimated by the theory of Dlott and Fayer in which the rate is proportional to the number of normal mode vibrations. It was evaluated frequencies of normal mode vibrations of eight molecules by means of density functional theory (DFT) at the b3p86/6-31G(d,p) level. It is found that the number of doorway modes shows a linear correlation to the atomization energies of the molecules, which were also calculated by means of the same method. A mechanism of this correlation is discussed. It is also noted that in those explosives with similar molecular structure and molecular weight, the correlation between the atomization energy and the number of doorway modes is higher.

  17. Corrections to the Nonrelativistic Ground Energy of a Helium Atom

    Institute of Scientific and Technical Information of China (English)

    段一士; 刘玉孝; 张丽杰

    2004-01-01

    Considering the nuclear motion, we present the nonrelativistic ground energy of a helium atom by using a simple effective variational wavefunction with a flexible parameter k. Based on the result, the relativistic and radiative corrections to the nonrelativistic Hamiltonian are discussed. The high precision value of the helium ground energy is evaluated to be -2.90338 a.u. With the relative error 0.00034%.

  18. Estimation of correlation energy for excited-states of atoms

    CERN Document Server

    Hemanadhan, M

    2014-01-01

    The correlation energies of various atoms in their excited-states are estimated by modelling the Coulomb hole following the previous work by Chakravorty and Clementi. The parameter in the model is fixed by making the corresponding Coulomb hole to satisfy the exact constraint of charge neutrality.

  19. A Bibliography of Basic Books on Atomic Energy

    Energy Technology Data Exchange (ETDEWEB)

    None

    1974-01-01

    This booklet lists selected commercially published books for the general public on atomic energy and closely related subjects. Books for young readers have school grade annotations.This booklet contains an author index, a title index, and a list of publishers’ addresses.

  20. Delegation from the Pakistan Atomic Energy Commission (PAEC)

    CERN Multimedia

    Patrice Loiez

    2002-01-01

    L. to r.: Dr Hafeez Hoorani (NCP) and Dr Michel Della Negra, Spokesman, CMS experiment with a delegation from the Pakistan Atomic Energy Commission: Mr Saeed Ahmed, Director SES, PAEC, Mr Muhammad Naeem, Director PWI and Mr Javed Iqleem, Deputy Chairman PAEC visiting the CMS magnet assembly hall at Point 5.

  1. Scientists credit `Atoms for Peace' for progress on energy, security

    CERN Multimedia

    Jones, D

    2003-01-01

    "Fifty years after President Eisenhower unveiled his plan for developing peaceful uses for nuclear fission, the scientific advances spawned by his Atoms for Peace program have made possible major advances in energy and national security, a panel of physicists said last week" (1 page).

  2. Applications of NAA at Institute of High Energy Physics

    Energy Technology Data Exchange (ETDEWEB)

    Zhang Zhiyong; Chai Zhifang [Chinese Academy of Sciences, Institute of High Energy Physics, Beijing (China)

    2003-03-01

    Recent achievements in application studies of neutron activation analysis (NAA) at Institute of High Energy Physics, The Chinese Academy of Sciences are briefly described. A small number of selected areas and problems, particularly in life sciences, are highlighted because they present challenges for NAA and its prospects in the future. (author)

  3. Wanted: institutions for balancing global food and energy markets.

    NARCIS (Netherlands)

    Koning, N.B.J.; Mol, A.P.J.

    2009-01-01

    The increasing demand for biomass for energy use is further escalating existing food security risks. Managing these risks is a task for global institutions. These should ensure timely investment in the world's capacity for producing biomass and balance the use of this biomass for foods and for non-f

  4. Multipolar electrostatics for proteins: atom-atom electrostatic energies in crambin.

    Science.gov (United States)

    Yuan, Yongna; Mills, Matthew J L; Popelier, Paul L A

    2014-02-15

    Accurate electrostatics necessitates the use of multipole moments centered on nuclei or extra point charges centered away from the nuclei. Here, we follow the former alternative and investigate the convergence behavior of atom-atom electrostatic interactions in the pilot protein crambin. Amino acids are cut out from a Protein Data Bank structure of crambin, as single amino acids, di, or tripeptides, and are then capped with a peptide bond at each side. The atoms in the amino acids are defined through Quantum Chemical Topology (QCT) as finite volume electron density fragments. Atom-atom electrostatic energies are computed by means of a multipole expansion with regular spherical harmonics, up to a total interaction rank of L = ℓA+ ℓB + 1 = 10. The minimum internuclear distance in the convergent region of all the 15 possible types of atom-atom interactions in crambin that were calculated based on single amino acids are close to the values calculated from di and tripeptides. Values obtained at B3LYP/aug-cc-pVTZ and MP2/aug-cc-pVTZ levels are only slightly larger than those calculated at HF/6-31G(d,p) level. This convergence behavior is transferable to the well-known amyloid beta polypeptide Aβ1-42. Moreover, for a selected central atom, the influence of its neighbors on its multipole moments is investigated, and how far away this influence can be ignored is also determined. Finally, the convergence behavior of AMBER becomes closer to that of QCT with increasing internuclear distance.

  5. California Institute for Energy Efficiency: 1993 Annual report

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    1993-12-31

    In 1988, a statewide partnership of California`s six largest electric and gas utilities, the California Public Utilities Commission, the California Energy Commission, the University of California, and Lawrence Berkeley Laboratory (LBL) led to the creation of the California Institute for energy Efficiency. CIEE was specifically established to respond to California`s energy and environmental needs by developing new, energy-efficient technologies for buildings, industry, and transportation using the scientific and technological capabilities of the state`s universities, colleges, and university-affiliated laboratories. This 1993 Annual Report highlights the accomplishments of CIEE`s research and development program, which includes 11 major multiyear projects in the fields of Building Energy Efficiency and Air Quality Impacts of Energy Efficiency as well as 21 ongoing exploratory projects. This report contains research highlights from seven of these programs.

  6. Energy-Efficiency & Water Institute Research Facility, Purdue University, (IN)

    Energy Technology Data Exchange (ETDEWEB)

    Nnanna, Agbai [Purdue Univ., West Lafayette, IN (United States)

    2015-01-30

    The renovation of the Schneider Avenue Building to construct two research laboratories within the building is complete. The research laboratories are for the Purdue Calumet Water Institute and the Energy Efficiency and Reliability Center. The Water Institute occupies approximately 1000+ SF of research space plus supporting offices. The Energy-Efficiency Center occupies approximately 1000+ SF that houses the research space. The labs will enhance the Water & Energy Institute’s research capabilities necessary to tackle these issues through the development of practical approaches critical to local government and industry. The addition of these research laboratories to the Purdue University Calumet campus is in both direct support of the University’s Strategic Plan as well as the 2008 Campus Master Plan that identifies a 20% shortage of research space.

  7. Atomic Energy Levels with QED and Contribution of the Screened Self-Energy

    OpenAIRE

    Bigot, Eric-Olivier Le; Indelicato, Paul

    2000-01-01

    We present an introduction to the principles behind atomic energy level calculations with Quantum Electrodynamics (QED) and the two-time Green's function method; this method allows one to calculate an effective Hamiltonian that contains all QED effects and that can be used to predict QED Lamb shifts of degenerate, quasidegenerate and isolated atomic levels.

  8. Institutional entrepreneurship in transforming energy systems towards sustainability : Wind energy in Finland and India

    NARCIS (Netherlands)

    Jolly, Suyash; Spodniak, Petr; Raven, R. P J M

    2016-01-01

    A growing body of literature has examined the dynamics of wind energy development across different mature and emerging institutional contexts. However, so far only few have paused to reflect on the differences between developed and emerging economies. Building upon the literature on institutional en

  9. Quickening nature's pulse: atomic agriculture at the International Atomic Energy Agency.

    Science.gov (United States)

    Hamblin, Jacob Darwin

    2015-01-01

    Mutation breeders in the 1960s seemed poised to use atomic energy to speed up mutation rates in plants in order to develop new crop varieties, for the benefit of all people. Although skepticism had slowed this work in the United States, the International Atomic Energy Agency (IAEA) nurtured the scientific field, its community of experts, and an imagined version of the future that put humans in control of their destiny. The IAEA acted as a center of dissemination and support for experts and ideas even when they had fallen from favor elsewhere. Through the lens of the IAEA, plant breeding bore the appearance of a socially progressive, ultra-modern science destined to alleviate population pressures. Administrators at the IAEA also were desperate for success stories, hoping to highlight mutation plant breeding as a potential solution to the world's ills. The community of mutation plant breeders gained a lifeline from the consistent clarion call from the Vienna-based agency to use atomic energy to understand the natural world and quicken its pulse with radioisotopes.

  10. Plasma screening effects on the energies of hydrogen atom

    Energy Technology Data Exchange (ETDEWEB)

    Soylu, A. [Department of Physics, Nigde University, 51240 Nigde (Turkey)

    2012-07-15

    A more general exponential cosine screened Coulomb potential is used for the first time to investigate the screening effects on the hydrogen atom in plasmas. This potential is examined for four different cases that correspond to four different type potentials when the different parameters are used in the potential within the framework of the well-known asymptotic iteration method. By solving the corresponding the radial Schroedinger equation with the screened and exponential cosine screened Coulomb potentials and comparing the obtained energy eigenvalues with the results of other studies, the applicability of the method to this kind of plasma physics problem is shown. The energy values of more general exponential cosine screened Coulomb potential are presented for various parameters in the potential. One of the advantages of the present potential is that it exhibits stronger screening effect than that of the exponential cosine screened Coulomb potential and it is also reduced to screened Coulomb and exponential cosine screened Coulomb as well as Coulomb potentials for special values of parameters. The parameters in the potential would be useful to model screening effects which cause an increase or decrease in the energy values of hydrogen atom in both Debye and quantum plasmas and in this manner this potential would be useful for the investigations of the atomic structure and collisions in plasmas.

  11. Scattering of low-energy neutrinos on atomic shells

    Energy Technology Data Exchange (ETDEWEB)

    Babič, Andrej [Dept. of Dosimetry and Application of Ionizing Radiation, Czech Technical University, 115 19 Prague, Czech Rep. (Czech Republic); Institute of Experimental and Applied Physics, Czech Technical University, 128 00 Prague (Czech Republic); Bogoliubov Laboratory of Theoretical Physics, Joint Institute for Nuclear Research, 141980 Dubna (Russian Federation); Šimkovic, Fedor [Institute of Experimental and Applied Physics, Czech Technical University, 128 00 Prague (Czech Republic); Bogoliubov Laboratory of Theoretical Physics, Joint Institute for Nuclear Research, 141980 Dubna (Russian Federation); Department of Nuclear Physics and Biophysics, Comenius University, 842 48 Bratislava (Slovakia)

    2015-10-28

    We present a derivation of the total cross section for inelastic scattering of low-energy solar neutrinos and reactor antineutrinos on bound electrons, resulting in a transition of the electron to an excited state. The atomic-shell structure of various chemical elements is treated in terms of a nonrelativistic approximation. We estimate the interaction rates for modern neutrino detectors, in particular the Borexino and GEMMA experiments. We establish that in these experiments the effect can be safely neglected, but it could be accessible to future large-volume neutrino detectors with low energy threshold.

  12. Addressing Social and Institutional Barriers for Wind Energy Installations

    Energy Technology Data Exchange (ETDEWEB)

    Ramirez, L.; Gonzalez, R.; Varela, M. [Ciemat. Madrid (Spain); Ramirez, I.; Vicente, F. [Consejeria de Medio Ambiente, Agricultura y Agua. Comunidad Autonoma de Murcia (Spain)

    2000-07-01

    This project has been jointly financed by the European Commission and developed within the Programme Thermie-B. The main tasks to carried out are: Revision of institutional and legal framework. The revision of institutional and legal framework of different participating countries, i. e. their comparison with the rest of the countries with a relevant role in the field of wind energy. Opinion poll carried out on the wind energy. By means of this means, one wants to test public opinion with respect to wind energy. So for such purpose, there are interviews carried out in the municipalities with wind parks, as well as in those where these are in the process of being installed or the project is in its due course. Simulation of wind parks installation. The Wind Park Wandered software tool is a Design and Visualisation tool developed by CINAR, which allows the preview of potential wind parks, evaluating their visual and audio impact. Production and distribution of information on wind energy. For such purpose, we can include the present publication with which one could summarise the main aspects associated with wind energy from its origin, the study of energy source (wind), and the machines that make use of it or the most relevant social and environmental contexts. Organizing informative seminars on the design possibilities of wind parks. At these seminar, one could assess the present wind energy situation in the European context and in each one of the participating countries. And possibilities of presenting WPW software as a design tool for wind parks. (Author) 12 refs.

  13. NATO Advanced Study Institute on Laser Interactions with Atoms, Solids,and Plasmas

    CERN Document Server

    1994-01-01

    The aim of this NATO Advanced Study Institute was to bring together scientists and students working in the field of laser matter interactions in order to review and stimulate developmentoffundamental science with ultra-short pulse lasers. New techniques of pulse compression and colliding-pulse mode-locking have made possible the construction of lasers with pulse lengths in the femtosecond range. Such lasers are now in operation at several research laboratories in Europe and the United States. These laser facilities present a new and exciting research direction with both pure and applied science components. In this ASI the emphasis is on fundamental processes occurring in the interaction of short laser pulses with atoms, molecules, solids, and plasmas. In the case of laser-atom (molecule) interactions, high power lasers provide the first access to extreme high-intensity conditions above 10'8 Watts/em', a new frontier for nonlinear interaction of photons with atoms and molecules. New phenomena observed include ...

  14. Importance of Atomic Contacts in Vibrational Energy Flow in Proteins.

    Science.gov (United States)

    Kondoh, Masato; Mizuno, Misao; Mizutani, Yasuhisa

    2016-06-02

    Vibrational energy flow in proteins was studied by monitoring the time-resolved anti-Stokes ultraviolet resonance Raman scattering of three myoglobin mutants in which a Trp residue substitutes a different amino acid residue near heme. The anti-Stokes Raman intensities of the Trp residue in the three mutants increased with similar rates after depositing excess vibrational energy at heme, despite the difference in distance between heme and each substituted Trp residue along the main chain of the protein. This indicates that vibrational energy is not transferred through the main chain of the protein but rather through atomic contacts between heme and the Trp residue. Distinct differences were observed in the amplitude of the band intensity change between the Trp residues at different positions, and the amplitude of the band intensity change exhibits a correlation with the extent of exposure of the Trp residue to solvent water. This correlation indicates that atomic contacts between an amino acid residue and solvent water play an important role in vibrational energy flow in a protein.

  15. Software development agreement between CERN and the Indian Department of Atomic Energy

    CERN Multimedia

    Patrice Loïez

    2003-01-01

    The development and prototyping work for the LHC computing facility is being organised as a project that includes many scientific institutes and industrial partners, coordinated by CERN. The project is nicknamed LCG (after LHC Computing Grid). Addendum No. 1 to the Protocol dated 24/09/02 to the 1991 co-operation agreement between CERN and the Department of Atomic Energy (DAE) of the Government of India defines the collaboration between CERN and DAE on software development for the LCG Prototype Project. Photo 01: Signing the addendum are G. Govindrajan (left), Director of the Electronics and Instrumentation Group at the Bhabha Atomic Research Centre, Mumbai, India and Dr. Hans Hoffmann, CERN Director for Technology Transfer and for Scientific Computing. Looking on are Christoph Eck (far left), resource manager of the LCG Project and Les Robertson, LCG Project Leader. Photo 02: (left to right) Christoph Eck, resource manager of the LCG Project; G. Govindrajan, Director of the Electronics and Instrumentation G...

  16. Software development agreement between CERN and the Indian Department of Atomic Energy

    CERN Multimedia

    Patrice Loïez

    2003-01-01

    The development and prototyping work for the LHC computing facility is being organised as a project that includes many scientific institutes and industrial partners, coordinated by CERN. The project is nicknamed LCG (after LHC Computing Grid). Addendum No. 1 to the Protocol dated 24/09/02 to the 1991 co-operation agreement between CERN and the Department of Atomic Energy (DAE) of the Government of India defines the collaboration between CERN and DAE on software development for the LCG Prototype Project. Signing the addendum are G. Govindrajan (left), Director of the Electronics and Instrumentation Group at the Bhabha Atomic Research Centre, Mumbai, India and Dr. Hans Hoffmann, CERN Director for Technology Transfer and for Scientific Computing.

  17. Features of Low Energy Classical Bremsstrahlung From Neutral Atoms.

    Science.gov (United States)

    Florescu, A.; Obolensky, O. I.; Pratt, R. H.

    2002-05-01

    We study classical bremsstrahlung from neutral atoms and investigate the features characteristic for the low incident energy region. These features include oscillations in the energy dependence of the bremsstrahlung cross section and structures in the asymmetry parameter of radiation. We use soft-photon limit results to elucidate the physical origins of the features. We show that there is a correspondence between classical and quantum results [1]. In both cases the features result from the suppression of contributions to the radiation from certain angular momenta at certain energies. In quantum mechanics this corresponds to zeroes in certain radiation matrix elements. In the classical case the lack of contribution from some interval of angular momentum is caused by behaviors of elastic electron scattering in screened potentials. [1] A. Florescu, O. I. Obolensky, C. D. Shaffer, and R. H. Pratt 2001 AIP Conference Proceedings 576, 60-64.

  18. Positron-Lithium Atom and Electron-Lithium Atom Scattering Systems at Intermediate and High Energies

    Institute of Scientific and Technical Information of China (English)

    K. Ratnavelu; S. Y. Ng

    2006-01-01

    @@ The coupled-channel optical method is used to study positron scattering by atomic lithium at energies ranging from the ionization threshold to 60 eV. The present method simultaneously treats the target channels and the positronium (Ps) channels in the coupled-channel method together with the continuum effects via an ab-initio optical potential. Ionization, elastic and inelastic cross sections in target channels, and the total cross section are also reported and compared with other theoretical and experimental data. A comparative study with the corresponding electron-lithium data is also reported.

  19. Embedded atom calculations of unstable stacking fault energies and surface energies in intermetallics

    Energy Technology Data Exchange (ETDEWEB)

    Farkas, D. [Department of Materials Science and Engineering, Virginia Polytechnic Institute and State University, Blacksburg, Virginia 24061 (United States); Zhou, S.J. [Theoretical Division and Center for Nonlinear Studies, Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States); Vailhe, C.; Mutasa, B.; Panova, J. [Department of Materials Science and Engineering, Virginia Polytechnic Institute and State University, Blacksburg, Virginia 24061 (United States)

    1997-01-01

    We performed embedded atom method calculations on surface energies and unstable stacking fault energies for a series of intermetallics for which interatomic potentials of the embedded atom type have recently been developed. These results were analyzed and applied to the prediction of relative ductility of these materials using the various current theories. Series of alloys with the B2 ordered structure were studied, and the results were compared to those in pure body-centered cubic (bcc) Fe. Ordered compounds with L1{sub 2} and L1{sub 0} structures based on the face-centered cubic (fcc) lattice were also studied. It was found that there is a correlation between the values of the antiphase boundary (APB) energies in B2 alloys and their unstackable stacking fault energies. Materials with higher APB energies tend to have higher unstable stacking fault energies, leading to an increased tendency to brittle fracture. {copyright} {ital 1997 Materials Research Society.}

  20. Geopressured-geothermal energy development: government incentives and institutional structures

    Energy Technology Data Exchange (ETDEWEB)

    Frederick, D.O.; Prestwood, D.C.L.; Roberts, K.; Vanston, J.H. Jr.

    1979-01-01

    The following subjects are included: a geothermal resource overview, the evolution of the current Texas geopressured-geothermal institutional structure, project evaluation with uncertainty and the structure of incentives, the natural gas industry, the electric utility industry, potential governmental participants in resource development, industrial users of thermal energy, current government incentives bearing on geopressured-geothermal development, six profiles for utilization of the geopressured-geothermal resources in the mid-term, and probable impacts of new government incentives on mid-term resource utilization profiles. (MHR)

  1. Institutional and environmental aspects of geothermal energy development

    Science.gov (United States)

    Citron, O. R.

    1977-01-01

    Until recently, the majority of work in geothermal energy development has been devoted to technical considerations of resource identification and extraction technologies. The increasing interest in exploiting the variety of geothermal resources has prompted an examination of the institutional barriers to their introduction for commercial use. A significant effort was undertaken by the Jet Propulsion Laboratory as a part of a national study to identify existing constraints to geothermal development and possible remedial actions. These aspects included legislative and legal parameters plus environmental, social, and economic considerations.

  2. NATO Advanced Study Institute on Giant Resonances in Atoms, Molecules, and Solids

    CERN Document Server

    Esteva, J; Karnatak, R

    1987-01-01

    Often, a new area of science grows at the confines between recognised subject divisions, drawing upon techniques and intellectual perspectives from a diversity of fields. Such growth can remain unnoticed at first, until a characteristic fami ly of effects, described by appropriate key words, has developed, at which point a distinct subject is born. Such is very much the case with atomic 'giant resonances'. For a start, their name itself was borrowed from the field of nuclear collective resonances. The energy range in which they occur, at the juncture of the extreme UV and the soft X-rays, remains to this day a meeting point of two different experimental techniques: the grating and the crystal spectrometer. The impetus of synchrotron spectroscopy also played a large part in developing novel methods, described by many acronyms, which are used to study 'giant resonances' today. Finally, although we have described them as 'atomic' to differentiate them from their counterparts in Nuclear Physics, their occurrence ...

  3. Many-body approximations for atomic binding energies

    CERN Document Server

    Schuster, Micah D; Staker, Joshua T

    2011-01-01

    We benchmark three approximations for the many-body problem -- the Hartree-Fock, projected Hartree-Fock, and random phase approximations -- against full numerical configuration-interaction calculations of the electronic structure of atoms, from Li through to Ne. Each method uses exactly the same input, i.e., the same single-particle basis and Coulomb matrix elements, so any differences are strictly due to the approximation itself. Although it consistently overestimates the ground state binding energy, the random phase approximation has the smallest overall errors; furthermore, we suggest it may be useful as a method for efficient optimization of single-particle basis functions.

  4. Environmental Survey preliminary report, Solar Energy Research Institute, Golden, Colorado

    Energy Technology Data Exchange (ETDEWEB)

    1988-10-01

    This report presents the preliminary findings of the first phase of the Environmental Survey of the US Department of Energy's (DOE) Solar Energy Research Institute (SERI), conducted December 14 through 18, 1987. The Survey is being conducted by an interdisciplinary team of environmental specialists, led and managed by the Office of Environment, Safety and Health's Office of Environmental Audit. The team includes outside experts supplied by private contractors. The objective of the Survey is to identify environmental problems and areas of environmental risk associated with SERI. The Survey covers all environmental media and all areas of environmental regulation. It is being performed in accordance with the DOE Environmental Survey Manual. The on-site phase of the Survey involves the review of existing site environmental data, observations of the operations carried on at SERI, and interviews with site personnel. 33 refs., 22 figs., 21 tabs.

  5. U.S. Radioecology Research Programs of the Atomic Energy Commission in the 1950s

    Energy Technology Data Exchange (ETDEWEB)

    Reichle, D.E.

    2004-01-12

    This report contains two companion papers about radiological and environmental research that developed out of efforts of the Atomic Energy Commission in the late 1940s and the 1950s. Both papers were written for the Joint U.S.-Russian International Symposium entitled ''History of Atomic Energy Projects in the 1950s--Sociopolitical, Environmental, and Engineering Lessons Learned,'' which was hosted by the International Institute for Applied Systems Analysis in Laxemberg, Austria, in October 1999. Because the proceedings of this symposium were not published, these valuable historic reviews and their references are being documented as a single ORNL report. The first paper, ''U.S. Radioecology Research Programs Initiated in the 1950s,'' written by David Reichle and Stanley Auerbach, deals with the formation of the early radioecological research programs at the U.S. Atomic Energy Commission's nuclear production facilities at the Clinton Engineering Works in Oak Ridge, Tennessee; at the Hanford Plant in Richland, Washington; and at the Savannah River Plant in Georgia. These early radioecology programs were outgrowths of the environmental monitoring programs at each site and eventually developed into the world renowned National Laboratory environmental program sponsored by the Office of Biological and Environmental Research of the U.S. Department of Energy. The original version of the first paper was presented by David Reichle at the symposium. The second paper, ''U.S. Atomic Energy Commission's Environmental Research Programs Established in the 1950s,'' summarizes all the environmental research programs supported by the U.S. Atomic Energy Commission in the 1950s and discusses their present-day legacies. This paper is a modified, expanded version of a paper that was published in September 1997 in a volume commemorating the 50th anniversary symposium of the U.S. Department of Energy's Office of

  6. ASTROPHYSICS. Atom-interferometry constraints on dark energy.

    Science.gov (United States)

    Hamilton, P; Jaffe, M; Haslinger, P; Simmons, Q; Müller, H; Khoury, J

    2015-08-21

    If dark energy, which drives the accelerated expansion of the universe, consists of a light scalar field, it might be detectable as a "fifth force" between normal-matter objects, in potential conflict with precision tests of gravity. Chameleon fields and other theories with screening mechanisms, however, can evade these tests by suppressing the forces in regions of high density, such as the laboratory. Using a cesium matter-wave interferometer near a spherical mass in an ultrahigh-vacuum chamber, we reduced the screening mechanism by probing the field with individual atoms rather than with bulk matter. We thereby constrained a wide class of dark energy theories, including a range of chameleon and other theories that reproduce the observed cosmic acceleration.

  7. The role of correlation in the ground state energy of confined helium atom

    Energy Technology Data Exchange (ETDEWEB)

    Aquino, N. [Departamento de Física, Universidad Autónoma Metropolitana-Iztapalapa, Apartado Postal 55-534, 09340 México Distrito Federal (Mexico)

    2014-01-14

    We analyze the ground state energy of helium atom confined by spherical impenetrable walls, and the role of the correlation energy in the total energy. The confinement of an atom in a cavity is one way in which we can model the effect of the external pressure on an atom. The calculations of energy of the system are carried out by the variational method. We find that the correlation energy remains almost constant for a range values of size of the boxes analyzed.

  8. ELENA MCP detector: absolute efficiency measurement for low energy neutral atoms

    Science.gov (United States)

    Rispoli, R.; De Angelis, E.; Colasanti, L.; Vertolli, N.; Orsini, S.; Scheer, J.; Mura, A.; Milillo, A.; Wurz, P.; Selci, S.; Di Lellis, A. M.; Leoni, R.; D'Alessandro, M.; Mattioli, F.; Cibella, S.

    2012-04-01

    MicroChannel plates (MCP) detectors are frequently used in space instrumentation for detecting a wide range of radiation and particles. In particular, the capability to detect non-thermal low energy neutral species is crucial for the sensor ELENA (Emitted Low-Energy Neutral Atoms), part of the package SERENA (Search for Exospheric Refilling and Emitted Natural Abundances) on board the BepiColombo mission to Mercury to be launched in 2014. ELENA is a TOF sensor, based on a novel concept ultra-sonic oscillating shutter (Start section)which is operated at frequencies up to 50 kHz; a MCP detector is used as a Stop section. It is aimed to detect neutral atoms in the range 10 eV - 5 keV, within 70° FOV, perpendicular to the S/C orbital plane. ELENA will monitor the emission of neutral atoms from the whole surface of Mercury thanks to the spacecraft motion. The major scientific objectives are the interaction between the environment and the planet, the global particle loss-rate and the remote sensing of the surface properties. In particular, surface release processes are investigated by identifying particles release from the surface, via solar wind-induced ion sputtering (100 eV) as well as Hydrogen back-scattered at hundreds eV. MCP absolute detection efficiency for very low energy neutral atoms (EMEFISTO facility of the Physical Institute of University of Bern (CH), measurements on three different type of MCPs coating have been performed providing the behaviors of MCP detection efficiency in the range 10eV-1keV. Outcomes from such measurements are here discussed.

  9. Isotope Effects in Low Energy Ion-Atom Collisions

    Energy Technology Data Exchange (ETDEWEB)

    Havener, Charles C [ORNL; Seely, D. G. [Albion College; Thomas, J. D. [University of Toledo, Toledo, OH; Kvale, Thomas Jay [University of Toledo, Toledo, OH

    2009-01-01

    Isotope effects for charge transfer processes have recently received increased attention. The ion-atom merged-beams apparatus at Oak Ridge National Laboratory is used to measure charge transfer for low energy collisions of multi-charged ions with H and D and is therefore well suited to investigate isotope effects. The apparatus has been relocated and upgraded to accept high velocity beams from the 250 kV High Voltage Platform at the Multi-Charged Ion Research Facility. The intense higher velocity multi-charged ion beams allow, for the first time, measurements with both H and D from keV/u down to meV/u collision energies in the center-of-mass frame. When charge transfer occurs at relatively large inter-nuclear distances (via radial couplings) the ion-induced dipole attraction can lead to trajectory effects, causing differences in the charge transfer cross sections for H and D. A strong isotope effect (nearly a factor of two) has been observed in the cross section for Si4+ + H(D) below 0.1 eV/u. However, little or no difference is observed for N2+ + H(D). Recently, strong effects have been predicted for the fundamental system He2+ + H(D,T) at collision energies below 200 eV/u where charge transfer occurs primarily through united-atom rotational coupling. We are currently exploring systems where rotational coupling is important and isotopic differences in the cross section can be observed.

  10. Energy from the Atom. A Basic Teaching Unit on Energy. Revised.

    Science.gov (United States)

    McDermott, Hugh, Ed.; Scharmann, Larry, Ed.

    Recommended for grades 9-12 social studies and/or physical science classes, this 4-8 day unit focuses on four topics: (1) the background and history of atomic development; (2) two common types of nuclear reactors (boiling water and pressurized water reactors); (3) disposal of radioactive waste; and (4) the future of nuclear energy. Each topic…

  11. Seeking to Improve Low Energy Neutral Atom Detection in Space

    Science.gov (United States)

    Shappirio, M.; Coplan, M.; Chornay, D.; Collier, M.; Herrero, F.; Ogilvie, K.; Williams, E.

    2007-01-01

    The detection of energetic neutral atoms allows for the remote examination of the interactions between plasmas and neutral populations in space. Before these neutral atoms can be measured, they must first be converted to ions. For the low energy end of this spectrum, interaction with a conversion surface is often the most efficient method to convert neutrals into ions. It is generally thought that the most efficient surfaces are low work functions materials. However, by their very nature, these surfaces are highly reactive and unstable, and therefore are not suitable for space missions where conditions cannot be controlled as they are in a laboratory. We therefore are looking to optimize a stable surface for conversion efficiency. Conversion efficiency can be increased either by changing the incident angle of the neutral particles to be grazing incidence and using stable surfaces with high conversion efficiencies. We have examined how to increase the angle of incidence from -80 degrees to -89 degrees, while maintaining or improving the total active conversion surface area without increasing the overall volume of the instrument. We are developing a method to micro-machine silicon, which will reduce the volume to surface area ratio by a factor of 60. We have also examined the material properties that affect the conversion efficiency of the surface for stable surfaces. Some of the parameters we have examined are work function, smoothness, and bond structure. We find that for stable surfaces, the most important property is the smoothness of the surface.

  12. An atomic empire a technical history of the rise and fall of the British atomic energy programme

    CERN Document Server

    Hill, C N

    2013-01-01

    Britain was the first country to exploit atomic energy on a large scale, and at its peak in the mid-1960s, it had generated more electricity from nuclear power than the rest of the world combined.The civil atomic energy programme grew out of the military programme which produced plutonium for atomic weapons. In 1956, Calder Hall power station was opened by the Queen. The very next year, one of the early Windscale reactors caught fire and the world's first major nuclear accident occurred.The civil programme ran into further difficulty in the mid-1960s and as a consequence of procrastination in

  13. Chaotic Energy Hopping in Bidirectionally Kicked Rydberg Atoms

    Science.gov (United States)

    Burke, Korana; Mitchell, Kevin; Ye, Shuzhen; Dunning, F. Barry

    2012-06-01

    A highly excited (n 306) quasi one-dimensional Rydberg atom exposed to periodic alternating external electric field pulses exhibits chaotic behavior. Time evolution of this system is governed by a geometric structure of phase space called a homoclinic tangle and its turnstile. The turnstile is responsible for organizing chaotic ionization. We present and explain the results from an experiment designed to probe the structure of the phase space turnstile. We create time-independent Rydberg wave packets, subject them to alternating electric field kicks, and measure the ionization fraction. We present the behavior of the ionization fraction as a function of the applied kick strength and show that this behavior is directly connected to the size and shape of the underlying turnstile. For short kicking periods the ionization fraction as a function of the applied kick strength exhibits step-function-like behavior that changes into s-shape behavior for large kicking periods. Next we use the geometric structure of phase space to design a short pulse sequence that quickly and efficiently transfers electronic wave packet from a high energy state to a much lower energy state. Finally, we show how the phase space geometry influences the efficiency of the transport between energy states.

  14. Atomic Energy of Canada Limited annual report 2000-2001

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    2001-07-01

    This is the annual report of the Atomic Energy of Canada Limited for the year ending March 31, 2001 and summarizes the activities of AECL during the period 2000-2001. The activities covered in this report include the CANDU reactor business, with progress being reported in the construction of two CANDU 6 reactors for the Qinshan CANDU project in China, the anticipated completion of Cernavoda unit 2, the completion of spent fuel storage at Cernavoda unit 1 in Romania, as well as the service business with New Brunswick Power, Ontario Power Generation, Bruce Power and Hydro Quebec in the refurbishment of operating, CANDU reactors. In the R and D programs discussions continue on funding for the Canadian Neutron Facility for Materials Research (CNF) and progress on the Maple medical isotope reactor.

  15. Atomic Energy of Canada Limited annual report 1999-2000

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    2000-07-01

    This is the annual report of the Atomic Energy of Canada Limited for the year ending March 31, 2000, and summarizes the activities of AECL during the period 1999-2000. The activities covered in this report include the CANDU reactor business, with the completion of the Wolsong unit 4 in the Republic of Korea, progress in the construction of two CANDU reactors for the Qinshan CANDU project in China, as well as the service business with Ontario Power Generation in the rehabilitation and life extension of operating CANDU reactors. In the R and D programs there is on-going effort towards the next generation of reactor technologies for CANDU nuclear power plants, discussions continue on the funding for the Canadian Neutron Facility for materials research (CNF) and progress being made on the Maple medical isotope reactor.

  16. Energy management action plan: Developing a strategy for overcoming institutional barriers to municipal energy conservation

    Energy Technology Data Exchange (ETDEWEB)

    1992-12-31

    Energy offices working to improve efficiency of local government facilities face not only technical tasks, but institutional barriers, such as budget structures that do not reward efficiency, a low awareness of energy issues, and purchasing procedures based only on minimizing initial cost. The bureau, in working to remove such barriers in San Francisco, has identified 37 institutional barriers in areas such as operations & maintenance, purchasing, and facility design; these barriers were then reorganized into three groupings-- policy & attitudes, budget & incentives, and awareness & information-- and mapped. This map shows that the barriers mutually reinforce each other, and that a holistic approach is required for permanent change. The city`s recreation & parks department was used as a model department, and information about facility energy use was compiled into a departmental energy review. Staff interviews showed how barriers affect conservation. The bureau then generated ideas for projects to remove specific barriers and rated them according to potential impact and the resources required to implement them. Four of the six projects selected focused on maintenance staff: a cost- sharing lighting retrofit program, a boiler efficiency program, a departmental energy tracking system, and a budgetary incentive program for conservation. The other two projects are city-wide: promotion of a new term contract supplying energy-efficient light materials, and publication/distribution of ENERGY NEWS newsletter. A general methodology, the EMAP Strategy Guide, has been created to assist other energy offices in developing EMAPs.

  17. Howard University Energy Expert Systems Institute Summer Program (EESI)

    Science.gov (United States)

    Momoh, James A.; Chuku, Arunsi; Abban, Joseph

    1996-01-01

    Howard University, under the auspices of the Center for Energy Systems and Controls runs the Energy Expert Systems Institute (EESI) summer outreach program for high school/pre-college minority students. The main objectives are to introduce precollege minority students to research in the power industry using modern state-of-the-art technology such as Expert Systems, Fuzzy Logic and Artificial Neural Networks; to involve minority students in space power management, systems and failure diagnosis; to generate interest in career options in electrical engineering; and to experience problem-solving in a teamwork environment consisting of faculty, senior research associates and graduate students. For five weeks the students are exposed not only to the exciting experience of college life, but also to the inspiring field of engineering, especially electrical engineering. The program consists of lectures in the fundamentals of engineering, mathematics, communication skills and computer skills. The projects are divided into mini and major. Topics for the 1995 mini projects were Expert Systems for the Electric Bus and Breast Cancer Detection. Topics on the major projects include Hybrid Electric Vehicle, Solar Dynamics and Distribution Automation. On the final day, designated as 'EESI Day' the students did oral presentations of their projects and prizes were awarded to the best group. The program began in the summer of 1993. The reaction from the students has been very positive. The program also arranges field trips to special places of interest such as the NASA Goddard Space Center.

  18. Hawaii Natural Energy Institute annual report, July 1981-June 1982

    Energy Technology Data Exchange (ETDEWEB)

    Brown, N.E. (ed.)

    1982-01-01

    This report includes brief progress reports on the 35 research and development projects in geothermal energy, ocean energy, biomass energy, wind energy, solar energy, and other renewable energy sources. (DLC)

  19. ELENA MCP detector: absolute detection efficiency for low-energy neutral atoms

    Science.gov (United States)

    Rispoli, R.; De Angelis, E.; Colasanti, L.; Vertolli, N.; Orsini, S.; Scheer, J. A.; Mura, A.; Milillo, A.; Wurz, P.; Selci, S.; Di Lellis, A. M.; Leoni, R.; D'Alessandro, M.; Mattioli, F.; Cibella, S.

    2012-09-01

    Microchannel Plates (MCP) detectors are frequently used in space instrumentation for detecting a wide range of radiation and particles. In particular, the capability to detect non-thermal low energy neutral species is crucial for the sensor ELENA (Emitted Low-Energy Neutral Atoms), part of the package SERENA (Search for Exospheric Refilling and Emitted Natural Abundances) on board the BepiColombo mission of ESA to Mercury to be launched in 2015. ELENA is a Time of Flight (TOF) sensor, based on a novel concept using an ultra-sonic oscillating shutter (Start section), which is operated at frequencies up to 50 kHz; a MCP detector is used as a Stop detector. The scientific objective of ELENA is to detect energetic neutral atoms in the range 10 eV - 5 keV, within 76° FOV, perpendicular to the S/C orbital plane. ELENA will monitor the emission of neutral atoms from the whole surface of Mercury thanks to the spacecraft motion. The major scientific objectives are the interaction between the plasma environment and the planet’s surface, the global particle loss-rate and the remote sensing of the surface properties. In particular, surface release processes are investigated by identifying particles released from the surface, via solar wind-induced ion sputtering (MEFISTO facility of the Physical Institute of the University of Bern (CH), measurements on three different types of MCP (with and without coating) have been performed providing the detection efficiencies in the energy range 10eV - 1keV. Outcomes from such measurements are discussed here.

  20. Atoms

    Institute of Scientific and Technical Information of China (English)

    刘洪毓

    2007-01-01

    Atoms(原子)are all around us.They are something like the bricks (砖块)of which everything is made. The size of an atom is very,very small.In just one grain of salt are held millions of atoms. Atoms are very important.The way one object acts depends on what

  1. The impact of atomic precision measurements in high energy physics

    OpenAIRE

    Casalbuoni, Roberto

    2000-01-01

    In this talk I discuss the relevance of atomic physics in understanding some important questions about elementary particle physics. A particular attention is devoted to atomic parity violation measurements which seem to suggest new physics beyond the Standard Model. Atomic physics might also be relevant in discovering possible violations of the CPT symmetry.

  2. A study on the improvement of the legal system concerning Korean Atomic Energy Act

    Energy Technology Data Exchange (ETDEWEB)

    Yoo, Il Un; Jung, Jong Hak; Kim, Jae Ho; Moon, Jong Wook; Kim, In Sub [Chungnam National Univ., Taejon (Korea, Republic of)

    1998-03-15

    Cause-effect analysis, adjustment, and generalization of the current atomic energy act are contents of this research. These are to be based on the legal theory. Analysis of the current atomic energy act from the viewpoint of constitutional law and administrative law. Review of the other domestic legal systems which have similar problems as the atomic energy act has. Inquiry about the operation of nuclear legal systems of foreign nations.

  3. Atomic Energy Act and Related Legislation. Environmental Guidance Program Reference Book: Revision 6

    Energy Technology Data Exchange (ETDEWEB)

    1992-09-01

    This report presents information related to the Atomic Energy Act and related legislation. Sections are presented pertaining to legislative history and statutes, implementing regulations, and updates.

  4. 75 FR 10444 - Nuclear Energy Institute; Denial of Petition for Rulemaking

    Science.gov (United States)

    2010-03-08

    ... COMMISSION 10 CFR Part 73 Nuclear Energy Institute; Denial of Petition for Rulemaking AGENCY: Nuclear... (NRC) is denying a petition for rulemaking (PRM) submitted by the Nuclear Energy Institute (NEI) (the... rulemaking. The petitioner states that the nuclear energy industry has fully implemented numerous...

  5. Used energy-related laboratory equipment grant program for institutions of higher learning. Eligible equipment catalog

    Energy Technology Data Exchange (ETDEWEB)

    1994-07-01

    This is a listing of energy related equipment available through the Energy-Related Laboratory Equipment Grant Program which grants used equipment to institutions of higher education for energy-related research. Information included is an overview of the program, how to apply for a grant of equipment, eligibility requirements, types of equipment available, and the costs for the institution.

  6. AtomDB and PyAtomDB: Atomic Data and Modelling Tools for High Energy and Non-Maxwellian Plasmas

    Science.gov (United States)

    Foster, Adam; Smith, Randall K.; Brickhouse, Nancy S.; Cui, Xiaohong

    2016-04-01

    The release of AtomDB 3 included a large wealth of inner shell ionization and excitation data allowing accurate modeling of non-equilibrium plasmas. We describe the newly calculated data and compare it to published literature data. We apply the new models to existing supernova remnant data such as W49B and N132D. We further outline progress towards AtomDB 3.1, including a new energy-dependent charge exchange cross sections.We present newly developed models for the spectra of electron-electron bremsstrahlung and those due to non-Maxwellian electron distributions.Finally, we present our new atomic database access tools, released as PyAtomDB, allowing powerful use of the underlying fundamental atomic data as well as the spectral emissivities.

  7. Atomic Layer Deposition of Bismuth Vanadates for Solar Energy Materials.

    Science.gov (United States)

    Stefik, Morgan

    2016-07-07

    The fabrication of porous nanocomposites is key to the advancement of energy conversion and storage devices that interface with electrolytes. Bismuth vanadate, BiVO4 , is a promising oxide for solar water splitting where the controlled fabrication of BiVO4 layers within porous, conducting scaffolds has remained a challenge. Here, the atomic layer deposition of bismuth vanadates is reported from BiPh3 , vanadium(V) oxytriisopropoxide, and water. The resulting films have tunable stoichiometry and may be crystallized to form the photoactive scheelite structure of BiVO4 . A selective etching process was used with vanadium-rich depositions to enable the synthesis of phase-pure BiVO4 after spinodal decomposition. BiVO4 thin films were measured for photoelectrochemical performance under AM 1.5 illumination. The average photocurrents were 1.17 mA cm(-2) at 1.23 V versus the reversible hydrogen electrode using a hole-scavenging sulfite electrolyte. The capability to deposit conformal bismuth vanadates will enable a new generation of nanocomposite architectures for solar water splitting.

  8. Tritium handling experience at Atomic Energy of Canada Limited

    Energy Technology Data Exchange (ETDEWEB)

    Suppiah, S.; McCrimmon, K.; Lalonde, S.; Ryland, D.; Boniface, H.; Muirhead, C.; Castillo, I. [Atomic Energy of Canad Limited - AECL, Chalk River Laboratories, Chalk River, ON (Canada)

    2015-03-15

    Canada has been a leader in tritium handling technologies as a result of the successful CANDU reactor technology used for power production. Over the last 50 to 60 years, capabilities have been established in tritium handling and tritium management in CANDU stations, tritium removal processes for heavy and light water, tritium measurement and monitoring, and understanding the effects of tritium on the environment. This paper outlines details of tritium-related work currently being carried out at Atomic Energy of Canada Limited (AECL). It concerns the CECE (Combined Electrolysis and Catalytic Exchange) process for detritiation, tritium-compatible electrolysers, tritium permeation studies, and tritium powered batteries. It is worth noting that AECL offers a Tritium Safe-Handling Course to national and international participants, the course is a mixture of classroom sessions and hands-on practical exercises. The expertise and facilities available at AECL is ready to address technological needs of nuclear fusion and next-generation nuclear fission reactors related to tritium handling and related issues.

  9. Fast and Accurate Modeling of Molecular Atomization Energies with Machine Learning

    CERN Document Server

    Rupp, Matthias; Müller, Klaus-Robert; von Lilienfeld, O Anatole

    2011-01-01

    We introduce a machine learning model to predict atomization energies of a diverse set of organic molecules, based on nuclear charges and atomic positions only. The problem of solving the molecular Schr\\"odinger equation is mapped onto a non-linear statistical regression problem of reduced complexity. Regression models are trained on and compared to atomization energies computed with hybrid density-functional theory. Cross-validation over more than seven thousand small organic molecules yields a mean absolute error of ~10 kcal/mol. Applicability is demonstrated for the prediction of molecular atomization potential energy curves.

  10. Level-energy-dependent mean velocities of excited tungsten atoms sputtered by krypton-ion bombardment

    Energy Technology Data Exchange (ETDEWEB)

    Nogami, Keisuke; Sakai, Yasuhiro; Mineta, Shota [Department of Physics, Toho University, Miyama, Funabashi, Chiba 274-8510 (Japan); Kato, Daiji; Murakami, Izumi [National Institute for Fusion Science, Toki, Gifu 509-5292, Japan and Department of Fusion Science, School of Physical Sciences, SOKENDAI (The Graduate University for Advanced Studies), Toki, Gifu 509-5292 (Japan); Sakaue, Hiroyuki A. [National Institute for Fusion Science, Toki, Gifu 509-5292 (Japan); Kenmotsu, Takahiro [Department of Biomedical Engineering, Faculty of Life and Medical Sciences, Doshisha University, Tatara-Miyakodani, Kyotanabe, Kyoto 610-0394 (Japan); Furuya, Kenji [Faculty of Arts and Science, Kyushu University, 744 Motooka, Nishi-ku, Fukuoka 819-0395 (Japan); Motohashi, Kenji, E-mail: motohashi@toyo.jp [Department of Biomedical Engineering, Faculty of Science and Engineering, Toyo University, 2100 Kujirai, Kawagoe, Saitama 350-8585, Japan and Bio-Nano Electronics Research Centre, Toyo University, 2100 Kujirai, Kawagoe, Saitama 350-8585 (Japan)

    2015-11-15

    Visible emission spectra were acquired from neutral atoms sputtered by 35–60 keV Kr{sup +} ions from a polycrystalline tungsten surface. Mean velocities of excited tungsten atoms in seven different 6p states were also obtained via the dependence of photon intensities on the distance from the surface. The average velocities parallel to the surface normal varied by factors of 2–4 for atoms in the different 6p energy levels. However, they were almost independent of the incident ion kinetic energy. The 6p-level energy dependence indicated that the velocities of the excited atoms were determined by inelastic processes that involve resonant charge exchange.

  11. SIMULATION OF THE ATOMIZED FLOW BY SLIT TYPE BUCKET ENERGY DISSIPATOR

    Institute of Scientific and Technical Information of China (English)

    LIU Shi-he; DUAN Hong-dong

    2005-01-01

    Slit type bucket is one kind of flip bucket for energy dissipation generally used in the hydraulic project.In this paper the atomized flow produced behind this energy dissipator is analyzed, a numerical model for the aerated jet considering air entrainment and air resistance force is suggested, and simulation of the rain resulted by the atomized flow is also discussed.Furthermore, the prototype observation data for the atomized flow of Dongjiang Hydropower Station is used to verify the model suggested.

  12. Organizational Cultural Assessment of the Solar Energy Research Institute

    Energy Technology Data Exchange (ETDEWEB)

    None

    1991-06-01

    An Organizational Cultural Assessment (OCA) was performed at the Solar Energy Research Institute (SERI) by administering an Organizational Culture Survey (OCS) that queried employees on the subjects of organizational culture, various aspects of communications, employee commitment, work group cohesion, coordination of work, environmental concerns, hazardous nature of work, safety and overall job satisfaction. The purpose of the OCS is to measure in a quantitative and objective way the notion of culture;'' that is, the values, attitudes, and beliefs of the individuals working within the organization. In addition, through the OCS, a broad simple of individuals can be reached that would probably not be interviewed or observed during the course of a typical assessment. The OCS also provides a descriptive profile of the organization at one point in time that can then be compared to a profile taken at a different point in time to assess changes in the culture of the organization. All data from the OCS is presented in group summaries, by division, supervisory level, and staff classification. Statistically significant differences between groups are identified and discussed. The most notable finding which emerges from the OCA conducted at SERI is that it is a very homogeneous organization as indicated by the few statistically significant differences found between divisions/offices, staff classifications, and supervisory levels. The results also indicate SERI to be an organization which places a large amount of emphasis on those behaviors which are considered constructive'' (i.e., Humanistic-Encouraging, Affiliative, Achievement, Self-Actualizing) and, although to a lesser extent, on those behaviors which could be regarded as passive/defensive'' (i.e., Approval, Conventional, Dependent, Avoidance). 9 refs., 11 figs., 6 tabs.

  13. Energy crises and cooperation: Do international institutions matter?

    Science.gov (United States)

    Chakarova, Vessela P.

    The risk of an oil supply disruption still exists. Oil reserves are increasingly concentrated in a handful of unreliable regimes, plagued by piracy and terrorism. Natural disasters and chokepoint incidents have increased in frequency. In addition, oil is expected to remain a significant part of the energy mix up until 2030. By that time Europe will be importing 90% of its oil. Thus, oil supply security will become an increasingly important feature of European politics. One way to counter the noxious consequences of an oil disruption is to cooperate. International cooperation is a critical factor in any type of crisis, however, it is especially important when it comes to a finite, highly concentrated and critical commodity like oil. The lack of coordination might lead to scrambling and oil hoarding, which dramatically exacerbate the crisis. Yet cooperation in the oil issue-area has been the subject of only a few studies, none of which provides a systematic and comprehensive analysis. They are also limited in their scope and findings. This dissertation aims to partially fill this lacuna. It employs a structured focused comparison to study European consumer countries' cooperation in times of oil supply shortages. There have been fifteen such crises since the Second World War, three of which with dramatic consequences for the world economy. The analysis evaluates European cooperative efforts in seven of these cases, starting with the Abadan crisis in 1951. The cases are selected on the basis of their magnitude and economic impact. In particular, I look at intergovernmental negotiations within existing international bodies prior to, during and immediately after the crisis. The findings suggest that institutions are more likely to facilitate interstate cooperation in the presence of a strong leader (a hegemon) - a role, which in the case of the oil issue-area was assumed by the US until the early 1970s.

  14. Energy shift of H-atom electrons due to Gibbons-Hawking thermal bath

    CERN Document Server

    Pardy, Miroslav

    2016-01-01

    The electromagnetic shift of energy levels of H-atom electrons is determined by calculating an electron coupling to the Gibbons-Hawking electromagnetic field thermal bath. Energy shift of electrons in H-atom is determined in the framework of the non-relativistic quantum mechanics.

  15. CAS institute, US national lab ink MOU on renewable energy sources

    Institute of Scientific and Technical Information of China (English)

    2009-01-01

    @@ Amemorandum of understanding (MOU) for cooperation on renewable energy sources was signed between the CAS Institute of Electrical Engineering (IEE) and the US National Renewable Energy Laboratory (NREL) on 11 November,2008, in Beijing.

  16. Legal-institutional arrangements facilitating offshore wind energy conversion systems (WECS) utilization. Final report

    Energy Technology Data Exchange (ETDEWEB)

    Mayo, L.H.

    1977-09-01

    Concern for the continuing sufficiency of energy supplies in the U.S. has tended to direct increasing attention to unconventional sources of supply, including wind energy. Some of the more striking proposals for the utilization of wind energy relate to offshore configurations. The legal-institutional arrangements for facilitating the utilization of offshore wind energy conversion systems (WECS) are examined by positioning three program alternatives and analyzing the institutional support required for the implementation of each.

  17. 76 FR 28192 - Petition for Rulemaking Submitted by the Nuclear Energy Institute

    Science.gov (United States)

    2011-05-16

    ... From the Federal Register Online via the Government Publishing Office NUCLEAR REGULATORY COMMISSION 10 CFR Part 26 Petition for Rulemaking Submitted by the Nuclear Energy Institute AGENCY: Nuclear... rulemaking (PRM) submitted by Anthony R. Pietrangelo, on behalf of the Nuclear Energy Institute (NEI),...

  18. 75 FR 63725 - Nuclear Energy Institute; Consideration of Petition in the Rulemaking Process

    Science.gov (United States)

    2010-10-18

    ... From the Federal Register Online via the Government Publishing Office NUCLEAR REGULATORY COMMISSION 10 CFR Part 70 Nuclear Energy Institute; Consideration of Petition in the Rulemaking Process... raised in a petition submitted by the Nuclear Energy Institute (NEI), and is denying the remaining...

  19. Atomic mean excitation energies for stopping powers from local plasma oscillator strengths

    Science.gov (United States)

    Wilson, J. W.; Xu, Y. J.; Chang, C. K.; Kamaratos, E.

    1984-01-01

    The stopping of a charged particle by isolated atoms is investigated theoretically using an 'atomic plasma' model in which atomic oscillator strengths are replaced by the plasma frequency spectrum. The plasma-frequency correction factor for individual electron motion proposed by Pines (1953) is incorporated, and atomic mean excitation energies are calculated for atoms through Sr. The results are compared in a graph with those obtained theoretically by Inokuti et al. (1978, 1981) and Dehmer et al. (1975) and with the experimental values compiled by Seltzer and Berger (1982): good agreement is shown.

  20. Observation of a power-law energy distribution in atom-ion hybrid system

    Science.gov (United States)

    Meir, Ziv; Akerman, Nitzan; Sikorsky, Tomas; Ben-Shlomi, Ruti; Dallal, Yehonatan; Ozeri, Roee

    2016-05-01

    Understanding atom-ion collision dynamics is at the heart of the growing field of ultra-cold atom-ion physics. The naive picture of a hot ion sympathetically-cooled by a cold atomic bath doesn't hold due to the time dependent potentials generated by the ion Paul trap. The energy scale of the atom-ion system is determined by a combination of the atomic bath temperature, the ion's excess micromotion (EMM) and the back action of the atom-ion attraction on the ion's position in the trap. However, it is the position dependent ion's inherent micromotion which acts as an amplifier for the ion's energy during random consecutive collisions. Due to this reason, the ion's energy distribution deviates from Maxwell-Boltzmann (MB) characterized by an exponential tail to one with power-law tail described by Tsallis q-exponential function. Here we report on the observation of a strong deviation from MB to Tsallis energy distribution of a trapped ion. In our experiment, a ground-state cooled 88 Sr+ ion is immersed in an ultra-cold cloud of 87 Rb atoms. The energy scale is determined by either EMM or solely due to the back action on the ion position during a collision with an atom in the trap. Energy distributions are obtained using narrow optical clock spectroscopy.

  1. Energy Spectra of the Confined Atoms Obtained by Using B-Splines

    Institute of Scientific and Technical Information of China (English)

    SHI Ting-Yun; BAO Cheng-Guang; LI Bai-Wen

    2001-01-01

    We have calculated the energy spectra of one- and two-electron atoms (ions) centered in an impenetrable spherical box by variational method with B-splines as basis functions. Accurate results are obtained for both large and small radii of confinement. The critical box radius of confined hydrogen atom is also calculated to show the usefulness of our method. A partial energy degeneracy in confined hydrogen atom is found when the radius of spherical box is equal to the distance at which a node of single-node wavefunctions of free hydrogen atom is located.

  2. Theoretical study of atoms by the electronic kinetic energy density and stress tensor density

    CERN Document Server

    Nozaki, Hiroo; Tachibana, Akitomo

    2016-01-01

    We analyze the electronic structure of atoms in the first, second and third periods using the electronic kinetic energy density and stress tensor density, which are local quantities motivated by quantum field theoretic consideration, specifically the rigged quantum electrodynamics. We compute the zero surfaces of the electronic kinetic energy density, which we call the electronic interfaces, of the atoms. We find that their sizes exhibit clear periodicity and are comparable to the conventional atomic and ionic radii. We also compute the electronic stress tensor density and its divergence, tension density, of the atoms, and discuss how their electronic structures are characterized by them.

  3. Excitation and charge transfer in low-energy hydrogen atom collisions with neutral atoms: Theory, comparisons, and application to Ca

    CERN Document Server

    Barklem, Paul S

    2016-01-01

    A theoretical method for the estimation of cross sections and rates for excitation and charge transfer processes in low-energy hydrogen atom collisions with neutral atoms, based on an asymptotic two-electron model of ionic-covalent interactions in the neutral atom-hydrogen atom system, is presented. The calculation of potentials and non-adiabatic radial couplings using the method is demonstrated. The potentials are used together with the multi-channel Landau-Zener model to calculate cross sections and rate coefficients. The main feature of the method is that it employs asymptotically exact atomic wavefunctions, which can be determined from known atomic parameters. The method is applied to Li+H, Na+H, and Mg+H collisions, and the results compare well with existing detailed full-quantum calculations. The method is applied to the astrophysically important problem of Ca+H collisions, and rate coefficients are calculated for temperatures in the range 1000-20000 K.

  4. Alternate Funding Sources for the International Atomic Energy Agency

    Energy Technology Data Exchange (ETDEWEB)

    Toomey, Christopher; Wyse, Evan T.; Kurzrok, Andrew J.; Swarthout, Jordan M.

    2012-09-04

    Since 1957, the International Atomic Energy Agency (IAEA) has worked to ensure the safe and responsible promotion of nuclear technology throughout the world. The IAEA operates at the intersection of the Nuclear Nonproliferation Treaty’s (NPT) fourth and third articles, which guarantee Parties to the Treaty the right to peaceful uses of nuclear technology, provided those activities are placed under safeguards verified by the IAEA. However, while the IAEA has enjoyed substantial success and prestige in the international community, there is a concern that its resources are being stretched to a point where it may no longer be possible to execute its multifaceted mission in its entirety. As noted by the Director General (DG) in 2008, demographics suggest that every aspect of the IAEA’s operations will be in higher demand due to increasing reliance on non-carbon-based energy and the concomitant nonproliferation, safety, and security risks that growth entails. In addition to these nuclear energy concerns, the demand for technical developmental assistance in the fields of food security, resource conservation, and human health is also predicted to increase as the rest of the world develops. Even with a 100% value-for-money rating by the U.S. Office of Management and Budget (OMB) and being described as an “extraordinary bargain” by the United Nations Secretary-General’s High-level Panel on Threats, Challenges and Change, real budget growth at the Agency has been limited to zero-real growth for a better part of the last two decades. Although the 2012 regular budget (RB) received a small increase for most programs, the 2013 RB has been set at zero-real growth. As a result, the IAEA has had to defer infrastructure investments, which has hindered its ability to provide the public goods its Members seek, decreased global security and development opportunities, and functionally transformed the IAEA into a charity, dependent on extrabudgetary (EB) contributions to sustain

  5. Dr. R. Chidambaram, Chairman, Atomic Energy Commission, India

    CERN Multimedia

    Laurent Guiraud

    1999-01-01

    Chairman R. Chidambaram (second from right) accompagnied by (left to right) Atul Gurtu and Vemuri Narasimham of Bombay's Tata Institute for Fundamental Research, and CMS co-spokesman Jim Virdee (right).

  6. Paul Scherrer Institute Scientific Report 1998. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Daum, C.; Leuenberger, J. [eds.

    1999-08-01

    In view of its mission to contribute towards the development of a globally more sustainable energy supply system, the General Energy Department is focusing on four topical areas: advancing technologies for the use of renewable energies; investigating options for chemical and electrochemical energy storage on various time scales; developing highly efficient converters for the low emission use of fossil and renewable fuels, including both combustion devices and fuel cells; analyzing the consequences of energy use, and advancing scenarios for the development of the energy supply system. Progress in 1998 in these topical areas is described in this report. A list of scientific publications in 1998 is also provided. (author) figs., tabs., refs.

  7. Energy use and potential energy conservation for companies and institutions; Energieverbruik en besparingspotentieel bedrijven en instellingen

    Energy Technology Data Exchange (ETDEWEB)

    De Groot, G.M.; Morgenstern, P.P.

    2009-07-01

    The VROM Inspectorate (VI) ordered an investigation to determine which types of companies and institutions would qualify for the VI project Climate and Energy, which aims to stimulate companies to save energy. The project will focus on branches and sectors that, currently, are not participating in government energy conservation agreements or the Greenhouse gas Emission Trading System, but that have a high energy consumption and a significant potential for conserving energy. A large part of the Dutch trade, services and government sector (Handel, Diensten en Overheid (HDO)) qualifies for participation in the project of the VROM Inspectorate. This HDO sector is responsible for 12% of the energy use within the Netherlands and has large energy-saving potential. Many of the branches within this sector use a considerable amount of energy (five petajoules or more), but are not part of any energy conservation agreement. The branches involved are: recreation; healthcare and welfare; wholesale; retail; car trade, maintenance and repairs; food services; and commercial and financial services. The largest energy conservation measures for which the costs could be recovered within five years, relate to power consumption by machines, appliances and lighting. Insulation of existing buildings could also realise substantial energy savings, although the cost-recovery time would be longer and, therefore, these measures often are not mandatory. An important part of the industrial sector, consuming around 30 per cent of the energy within the Netherlands, does not qualify for participation in the VI project. In this sector, around 90% of the energy is used by companies that already participate in energy conservation agreements (the Covenant Benchmarking, and the Long-term agreements on energy efficiency (LTA3)), or in the Greenhouse Gas Emission Trading System (EU ETS). These companies have the largest potential for saving energy. Industrial sectors that, as yet, do not participate in

  8. Implementation of dose management system at radiation protection board of Ghana Atomic Energy Commission.

    Science.gov (United States)

    Hasford, F; Amoako, J K; Darko, E O; Emi-Reynolds, G; Sosu, E K; Otoo, F; Asiedu, G O

    2012-01-01

    The dose management system (DMS) is a computer software developed by the International Atomic Energy Agency for managing data on occupational exposure to radiation sources and intake of radionuclides. It is an integrated system for the user-friendly storage, processing and control of all existing internal and external dosimetry data. The Radiation Protection Board (RPB) of the Ghana Atomic Energy Commission has installed, customised, tested and using the DMS as a comprehensive DMS to improve personnel and area monitoring in the country. Personnel dose records from the RPBs database from 2000 to 2009 are grouped into medical, industrial and education/research sectors. The medical sector dominated the list of monitored institutions in the country over the 10-y period representing ∼87 %, while the industrial and education/research sectors represent ∼9 and ∼4 %, respectively. The number of monitored personnel in the same period follows a similar trend with medical, industrial and education/research sectors representing ∼74, ∼17 and ∼9 %, respectively. Analysis of dose data for 2009 showed that there was no instance of a dose above the annual dose limit of 20 mSv, however, 2.7 % of the exposed workers received individual annual doses >1 mSv. The highest recorded individual annual dose and total collective dose in all sectors were 4.73 mSv and 159.84 man Sv, respectively. Workers in the medical sector received higher individual doses than in the other two sectors, and average dose per exposed worker in all sectors is 0.25 mSv.

  9. Determining the band gap and mean kinetic energy of atoms from reflection electron energy loss spectra

    Energy Technology Data Exchange (ETDEWEB)

    Vos, M. [Atomic and Molecular Physics Laboratories, Research School of Physics and Engineering, Australian National University, Canberra ACT (Australia); Marmitt, G. G. [Atomic and Molecular Physics Laboratories, Research School of Physics and Engineering, Australian National University, Canberra ACT (Australia); Instituto de Fisica da Universidade Federal do Rio Grande do Sul, Avenida Bento Goncalves 9500, 91501-970 Porto Alegre, RS (Brazil); Finkelstein, Y. [Nuclear Research Center — Negev, Beer-Sheva 84190 (Israel); Moreh, R. [Physics Department, Ben-Gurion University of the Negev, Beer-Sheva 84105 (Israel)

    2015-09-14

    Reflection electron energy loss spectra from some insulating materials (CaCO{sub 3}, Li{sub 2}CO{sub 3}, and SiO{sub 2}) taken at relatively high incoming electron energies (5–40 keV) are analyzed. Here, one is bulk sensitive and a well-defined onset of inelastic excitations is observed from which one can infer the value of the band gap. An estimate of the band gap was obtained by fitting the spectra with a procedure that includes the recoil shift and recoil broadening affecting these measurements. The width of the elastic peak is directly connected to the mean kinetic energy of the atom in the material (Doppler broadening). The experimentally obtained mean kinetic energies of the O, C, Li, Ca, and Si atoms are compared with the calculated ones, and good agreement is found, especially if the effect of multiple scattering is taken into account. It is demonstrated experimentally that the onset of the inelastic excitation is also affected by Doppler broadening. Aided by this understanding, we can obtain a good fit of the elastic peak and the onset of inelastic excitations. For SiO{sub 2}, good agreement is obtained with the well-established value of the band gap (8.9 eV) only if it is assumed that the intensity near the edge scales as (E − E{sub gap}){sup 1.5}. For CaCO{sub 3}, the band gap obtained here (7 eV) is about 1 eV larger than the previous experimental value, whereas the value for Li{sub 2}CO{sub 3} (7.5 eV) is the first experimental estimate.

  10. Division of Atomic Physics. Lund Institute of Technology. Progress Report 1993-1994

    Energy Technology Data Exchange (ETDEWEB)

    Wahlstroem, C.G. [ed.

    1995-12-31

    The Division of Atomic Physics is responsible for basic physics teaching in all engineering disciplines and for specialized teaching in Optics, Atomic Physics, Spectroscopy, Laser Physics, and Non-Linear Optics. Research activities are mainly carried out in the fields of basic and applied spectroscopy, largely based on the use of lasers. Projects in the following areas are reported: Basic Atomic Physics - Atomic physics with high power laser radiation; Laser spectroscopic investigations of atomic and ionic excited states in the short-wavelength region; Laser spectroscopy in the visible; Theoretical Atomic Physics; Applied Optics and Quantum Electronics -High resolution spectroscopy; Photon echoes in Rare Earth Ion Doped Crystals; diode laser Spectroscopy; Environmental Remote Sensing -Tropospheric Ozone Lidar; Measurement of gases of geophysical origin; Industrial and Urban Pollution Measurements; Laser induced fluorescence of vegetation and water; Applications in Medicine and Biology - Tissue diagnostic using Laser-induced fluorescence; Photodynamic Therapy; Measurement of Optical Properties of Tissue with applications to Diagnostics; Two Photon Excited fluorescence Microscopy; Capillary Electrophoresis; New Techniques; Industrial Applications - Optical spectroscopy in Metallurgy; Physics of Electric Breakdown in Dielectric liquids; Optical Spectroscopy of Paper.

  11. Resonance interaction energy between two accelerated identical atoms in a coaccelerated frame and the Unruh effect

    CERN Document Server

    Zhou, Wenting; Rizzuto, Lucia

    2016-01-01

    We investigate the resonance interaction energy between two uniformly accelerated identical atoms, interacting with the scalar field or the electromagnetic field in the vacuum state, in the reference frame coaccelerating with the atoms. We assume that one atom is excited and the other in the ground state, and that they are prepared in their correlated symmetric or antisymmetric state. Using perturbation theory, we separate, at the second order in the atom-field coupling, the contributions of vacuum fluctuations and radiation reaction field to the energy shift of the interacting system. We show that only the radiation reaction term contributes to the resonance interaction between the two atoms, while Unruh thermal fluctuations, related to the vacuum fluctuations contribution, do not affect the resonance interatomic interaction. We also show that the resonance interaction between two uniformly accelerated atoms, recently investigated in the comoving (locally inertial) frame, can be recovered in the coaccelerate...

  12. Paul Scherrer Institute Scientific Report 2000. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Daum, Christina; Leuenberger, Jakob [eds.

    2001-03-01

    Research at PSI comprises all aspects of human energy use, with the ultimate goal of promoting development towards a sustainable energy supply system. In the General Energy Research Department, technologies are being advanced for the utilization of renewable energy sources, low-loss energy storage, efficient conversion, and low emission energy use. Experimental and model-based assessment of these emissions forms the basis of a comprehensive assessment of economic, ecological and environmental consequences, for both present and future energy supply systems. The research program of the department is centered around (1) development, use, and characterisation of catalysts for energy technologies in many different fields, like e.g. the partial oxidation of methanol for hydrogen production, the processing of methane by catalytic combustion and reforming; (2) use of concentrated solar radiation to induce chemical conversions, thereby producing energy carriers; (3) development of efficient, less polluting combustion engines and burners by advancing the detailed understanding of reaction mechanisms and combustion pathways; (4) research and development of low temperature polymer electrolyte fuel cells, novel batteries and capacitors, with applications envisaged for electric vehicles, photovoltaics and on-site load leveling; (5) experimental and model based research concerning transportation and chemistry of atmospheric trace gases related to anthropogenic energy transformations. Progress in 2000 in these topical areas is described in this report. A list of scientific publications in 2000 is also provided.

  13. Paul Scherrer Institute Scientific Report 2000. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Daum, Christina; Leuenberger, Jakob [eds.

    2001-07-01

    Research at PSI comprises all aspects of human energy use, with the ultimate goal of promoting development towards a sustainable energy supply system. In the General Energy Research Department, technologies are being advanced for the utilization of renewable energy sources, low-loss energy storage, efficient conversion, and low emission energy use. Experimental and model-based assessment of these emissions forms the basis of a comprehensive assessment of economic, ecological and environmental consequences, for both present and future energy supply systems. The research program of the department is centered around 1) development, use, and characterisation of catalysts for energy technologies in many different fields, like e.g. the partial oxidation of methanol for hydrogen production, the processing of methane by catalytic combustion and reforming; 2) use of concentrated solar radiation to induce chemical conversions, thereby producing energy carriers; 3) development of efficient, less polluting combustion engines and burners by advancing the detailed understanding of reaction mechanisms and combustion pathways; 4) research and development of low temperature polymer electrolyte fuel cells, novel batteries and capacitors, with applications envisaged for electric vehicles, photovoltaics and on-site load leveling; 5) experimental and model based research concerning transportation and chemistry of atmospheric trace gases related to anthropogenic energy transformations. Progress in 2000 in these topical areas is described in this report. A list of scientific publications in 2000 is also provided.

  14. Paul Scherrer Institut Scientific Report 2001. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Wokaun, Alexander; Daum, Christina (eds.)

    2002-03-01

    Research at PSI comprises all aspects of human energy use, with the ultimate goal of promoting development towards a sustainable energy supply system. In the General Energy Research Department, technologies are being advanced for the utilization of renewable energy sources, low-loss energy storage, efficient conversion, and low emission energy use. Experimental and model-based assessment of these emissions forms the basis of a comprehensive assessment of economic, ecological and environmental consequences, for both present and future energy supply systems. The research program of the department is centered around 1) development, use, and characterisation of catalysts for energy technologies in many different fields, like e.g. the partial oxidation of methanol for hydrogen production, the processing of methane by catalytic combustion and reforming; 2) use of concentrated solar radiation to induce chemical conversions, thereby producing energy carriers; 3) development of efficient, less polluting combustion engines and burners by advancing the detailed understanding of reaction mechanisms and combustion pathways; 4) research and development of low temperature polymer electrolyte fuel cells, novel batteries and capacitors, with applications envisaged for electric vehicles, photovoltaics and on-site load leveling; 5) experimental and model based research concerning transportation and chemistry of atmospheric trace gases related to anthropogenic energy transformations. Progress in 2000 in these topical areas is described in this report. A list of scientific publications in 2001 is also provided.

  15. Paul Scherrer Institut Scientific Report 2004. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Wokaun, Alexander; Daum, Christina (eds.)

    2005-03-01

    Research at PSI comprises all aspects of human energy use, with the ultimate goal of promoting development towards a sustainable energy supply system. In the General Energy Research Department, technologies are being advanced for the utilization of renewable energy sources, low-loss energy storage, efficient conversion, and low emission energy use. Experimental and model-based assessment of these emissions forms the basis of a comprehensive assessment of economic, ecological and environmental consequences, for both present and future energy supply systems. The research program of the department is centered around 1) development, use, and characterisation of catalysts for energy technologies in many different fields, like e.g. the partial oxidation of methanol for hydrogen production, the processing of methane by catalytic combustion and reforming; 2) use of concentrated solar radiation to induce chemical conversions, thereby producing energy carriers; 3) development of efficient, less polluting combustion engines and burners by advancing the detailed understanding of reaction mechanisms and combustion pathways; 4) research and development of low temperature polymer electrolyte fuel cells, novel batteries and capacitors, with applications envisaged for electric vehicles, photovoltaics and on-site load leveling; 5) experimental and model based research concerning transportation and chemistry of atmospheric trace gases related to anthropogenic energy transformations. Progress in 2000 in these topical areas is described in this report. A list of scientific publications in 2002 is also provided.

  16. Paul Scherrer Institut Scientific Report 2002. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Wokaun, Alexander; Daum, Christina (eds.)

    2003-03-01

    Research at PSI comprises all aspects of human energy use, with the ultimate goal of promoting development towards a sustainable energy supply system. In the General Energy Research Department, technologies are being advanced for the utilization of renewable energy sources, low-loss energy storage, efficient conversion, and low emission energy use. Experimental and model-based assessment of these emissions forms the basis of a comprehensive assessment of economic, ecological and environmental consequences, for both present and future energy supply systems. The research program of the department is centered around 1) development, use, and characterisation of catalysts for energy technologies in many different fields, like e.g. the partial oxidation of methanol for hydrogen production, the processing of methane by catalytic combustion and reforming; 2) use of concentrated solar radiation to induce chemical conversions, thereby producing energy carriers; 3) development of efficient, less polluting combustion engines and burners by advancing the detailed understanding of reaction mechanisms and combustion pathways; 4) research and development of low temperature polymer electrolyte fuel cells, novel batteries and capacitors, with applications envisaged for electric vehicles, photovoltaics and on-site load leveling; 5) experimental and model based research concerning transportation and chemistry of atmospheric trace gases related to anthropogenic energy transformations. Progress in 2000 in these topical areas is described in this report. A list of scientific publications in 2002 is also provided.

  17. Paul Scherrer Institut Scientific Report 2003. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Wokaun, Alexander; Daum, Christina (eds.)

    2004-03-01

    Research at PSI comprises all aspects of human energy use, with the ultimate goal of promoting development towards a sustainable energy supply system. In the General Energy Research Department, technologies are being advanced for the utilization of renewable energy sources, low-loss energy storage, efficient conversion, and low emission energy use. Experimental and model-based assessment of these emissions forms the basis of a comprehensive assessment of economic, ecological and environmental consequences, for both present and future energy supply systems. The research program of the department is centered around 1) development, use, and characterisation of catalysts for energy technologies in many different fields, like e.g. the partial oxidation of methanol for hydrogen production, the processing of methane by catalytic combustion and reforming; 2) use of concentrated solar radiation to induce chemical conversions, thereby producing energy carriers; 3) development of efficient, less polluting combustion engines and burners by advancing the detailed understanding of reaction mechanisms and combustion pathways; 4) research and development of low temperature polymer electrolyte fuel cells, novel batteries and capacitors, with applications envisaged for electric vehicles, photovoltaics and on-site load leveling; 5) experimental and model based research concerning transportation and chemistry of atmospheric trace gases related to anthropogenic energy transformations. Progress in 2000 in these topical areas is described in this report. A list of scientific publications in 2002 is also provided.

  18. From the atomic bomb to the Landau Institute autobiography top non-secret

    CERN Document Server

    Khalatnikov, Isaak M

    2012-01-01

    The book is an expanded autobiography of the famous theoretical physicist Isaak Khalatnikov. He worked together with L.D. Landau at the Institute for Physical Problems lead by P.L. Kapitza. He is the co-author of L.D. Landau in a number of important works. They worked together in the frame of the so-called Nuclear Bomb Project. After the death of L.D. Landau, I.M. Khalatnikov initiated the establishment of the Institute for Theoretical Physics, named in honour of L.D. Landau, within the USSR Academy of Sciences. He headed this institute from the beginning as its Director. The institute inherited almost all traditions of the Landau scientific school and played a prominent role in the development of theoretical physics. So, this is a story about how the institute was created, how it worked, and about the life of the physicists in the "golden age" of the Soviet science. A separate chapter is devoted to today´s life of the institute and the young generation of physicists working now in science. It is an historic...

  19. Paul Scherrer Institute Scientific Report 1999. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Daum, Christina; Leuenberger, Jakob [eds.

    2000-07-01

    Strengthening of international collaborations represented a strategic goal of the General Energy Research Department for 1999. For the Fifth Framework Program of the European Union, we participated in consortia and in the successful preparation of several proposals. National networks with partners from academia and Industry have been formed in two topical areas of central interest in the context of sustainability, i.e. 'Ecoefficient energy use and material cycles' and 'Sustainable transportation' on the other hand. Research at PSI comprises all aspects of human energy use, with the ultimate goal of promoting development towards a sustainable energy supply system. In the General Energy Research Department, technologies are being advanced for the utilization of renewable energy sources, low-loss energy storage, efficient conversion, and low emission energy use. Experimental and model-based assessment of these emissions forms the basis of a comprehensive assessment of economic, ecological and environmental consequences, for both present and future energy supply systems. The research program of the department is centered around 1) development, use, and characterisation of catalysts for energy technologies in many different fields, like e.g. the partial oxidation of methanol for hydrogen production, the processing of methane by catalytic combustion and reforming; 2) use of concentrated solar radiation to induce chemical conversions, thereby producing energy carriers; 3) development of efficient, less polluting combustion engines and burners by advancing the detailed understanding of reaction mechanisms and combustion pathways; 4) research and development of low temperature polymer electrolyte fuel cells, novel batteries and capacitors, with applications envisaged for electric vehicles, photovoltaics and on-site load leveling; 5) experimental and model based research concerning transportation and chemistry of atmospheric trace gases related to

  20. Definition of a proper institutional and legal framweork to promote energy efficiency in Uruguay

    Energy Technology Data Exchange (ETDEWEB)

    Blanco, Alfonso; Juarez, Maria

    2010-09-15

    There is no lower cost energy source than the avoided energy from unnecessary consumption either more expensive energy than scarce energy resources in a growing economy. Under this concept energy efficiency has been established as one of the main pillars of energy policy in Uruguay since 2005. A recently approved Law provides 4-axis of action to promote energy efficiency: building of institutional structure and long-term framework necessary for nationwide development, ensuring consumers access to adequate information, facilitating the access to finance and economic resources to encourage energy efficiency projects and, removing tax and administrative barriers to energy efficiency.

  1. The CUNY Energy Institute Electrical Energy Storage Development for Grid Applications

    Energy Technology Data Exchange (ETDEWEB)

    Banerjee, Sanjoy

    2013-03-31

    1. Project Objectives The objectives of the project are to elucidate science issues intrinsic to high energy density electricity storage (battery) systems for smart-grid applications, research improvements in such systems to enable scale-up to grid-scale and demonstrate a large 200 kWh battery to facilitate transfer of the technology to industry. 2. Background Complex and difficult to control interfacial phenomena are intrinsic to high energy density electrical energy storage systems, since they are typically operated far from equilibrium. One example of such phenomena is the formation of dendrites. Such dendrites occur on battery electrodes as they cycle, and can lead to internal short circuits, reducing cycle life. An improved understanding of the formation of dendrites and their control can improve the cycle life and safety of many energy storage systems, including rechargeable lithium and zinc batteries. Another area where improved understanding is desirable is the application of ionic liquids as electrolytes in energy storage systems. An ionic liquid is typically thought of as a material that is fully ionized (consisting only of anions and cations) and is fluid at or near room temperature. Some features of ionic liquids include a generally high thermal stability (up to 450 °C), a high electrochemical window (up to 6 V) and relatively high intrinsic conductivities. Such features make them attractive as battery or capacitor electrolytes, and may enable batteries which are safer (due to the good thermal stability) and of much higher energy density (due to the higher voltage electrode materials which may be employed) than state of the art secondary (rechargeable) batteries. Of particular interest is the use of such liquids as electrolytes in metal air batteries, where energy densities on the order of 1-2,000 Wh / kg are possible; this is 5-10 times that of existing state of the art lithium battery technology. The Energy Institute has been engaged in the

  2. Interactions of satellite-speed helium atoms with satellite surfaces. 2: energy distributions of reflected helium atoms. [7000 m/s

    Energy Technology Data Exchange (ETDEWEB)

    Liu, S.M.; Knuth, E.L.

    1976-04-01

    Energy transfer in collisions of satellite-speed (7,000 m/s) helium atoms with a cleaned 6061-T6 satellite-type aluminum surface was investigated by use of the molecular-beam technique. The amount of energy transferred was determined from the measured energy of the molecular-beam and the measured spatial and energy distributions of the reflected atoms. Spatial distributions of helium atoms scattered from a 6061-T6 aluminum surface were measured. The scattering pattern exhibits a prominent backscattering, probably due to the gross surface roughness and/or the relative lattice softness of the aluminum surface. Energy distributions of reflected helium atoms from the same surface were measured for six different incidence angles. For each incidence angle, distributions were measured at approximately sixty scattering positions. At a given scattering position, the energy spectra of the reflected helium atoms and the background gas were obtained by use of the retarding-field energy analyzer. (auth)

  3. Field ionization of free helium atoms: Correlation between the kinetic energy of ionized atoms and probability of their field ionization

    Energy Technology Data Exchange (ETDEWEB)

    Piskur, J.; Borg, L. [Institute of Experimental Physics, Graz University of Technology, Petersgasse 16, 8010 Graz (Austria); Stupnik, A.; Leisch, M. [Institute of Solid State Physics, Graz University of Technology, Petersgasse 16, 8010 Graz (Austria); Ernst, W.E. [Institute of Experimental Physics, Graz University of Technology, Petersgasse 16, 8010 Graz (Austria); Holst, B. [Institute of Experimental Physics, Graz University of Technology, Petersgasse 16, 8010 Graz (Austria)], E-mail: bodil@cantab.net

    2008-05-15

    In this paper the correlation between the kinetic energy of helium atoms and the probability of field ionization is investigated by exploiting the narrow velocity distribution of supersonic molecular beams. Field ionization measurements were carried out on supersonic helium beams at 298 K and 95 K corresponding to energies of about 65 meV and 20 meV, respectively, for the individual atoms. The field ionization was performed with a tungsten tip, radius of curvature 12 nm, kept at room temperature. The ionization probability was found to increase by about a factor 10 when the beam was cooled from 298 K to 95 K. The results presented in this paper are of importance for improving the understanding of field ionization and for the development of a new detector for helium and other molecular beams.

  4. Field ionization of free helium atoms: Correlation between the kinetic energy of ionized atoms and probability of their field ionization

    Science.gov (United States)

    Piskur, J.; Borg, L.; Stupnik, A.; Leisch, M.; Ernst, W. E.; Holst, B.

    2008-05-01

    In this paper the correlation between the kinetic energy of helium atoms and the probability of field ionization is investigated by exploiting the narrow velocity distribution of supersonic molecular beams. Field ionization measurements were carried out on supersonic helium beams at 298 K and 95 K corresponding to energies of about 65 meV and 20 meV, respectively, for the individual atoms. The field ionization was performed with a tungsten tip, radius of curvature 12 nm, kept at room temperature. The ionization probability was found to increase by about a factor 10 when the beam was cooled from 298 K to 95 K. The results presented in this paper are of importance for improving the understanding of field ionization and for the development of a new detector for helium and other molecular beams.

  5. The Scales of Time, Length, Mass, Energy, and Other Fundamental Physical Quantities in the Atomic World and the Use of Atomic Units in Quantum Mechanical Calculations

    Science.gov (United States)

    Teo, Boon K.; Li, Wai-Kee

    2011-01-01

    This article is divided into two parts. In the first part, the atomic unit (au) system is introduced and the scales of time, space (length), and speed, as well as those of mass and energy, in the atomic world are discussed. In the second part, the utility of atomic units in quantum mechanical and spectroscopic calculations is illustrated with…

  6. Experimental evidence of the decrease of kinetic energy of hadrons in passing through atomic nuclei

    Science.gov (United States)

    Strugalski, Z.

    1985-01-01

    Hadrons with kinetic energies higher than the pion production threshold lose their kinetic energies monotonically in traversing atomic nuclei, due to the strong interactions in nuclear matter. This phenomenon is a crude analogy to the energy loss of charged particles in their passage through materials. Experimental evidence is presented.

  7. Mr Parvez Butt, Chairman of the Atomic Energy Commission (PAEC), Pakistan

    CERN Multimedia

    Maximilien Brice

    2003-01-01

    Photo 01: Mr. Parvez Butt, Chairman Pakistan Atomic Energy Commission (standing 4th from left) with his delegation and ATLAS team standing in front of the Barrel Supports manufactured in HMC3 - Pakistan.

  8. Report of the Energy Field Institute V on western energy opportunities, problems, and policy issues

    Energy Technology Data Exchange (ETDEWEB)

    Hepworth, J.C.; Foss, M.M.

    1982-12-01

    The fifth Energy and Minerals Field Institute program for Washington, D.C. Congressional and Executive Aides was held during August 15-21, 1982. The five-and-one-half day program was conducted through Wyoming, Colorado and Utah and consisted of visits to: an R and D tertiary petroleum production facility; an historic oil field entering secondary production; a surface uranium mine; a petroleum exploration drilling rig; a surface coal mine; an air cooled, coal-fired power plant; an oil shale site; a geothermal-electrical generating facility; and open pit copper mine and associated smelter and refinery; a petroleum refinery and an oil shale semi-works retort. During the field program, participants had opportunities to view communities affected by these activities, such as Wright City and Gillette, Wyoming, Parachute, Colorado and Milford and Cedar City, Utah. Throughout the program, aides met with local, state and industry officials and citizen leaders during bus rides, meals and site visits.

  9. Energy and low carbon development efforts in Ghana: institutional arrangements, initiatives, challenges and the way forward

    DEFF Research Database (Denmark)

    Tutu Benefoh, Daniel; Ackom, Emmanuel

    2016-01-01

    , clearer institutional mandates, continuous improvements in institutional coordination (intra and inter), capacity and skills development, sustained visibility of the essence of energy and LCD at high political levels as well as engagement by civil societies. Equally important are the issues of finance...

  10. Inauguration of the international Institute of the nuclear energy; Inauguration de l'Institut international de l'energie nucleaire

    Energy Technology Data Exchange (ETDEWEB)

    Anon.

    2011-07-15

    On June 27, 2011 was inaugurated in Saclay (France) the I2EN (international Institute of the nuclear energy) and the Jannus platform. The I2EN has to particularly centralize and relay, at the international scale, the French formations offer in the field of nuclear energy. On the other hand, the Jannus platform is an example of cooperation between research organisms and universities. (O.M.)

  11. The industrial development of atomic energy; Le developpement industriel de l'energie atomique

    Energy Technology Data Exchange (ETDEWEB)

    Kowarski, L. [Commissariat a l' Energie Atomique, Paris (France). Centre d' Etudes Nucleaires

    1955-07-01

    Countries with large stock of fissile material and producing large quantity of nuclear pure {sup 235}U and {sup 239}Pu are able to allocate part of the stock to non military research. For countries with low stock of fissile material, all the stock is allocated to military research. An economical and technical solution has to be find to dedicate a part of fissile material to non military research and develop the atomic energy industry. It stated the industrial and economical problems and in particular the choice between the use of enriched fuel with high refining cost or depleted fuel with low production cost. It discusses of four possible utilizations of the natural resources: reactors functioning with pure fissile material ({sup 235}U or {sup 239}Pu) or concentrated material ({sup 235}U mixed with small quantities of {sup 238}U after an incomplete isotopic separation), breeder reactors functioning with enriched material mixed with {sup 238}U or Thorium placed in an appropriate spatial distribution to allow neutrons beam to activate {sup 238}U or Thorium with the regeneration of fissile material in {sup 239}Pu, reactors using natural uranium or low enriched uranium can also produce Plutonium with less efficiency than breeder reactors and the last solution being the use of natural uranium with the only scope of energy production and no production of secondary fissile material. The first class using pure fissile material has a low energy efficiency and is used only by large fissile material stock countries to accumulate energy in small size fuel for nuclear engines researches for submarines and warships. The advantage of the second class of reactors, breeder reactors, is that they produce energy and plutonium. Two type of breeder reactor are considered: breeder reactor using pure fissile material and {sup 238}U or breeder reactor using the promising mixture of pure fissile material and Thorium. Different projects are in phase of development in United States, England

  12. Mapping of Ethiopian higher education institutions on clean energy

    Energy Technology Data Exchange (ETDEWEB)

    2011-04-15

    Norad commissioned Econ Poeyry to map teaching and research activities and capacity related to clean energy in selected Ethiopian universities. The mapping identified challenges and opportunities with the aim of facilitating future intervention by the Ethiopian Government and donors to help improve the energy sector development of the country. The report covered the government-owned universities of Bahir Dar, Mekelle, Jimma, Arba Minch and Addis Ababa. The mapping was based on a questionnaire and on interviews at each university. (Author)

  13. Paul Scherrer Institut annual report 1995. Annex IV: PSI nuclear energy and safety

    Energy Technology Data Exchange (ETDEWEB)

    Birchley, J.; Roesel, R.; Doesburg, R. van [eds.] [Paul Scherrer Inst. (PSI), Villigen (Switzerland)

    1996-09-01

    Nuclear energy research in Switzerland is concentrated at PSI`s Department F4. It is explicitly mentioned in the Institute`s official charter and commands about one fifth of the Institute`s federal resources. Presently, PSI invests approx. 200 py/a in nuclear energy research, one third of this being externally funded; the share of external funding in investment costs totals approx. 50%. This funding is provided by the Swiss utilities and the NAGRA, the Safety Authority (HSK) and the former National Fund for Energy Research (NEFF). PSI`s activities in nuclear research concentrate on three main areas: safety of operating plants, safety features of future reactor concepts and waste management. 7% of personnel are invested in addressing global aspects of energy. (author) figs., tabs., refs.

  14. Virial theorem in the Kohn-Sham density-functional theory formalism: accurate calculation of the atomic quantum theory of atoms in molecules energies.

    Science.gov (United States)

    Rodríguez, Juan I; Ayers, Paul W; Götz, Andreas W; Castillo-Alvarado, F L

    2009-07-14

    A new approach for computing the atom-in-molecule [quantum theory of atoms in molecule (QTAIM)] energies in Kohn-Sham density-functional theory is presented and tested by computing QTAIM energies for a set of representative molecules. In the new approach, the contribution for the correlation-kinetic energy (T(c)) is computed using the density-functional theory virial relation. Based on our calculations, it is shown that the conventional approach where atomic energies are computed using only the noninteracting part of the kinetic energy might be in error by hundreds of kJ/mol.

  15. Sampling and analysis plan for the former Atomic Energy Commission bus lot property

    Energy Technology Data Exchange (ETDEWEB)

    Nielson, R.R.

    1998-07-01

    This sampling and analysis plan (SAP) presents the rationale and strategy for the sampling and analysis activities proposed in support of an initial investigation of the former Atomic Energy Commission (AEC) bus lot property currently owned by Battelle Memorial Institute. The purpose of the proposed sampling and analysis activity is to investigate the potential for contamination above established action levels. The SAP will provide defensible data of sufficient quality and quantity to support recommendations of whether any further action within the study area is warranted. To assist in preparing sampling plans and reports, the Washington State Department of Ecology (Ecology) has published Guidance on Sampling and Data Analysis Methods. To specifically address sampling plans for petroleum-contaminated sites, Ecology has also published Guidance for Remediation of Petroleum Contaminated Sites. Both documents were used as guidance in preparing this plan. In 1992, a soil sample was taken within the current study area as part of a project to remove two underground storage tanks (USTs) at Battelle`s Sixth Street Warehouse Petroleum Dispensing Station (Section 1.3). The results showed that the sample contained elevated levels of total petroleum hydrocarbons (TPH) in the heavy distillate range. This current study was initiated in part as a result of that discovery. The following topics are considered: the historical background of the site, current site conditions, previous investigations performed at the site, an evaluation based on the available data, and the contaminants of potential concern (COPC).

  16. "Pseudo-invariant Eigen-operator" Method for Deriving Energy-Gap of an Atom-Cavity Jaynes-Cummings Hamiltonian with Atomic Centre-of-Mass Motion

    Institute of Scientific and Technical Information of China (English)

    FAN Hong-Yi; TANG Xu-Bing

    2006-01-01

    Using the "Pseudo-invariant eigen-operator" method we find the energy-gap of the Jaynes-Cummings Hamiltonian model of an atom-cavity system. This model takes the atomic centre-of-mass motion into account. The supersymmetric structure is involved in the Hamiltonian of an atom-cavity system. By selecting suitable supersymmetric generators and using supersymmetric transformation the Hamiltonian is diagonalized and energy eigenvectors are obtained.

  17. Scaled-energy spectroscopy of a |M|=1 Rydberg barium atom in an electric field

    Institute of Scientific and Technical Information of China (English)

    Wang Lei; Quan Wei; Shen Li; Yang Hai-Feng; Shi Ting-Yun; Liu Xiao-Jun; Liu Hong-Ping; Zhan Ming-Sheng

    2009-01-01

    We observe strong energy-dependent quantum defects in the scaled-energy Stark spectra for |M|=1 Rydberg states of barium atoms at three scaled energies: ε= -2.000, ε= -2.500 and ε=-3.000. In an attempt to explain the observations, theoretical calculations of closed orbit theory based on a model potential including core effect are performed for non-hydrogenic atoms. While such a potential has been uniformly successful for alkali atoms with a single valence electron, it fails to match experimental results for barium atoms in the 6snp Rydberg states with two valence electrons. Our study points out that this discrepancy is due to the strong perturbation from the 5d8p state, which voids the simple approximation for constant quantum defects of principle quantum number n.

  18. Matter, energy, and heat transfer in a classical ballistic atom pump.

    Science.gov (United States)

    Byrd, Tommy A; Das, Kunal K; Mitchell, Kevin A; Aubin, Seth; Delos, John B

    2014-11-01

    A ballistic atom pump is a system containing two reservoirs of neutral atoms or molecules and a junction connecting them containing a localized time-varying potential. Atoms move through the pump as independent particles. Under certain conditions, these pumps can create net transport of atoms from one reservoir to the other. While such systems are sometimes called "quantum pumps," they are also models of classical chaotic transport, and their quantum behavior cannot be understood without study of the corresponding classical behavior. Here we examine classically such a pump's effect on energy and temperature in the reservoirs, in addition to net particle transport. We show that the changes in particle number, of energy in each reservoir, and of temperature in each reservoir vary in unexpected ways as the incident particle energy is varied.

  19. A Combination of the Work Formalism for Exchange with an Optimized Correlation Energy Functional for Atoms

    Science.gov (United States)

    Cordero, N. A.; Sen, K. D.; Alonso, J. A.; Balbás, L. C.

    1995-09-01

    The Harbola-Sahni formalism for the exchange potential of many-electron systems gives extremely accurate total energies for atoms (the energies are practically indistinguishable from the Hartree-Fock energies). We combine here this formalism with the usual density functional prescription for the correlation potential, using a recently developed optimized local correlation functional (Gritsenko O.V. et al., Phys. Rev. A 47 (1993) 1811). Numerical tests carried out for several closed shell atoms and ions indicate that the results preserve the accuracy of the exchange-only calculations. We expect the same behavior to hold true for large molecules and atomic clusters. However, similar tests for the He, Be and Ne isoelectronic series indicate that the optimized local correlation functional is not valid for highly ionized atoms.

  20. Atom probe tomography simulations and density functional theory calculations of bonding energies in Cu3Au

    KAUST Repository

    Boll, Torben

    2012-10-01

    In this article the Cu-Au binding energy in Cu3Au is determined by comparing experimental atom probe tomography (APT) results to simulations. The resulting bonding energy is supported by density functional theory calculations. The APT simulations are based on the Müller-Schottky equation, which is modified to include different atomic neighborhoods and their characteristic bonds. The local environment is considered up to the fifth next nearest neighbors. To compare the experimental with simulated APT data, the AtomVicinity algorithm, which provides statistical information about the positions of the neighboring atoms, is applied. The quality of this information is influenced by the field evaporation behavior of the different species, which is connected to the bonding energies. © Microscopy Society of America 2012.

  1. Energy law in Europe - national, EU and international law and institutions

    Energy Technology Data Exchange (ETDEWEB)

    Roggenkamp, Martha M. [Leiden Univ., International Inst. for Energy Law, Leiden (Netherlands); Roenne, Anita [Copenhagen Univ., Copenhagen (Denmark); Redgwell, Catherine [St. Peter' s Coll., Oxford (United Kingdom); Guayo, Inigo del [Almeria Univ., Almeria (ES)] (eds.)

    2001-07-01

    This work provides a comparative survey, analysis and synthesis of energy law and regulation under EU and international law and in eight key European energy producing jurisdictions (Denmark, France, Germany, Italy, Netherlands, Norway, Spain, United Kingdom). In addition to separate chapters focusing on the law and institutions of each jurisdiction in turn, there are also major chapters on the impact of international law, environmental law issues, the CEEC and Energy Charter Treaty and EU Energy Law. (Author)

  2. Institutional applications of solar total energy systems. Third quarterly report

    Energy Technology Data Exchange (ETDEWEB)

    1978-01-31

    Estimates are presented of the availability of land for solar total energy (STE) systems. The investigation of the external decision processes that affect an STE system choice was continued. The STE system/utility interface was examined, presenting regional time-of-day pricing scenarios and estimates of backup rates. The possible effects that the financial community could have on STE market penetration was considered. Regional and sectoral energy-use profiles were developed. These profiles served as a basis for simulating yearly system performance on an hourly basis to estimate system costs and savings. Preliminary conceptual designs were developed for both thermal and photovoltaic STE systems. Refined system designs and detailed capital cost and performance estimates for the optimized designs are presented. (MHR)

  3. Energy and low carbon development efforts in Ghana: institutional arrangements, initiatives, challenges and the way forward

    Directory of Open Access Journals (Sweden)

    Emmanuel Kofi Ackom

    2016-04-01

    Full Text Available Over the years, Ghana has invested considerable effort and resources together with international partners to develop the energy sector and to mainstream energy low carbon pathways into national development plans. Low carbon development (LCD provides a good opportunity, of not only building upon earlier energy and climate change local processes and structures but also help to mainstream low carbon agenda in economic activities and national development plans. For this to work however, require efficient institutions and effective institutional arrangements. Based on extensive literature analysis, personal communications and inputs from stakeholders, the paper highlights the key institutional arrangements, their interactions, challenges and proffers recommendations for improvements. To improve energy and low carbon development effort from the perspectives of institutional structures, would require, clearer institutional mandates, continuous improvements in institutional coordination (intra and inter, capacity and skills development, sustained visibility of the essence of energy and LCD at high political levels as well as engagement by civil societies. Equally important are the issues of finance, data availability and quality, monitoring and evaluation.

  4. The FEMP Awards Program: Fostering Institutional Change and Energy Management Excellence

    Energy Technology Data Exchange (ETDEWEB)

    McDermott, Christa; Malone, Elizabeth L.

    2014-05-20

    This report assesses the use of institutional change principles and the institutional impact of award-winning projects through interviews with 22 Department of Energy Federal Energy Management Program (DOE FEMP) award winners. Award winners identified institutional facilitators and barriers in their projects and programs as well as factors in their implementation processes, thus providing information that can guide other efforts. We found that award winners do use strategies based on eight principles of institutional change, most frequently in terms of making changes to infrastructure, engaging leadership, and capitalizing on multiple motivations for making an energy efficiency improvement. The principles drawn on the least often were commitment and social empowerment. Award winners also faced five major types of obstacles that were institutional in nature: lack of resources, constraints of rules, psychological barriers, lack of information, and communication problems. We also used the seven categories of Energy Management Excellence (EME) as a lens to interpret the interview data and assess whether these categories relate to established institutional change principles. We found that the eight principles reflect strategies that have been found to be useful in improving energy efficiency in organizations, whereas the EME categories capture more of a blend of social contextual factors and strategies. The EME categories fill in some of the social context gaps that facilitate institutional change and energy management excellence, for example, personal persistence, a culture that supports creativity and innovation, regular engagement with tenants, contractors, and staff at all levels. Taking together the use of principles, EME criteria, and obstacles faced by interviewees, we make recommendations for how FEMP can better foster institutional change in federal agencies.

  5. Developing the World's Digital Collection on Peaceful Uses of Atomic Energy.

    Science.gov (United States)

    Levine, Emil

    1997-01-01

    Discusses the developers/development, maintainers, and users of the digital collection on peaceful uses of nuclear energy, produced by the International Nuclear Information System (INIS) of the International Atomic Energy Agency (IAEA). Sensitive to users in both developing and highly developed countries, this system provides closer linkage…

  6. 76 FR 56242 - Duke Energy Carolinas, LLC; Southern Nuclear Operating Company; Establishment of Atomic Safety...

    Science.gov (United States)

    2011-09-12

    ... Energy Carolinas, LLC; Southern Nuclear Operating Company; Establishment of Atomic Safety and Licensing...: Duke Energy Carolinas, LLC, (William States Lee III Nuclear Station, Units 1 and 2), Docket Nos. 52-018... From the Federal Register Online via the Government Publishing Office NUCLEAR...

  7. Using Density Functional Theory (DFT) for the Calculation of Atomization Energies

    Science.gov (United States)

    Bauschlicher, Charles W., Jr.; Partridge, Harry; Langhoff, Stephen R. (Technical Monitor)

    1995-01-01

    The calculation of atomization energies using density functional theory (DFT), using the B3LYP hybrid functional, is reported. The sensitivity of the atomization energy to basis set is studied and compared with the coupled cluster singles and doubles approach with a perturbational estimate of the triples (CCSD(T)). Merging the B3LYP results with the G2(MP2) approach is also considered. It is found that replacing the geometry optimization and calculation of the zero-point energy by the analogous quantities computed using the B3LYP approach reduces the maximum error in the G2(MP2) approach. In addition to the 55 G2 atomization energies, some results for transition metal containing systems will also be presented.

  8. Nuclear Energy: It is Time to Revitalize the Peaceful Atom

    Science.gov (United States)

    2011-03-16

    levels of poisonous hydrogen sulfide . Base load electricity is required twenty four hours a day. Wind power is intermittent. The sun does not shine at...dependence on foreign oil by producing hydrogen for use in fuel cells and synthetic liquid fuels.57 Nuclear energy is bad for the environment. Nuclear

  9. LOW ENERGY BEAM-GAS SPECTROSCOPY OF HIGHLY IONISED ATOMS

    OpenAIRE

    Desesquelles, J.; DENIS A.; Druetta, M.; Martin, S.

    1989-01-01

    Features of low energy beam-gas spectroscopic source are reviewed and compared to those of other light sources. Measurement techniques are surveyed. They include the study of wavelength of heavy multiply charged ions in visible and u.v. ranges from normal excited states, doubly excited states, high n levels and doubly excited Rydberg levels.

  10. Laser spectroscopy of the antiprotonic helium atom – its energy levels and state lifetimes

    CERN Document Server

    Hidetoshi, Yamaguchi

    2003-01-01

    The antiprotonic atom is a three-body exotic system consisting of an antiproton, an electron and a helium nucleus. Its surprising longevity was found and has been studied for more than 10 years. In this work, transition energies and lifetimes of this exotic atom were systematically studied by using the antiproton beam of AD(Antiproton Decelerator) facility at CERN, with an RFQ antiproton decelerator, a narrow-bandwidth laser, Cerenkov counters with fast-response photomultiplier tubes, and cryogenic helium target systems. Thirteen transition energies were determined with precisions of better than 200 ppb by a laser spectroscopy method, together with the elimination of the shift effect caused by collisions with surrounding atoms. Fifteen lifetimes (decay rates) of short-lived states were determined from the time distributions of the antiproton-annihilation signals and the resonance widths of the atomic spectral lines. The relation between the magnitude of the decay rates and the transition multipolarity was inv...

  11. The energy profiles of atomic conformational transition intermediates of adenylate kinase.

    Science.gov (United States)

    Feng, Yaping; Yang, Lei; Kloczkowski, Andrzej; Jernigan, Robert L

    2009-11-15

    The elastic network interpolation (ENI) (Kim et al., Biophys J 2002;83:1620-1630) is a computationally efficient and physically realistic method to generate conformational transition intermediates between two forms of a given protein. However it can be asked whether these calculated conformations provide good representatives for these intermediates. In this study, we use ENI to generate conformational transition intermediates between the open form and the closed form of adenylate kinase (AK). Based on C(alpha)-only intermediates, we construct atomic intermediates by grafting all the atoms of known AK structures onto the C(alpha) atoms and then perform CHARMM energy minimization to remove steric conflicts and optimize these intermediate structures. We compare the energy profiles for all intermediates from both the CHARMM force-field and from knowledge-based energy functions. We find that the CHARMM energies can successfully capture the two energy minima representing the open AK and closed AK forms, while the energies computed from the knowledge-based energy functions can detect the local energy minimum representing the closed AK form and show some general features of the transition pathway with a somewhat similar energy profile as the CHARMM energies. The combinatorial extension structural alignment (Shindyalov et al., 1998;11:739-747) and the k-means clustering algorithm are then used to show that known PDB structures closely resemble computed intermediates along the transition pathway.

  12. van der Waals energy under strong atom-field coupling in doped carbon nanotubes

    OpenAIRE

    Bondarev, Igor; Lambin, Philippe

    2004-01-01

    Using a unified macroscopic QED formalism, we derive an integral equation for the van der Waals energy of a two-level atomic system near a carbon nanotube. The equation is valid for both strong and weak atom-vacuum-field coupling. By solving it numerically, we demonstrate the inapplicability of weak-coupling-based van der Waals interaction models in a close vicinity of the nanotube surface.

  13. van der Waals energy under strong atom field coupling in doped carbon nanotubes

    Science.gov (United States)

    Bondarev, I. V.; Lambin, Ph.

    2004-10-01

    Using a unified macroscopic QED formalism, we derive an integral equation for the van der Waals energy of a two-level atomic system near a carbon nanotube. The equation is valid for both strong and weak atom-vacuum-field coupling. By solving it numerically, we demonstrate the inapplicability of weak-coupling-based van der Waals interaction models in a close vicinity of the nanotube surface.

  14. Direct measurement of desorption and diffusion energies of O and N atoms physisorbed on amorphous surfaces

    CERN Document Server

    Minissale, Marco; Dulieu, François

    2016-01-01

    Physisorbed atoms on the surface of interstellar dust grains play a central role in solid state astrochemistry. Their surface reactivity is one source of the observed molecular complexity in space. In experimental astrophysics, the high reactivity of atoms also constitutes an obstacle to measuring two of the fundamental properties in surface physics, namely desorption and diffusion energies, and so far direct measurements are non-existent for O and N atoms. We investigated the diffusion and desorption processes of O and N atoms on cold surfaces in order to give boundary conditions to astrochemical models. Here we propose a new technique for directly measuring the N- and O-atom mass signals. Including the experimental results in a simple model allows us to almost directly derive the desorption and diffusion barriers of N atoms on amorphous solid water ice (ASW) and O atoms on ASW and oxidized graphite. We find a strong constraint on the values of desorption and thermal diffusion energy barriers. The measured b...

  15. Paul Scherrer Institut Scientific Report 2001. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Wokaun, A.; Daum, C. (eds.)

    2002-03-01

    Major advances in 'Energy and Materials Cycles' have been achieved in the removal of heavy metals from the solid residues of municipal waste incineration. It has been conclusively shown that the oxidation/reduction conditions established during the thermal treatment of filter ash have a decisive influence on the evaporation of groups of heavy metals. With respect to biomass gasification, studies have been carried out with respect to the best way of extracting pure hydrogen from the low calorific value gas that is typically obtained from a biomass gasifier. The overarching goal of the laboratory 'High Temperature Solar Technology' is the use of solar energy for the production of solar fuels, or for the reduction of CO{sub 2} emissions in large scale industrial processes that are conventionally carried out with the use of fossil fuels. In a short-term project targeted at the solar production of lime, highly encouraging results (98% degree of calcination, adjustable reactivity of the lime) have been obtained in a 10 kW prototype reactor. Hybrid processes, in which the calorific value of fossil fuels is upgraded by solar energy, represent the medium-term strategy. In this context, the successful operation of the SYNMET reactor, in which zinc oxide is reacted with methane to produce zinc and synthesis gas, represents an important milestone. The physical sciences group has come up with a novel scheme in which sulfides, rather than oxides, are used as starting materials. Copper sulfide Cu{sub 2}S has been identified as a promising raw material, from which metallic copper would be produced in a solar reduction step. For the use of a catalytic combustor upstream of the main burning chamber of the gas turbine, it is crucial to know the stream wise distance over the catalyst where homogeneous ignition is initiated. The combustion-group working at this concept has made great advances in matching the observed ignition distances with theory. In addition, the

  16. Paul Scherrer Institut Scientific Report 2001. Volume V: General Energy

    Energy Technology Data Exchange (ETDEWEB)

    Wokaun, A.; Daum, C. (eds.)

    2002-03-01

    Major advances in 'Energy and Materials Cycles' have been achieved in the removal of heavy metals from the solid residues of municipal waste incineration. It has been conclusively shown that the oxidation/reduction conditions established during the thermal treatment of filter ash have a decisive influence on the evaporation of groups of heavy metals. With respect to biomass gasification, studies have been carried out with respect to the best way of extracting pure hydrogen from the low calorific value gas that is typically obtained from a biomass gasifier. The overarching goal of the laboratory 'High Temperature Solar Technology' is the use of solar energy for the production of solar fuels, or for the reduction of CO{sub 2} emissions in large scale industrial processes that are conventionally carried out with the use of fossil fuels. In a short-term project targeted at the solar production of lime, highly encouraging results (98% degree of calcination, adjustable reactivity of the lime) have been obtained in a 10 kW prototype reactor. Hybrid processes, in which the calorific value of fossil fuels is upgraded by solar energy, represent the medium-term strategy. In this context, the successful operation of the SYNMET reactor, in which zinc oxide is reacted with methane to produce zinc and synthesis gas, represents an important milestone. The physical sciences group has come up with a novel scheme in which sulfides, rather than oxides, are used as starting materials. Copper sulfide Cu{sub 2}S has been identified as a promising raw material, from which metallic copper would be produced in a solar reduction step. For the use of a catalytic combustor upstream of the main burning chamber of the gas turbine, it is crucial to know the stream wise distance over the catalyst where homogeneous ignition is initiated. The combustion-group working at this concept has made great advances in matching the observed ignition distances with theory. In addition, the

  17. Institutional aspects of state regulation of interrelations of subjects of the electric energy market

    Directory of Open Access Journals (Sweden)

    Kuzmynchuk Nataliia V.

    2014-01-01

    Full Text Available The article identifies tendencies of development of international electric energy markets. It marks out the role of well-organised functioning of the electric energy market for maintaining the energy security of the country under complex conditions of Ukrainian economy transformation under the influence of geopolitical changes, financial, economic and social factors. It justifies important role of the state in realisation of the regulating impact through mechanisms of institutional support of production, transportation and supply of electric energy; it focuses on imperfection of the existing system of institutes of this sphere, which determine harmonicity of the electric energy buy and sell process. Based on the system analysis of the institutional foundation, which reflects principles and essence of regulation of the electric energy market and interrelations of its subjects, the article generalises problems of the modern regulatory and legal base and realisation of strategic programmes of development in the context of formation of relations between the energy market participants, which would facilitate renovation of state regulation. The article marks out key directions of solution of topical issues of institutional support of activity of electric energy market participants, the most urgent of which are problems of the tariff policy, alternative energy development, financial discipline and technical state of fixed assets of the electric energy complex. The article puts in order the system of contractual relations of subjects of the electric energy market, which allows formation of the scientifically justified approaches in the direction of improvement of the organisational structure of the energy market and introduction of measures on increase of efficiency of regulating actions by the state.

  18. German atomic energy law in the international framework. Proceedings. Deutsches Atomenergierecht im internationalen Rahmen. Tagungsbericht

    Energy Technology Data Exchange (ETDEWEB)

    Pelzer, N. (Goettingen Univ. (Germany). Inst. fuer Voelkerrecht) (ed.)

    1992-01-01

    The regional conference was devoted to the legal problems that ensue from German reunification against the background of the integration of German atomic energy law within international law. The elements of national atomic energy legislation required by international law and recent developments in international nuclear liability law were discussed from different perspectives. The particular problems of the application of the German Atomic Energy Act in the 5 new Laender (the territories of the former GDR) were presented and discussed, namely: The continued validity of old licences issued by the GDR; practical legal problems connected with the construction of nuclear power plants in the 5 new Laender; the legal issues connected with the final repository for radioactive wastes at Morsleben; and the new developments in radiation protection law following from the Unification Treaty and the new ICRP recommendations. All 14 lectures have been abstracted and indexed individually. (orig.).

  19. Calculation of the surface energy of fcc metals with modified embedded-atom method

    Institute of Scientific and Technical Information of China (English)

    Zhang Jian-Min; Ma Fei; Xu Ke-Wei

    2004-01-01

    The surface energies for 38 surfaces of fcc metals Cu, Ag, Au, Ni, Pd, Pt, Al, Pb, Rh and Ir have been calculated by using the modified embedded-atom method. The results show that, for Cu, Ag, Ni, Al, Pb and Ir, the average values of the surface energies are very close to the polycrystalline experimental data. For all fcc metals, as predicted, the close-packed (111) surface has the lowest surface energy. The surface energies for the other surfaces increase linearly with increasing angle between the surfaces (hkl) and (111). This can be used to estimate the relative values of the surface energy.

  20. Inquiries about awareness and knowledge of children and pupils on the concept related with atomic energy

    Energy Technology Data Exchange (ETDEWEB)

    Atobe, Kozo; Kobayashi, T.; Matukawa, Tokuo; Honda, Makoto; Awata, Takaaki; Fukuoka, Noboru [Naruto University of Education, Naruto, Tokushima (Japan); Okada, Moritami [Kyoto Univ., Kumatori, Osaka (Japan). Research Reactor Inst; Nakagawa, Masuo [Faculty of Education, Kagawa University, Takamatsu, Kagawa (Japan)

    2001-01-01

    There is almost no chance to learn about the words (atomic energy), (radioactivity) and (radiation) in the middle and/or high school educations in Japan, because physics is one of the options in the high school curriculum, and 80-90% of students do not like to choose physics. This inquires aim to know the level of their knowledge on energy resources, atomic energy, radioactivity, radiation, and information sources on their related knowledge. Inquiries are made for the middle and high school students in Tokushima and Tsuruga. There are coal power plants in Tokushima, while atomic power plants in Tsuruga. Fossils energy gets the highest points in Tokushima, while Atomic energy gets the highest points in Tsuruga for a present-day energy source. Solar energy sources get the highest point as a promising 21st century energy source in both prefectures, especially for female students. Radioactivity reminds them of words atomic bomb, disease, injury, and harmful, those give very negative images. Radiation reminds them of words roentgen, radiation therapy, x-ray, and hospital use, those designate a sort of plus-image. More than 50 to 60% of them obtained their knowledge from mass media, particularly, television. In addition, less than a few % of them can give any scientific description about these words. As a whole, authors can say that the students have got a certain concept for these words from information of mass media. Meanwhile the school education has approximately no effect on the formation of their concept. Authors are giving some advises and recommendations for the school education and mass media in Japan. (Y. Tanaka)

  1. Self-energy and interaction energy of stacking fault in fcc metals calculated by embedded-atom method

    Institute of Scientific and Technical Information of China (English)

    何刚; 戎咏华; 徐祖耀

    2000-01-01

    The stacking fault energies of five fcc metals (Cu, Ag, Au, Ni and Al) with various quan-tivalences have been calculated by embedded-atom method (EAM). It indicated that the stacking fault energy is mainly determined by the metallic bond-energy and the lattice constant. Thus, monovalent fcc metals should have different stacking fault energies, contrary to Attree’s conclusion. The interaction energy between stacking faults one I 111 I layer apart in a fcc metal is found to be 1/40-1/250 of its self-energy, while it becomes zero when the two stacking faults are two layers apart. The twin energy is just half of the energy of intrinsic stacking fault energy without the consideration of lattice relaxation and the energy of a single intrinsic stacking fault is almost the same as that of extrinsic stacking fault, which are consistent with the results from the calculation of Lennard-Jones force between atoms, but differ from Attree’s result.

  2. [Constant scaled-energy spectroscopy of Rydberg atoms in a static electric field].

    Science.gov (United States)

    Cao, Jun-wen; Liu, Xiao-jun; Zhao, Zhi; Zhan, Ming-sheng

    2002-02-01

    In the past years, scaled energy spectroscopy is under active investigation because this method can simplify the analysis of atomic spectra in the external field based on classic mechanics. A fully computer-controlled experimental system to study the constant scaled-energy spectroscopy was established and described in this paper. The excitation energy E and the strength of the external electric field F were controlled synchronously to keep the scaled-energy epsilon = E/square root of F constant. With this system, constant scaled-energy spectra of Strontium Rydberg atoms at epsilon = -3.0 in a static electric field were successfully recorded for the first time, and the recurrence spectra were obtained by a Fourier transform.

  3. Wavefunction and energy of the 1s22sns configuration in a beryllium atom

    Institute of Scientific and Technical Information of China (English)

    Huang Shi-Zhong; Ma Kun; Yu Jia-Ming; Liu Fen

    2008-01-01

    A new set of trial functions for 1s22sns configurations in a beryllium atom is suggested.A Mathematica program baaed on the variational method is developed to calculate the wavefunctions and energies of 1s22sns (n=3-6)configurations in a beryllium atom.Non-relativistic energy,polarization correction and relativistic correction which include mass correction,one- and two-body Darwin corrections,spin-spin contact interaction and orbit-orbit interaction,are calculated respectively.The results are in good agreement with experimental data.

  4. Mr. Ansar Shamsi, Member Finance, Mr. Malik Adalat Khan, Director Finance, Pakistan Atomic Energy Commission

    CERN Multimedia

    Patrice Loïez

    2003-01-01

    Photo 01: Mr Ansar Shamsi, Member Finance, Pakistan Atomic Energy Commission (centre), visiting the ATLAS Tile Calorimeter in building 191 with, from left to right, Mr Syed Shaukat Hussain, Pakistan Mission in Geneva and Dr Peter Jenni, ATLAS Spokesperson. Photo 02: Mr Ansar Shamsi, Member Finance, Pakistan Atomic Energy Commission (2nd form left), visiting the ATLAS Tile Calorimeter in building 191 with, from left to right, Mr Syed Shaukat Hussain, Pakistan Mission in Geneva; Dr Peter Jenni, ATLAS Spokesperson; Dr David Jacobs and Dr Philip Bryant, Joint Pakistan-CERN Committee.

  5. Progression of Technology Education for Atomic Energy Engineering in Tsuyama National College of Technology

    Science.gov (United States)

    Kato, Manabu; Kobayashi, Toshiro; Okada, Tadashi; Sato, Makoto; Sasai, Yuji; Konishi, Daijiro; Harada, Kanji; Taniguchi, Hironari; Toya, Hideaki; Inada, Tomomi; Sori, Hitoshi; Yagi, Hideyuki

    This paper describes the achievements of a program in which technology education is provided to cultivate practical core engineers for low-level radiation. It was made possible by means of (1) an introductory education program starting at an early age and a continuous agenda throughout college days and (2) regional collaboration. First, with regard to the early-age introductory education program and the continuous education agenda, the subjects of study related to atomic energy or nuclear engineering were reorganized as “Subjects related to Atomic Power Education” for all grades in all departments. These subjects were included in the syllabus and the student guide book, emphasizing a continuous and consistent policy throughout seven-year college study, including the five-year system and additional two-year advanced course. Second, to promote practical education, the contents of lectures, experiments, and internships were enriched and realigned in collaboration with the Japan Atomic Energy Agency, Okayama University and The Cyugoku Electric Power Co., Inc. In addition to the expansion and rearrangement of atomic power education, research on atomic power conducted for graduation thesis projects were undertaken to enhance the educational and research activities. In consequence, it has been estimated that there is now a total of fourteen subject areas in atomic energy technology, more than eight-hundred registered students in the department, and thirteen members of the teaching staff related to atomic energy technology. Furthermore, the “Tsuyama model” is still being developed. This program was funded by the Ministry of Education, Culture, Sports, Science and Technology.

  6. International Atomic Energy Agency intercomparison of ion beam analysis software

    Science.gov (United States)

    Barradas, N. P.; Arstila, K.; Battistig, G.; Bianconi, M.; Dytlewski, N.; Jeynes, C.; Kótai, E.; Lulli, G.; Mayer, M.; Rauhala, E.; Szilágyi, E.; Thompson, M.

    2007-09-01

    Ion beam analysis (IBA) includes a group of techniques for the determination of elemental concentration depth profiles of thin film materials. Often the final results rely on simulations, fits and calculations, made by dedicated codes written for specific techniques. Here we evaluate numerical codes dedicated to the analysis of Rutherford backscattering spectrometry, non-Rutherford elastic backscattering spectrometry, elastic recoil detection analysis and non-resonant nuclear reaction analysis data. Several software packages have been presented and made available to the community. New codes regularly appear, and old codes continue to be used and occasionally updated and expanded. However, those codes have to date not been validated, or even compared to each other. Consequently, IBA practitioners use codes whose validity, correctness and accuracy have never been validated beyond the authors' efforts. In this work, we present the results of an IBA software intercomparison exercise, where seven different packages participated. These were DEPTH, GISA, DataFurnace (NDF), RBX, RUMP, SIMNRA (all analytical codes) and MCERD (a Monte Carlo code). In a first step, a series of simulations were defined, testing different capabilities of the codes, for fixed conditions. In a second step, a set of real experimental data were analysed. The main conclusion is that the codes perform well within the limits of their design, and that the largest differences in the results obtained are due to differences in the fundamental databases used (stopping power and scattering cross section). In particular, spectra can be calculated including Rutherford cross sections with screening, energy resolution convolutions including energy straggling, and pileup effects, with agreement between the codes available at the 0.1% level. This same agreement is also available for the non-RBS techniques. This agreement is not limited to calculation of spectra from particular structures with predetermined

  7. The bungling giant : Atomic Energy Canada Limited and next-generation nuclear technology, 1980-1994

    Energy Technology Data Exchange (ETDEWEB)

    Slater, I.J

    2003-07-01

    From 1980-1994 Atomic Energy Canada Limited (AECL), the Crown Corporation responsible for the development of nuclear technology in Canada, ventured into the market for small-scale, decentralized power systems with the Slowpoke Energy System (SES), a 10MW nuclear reactor for space heating in urban and remote areas. The SES was designed to be 'passively' or 'inherently' safe, such that even the most catastrophic failure of the system would not result in a serious accident (e.g. a meltdown or an explosion). This Canadian initiative, a beneficiary of the National Energy Program, was the first and by far the most successful attempt at a passively safe, decentralized nuclear power system anywhere in the world. Part one uses archival documentation and interviews with project leaders to reconstruct the history of the SES. The standard explanations for the failure of the project, cheap oil, public resistance to the technology, and lack of commercial expertise, are rejected. Part two presents an alternative explanation for the failure of AECL to commercialize the SES. In short, technological momentum towards large-scale nuclear designs led to structural restrictions for the SES project. These restrictions manifested themselves internally to the company (e.g., marginalization of the SES) and externally to the company (e.g., licensing). In part three, the historical lessons of the SES are used to refine one of the central tenets of Popper's political philosophy, 'piecemeal social engineering.' Popper's presentation of the idea is lacking in detail; the analysis of the SES provides some empirical grounding for the concept. I argue that the institutions surrounding traditional nuclear power represent a form utopian social engineering, leading to consequences such as the suspension of civil liberties to guarantee security of the technology. The SES project was an example of a move from the utopian social engineering of large

  8. Energy, environment, and policy choices: Summer institutes for science and social studies educators

    Energy Technology Data Exchange (ETDEWEB)

    Marek, E.A.; Chiodo, J.J.; Gerber, B.L.

    1997-06-01

    The Center for Energy Education (CEE) is a partnership linking the University of Oklahoma, Close Up Foundation and Department of Energy. Based upon the theme of energy, environment and public policy, the CEE`s main purposes are to: (1) educate teachers on energy sources, environmental issues and decisionmaking choices regarding public policy; (2) develop interdisciplinary curricula that are interactive in nature (see attachments); (3) disseminate energy education curricula; (4) serve as a resource center for a wide variety of energy education materials; (5) provide a national support system for teachers in energy education; and (6) conduct research in energy education. The CEE conducted its first two-week experimentially-based program for educators during the summer of 1993. Beginning at the University of Oklahoma, 57 teachers from across the country examined concepts and issues related to energy and environment, and how the interdependence of energy and environment significantly influences daily life. During the second week of the institute, participants went to Washington, D.C. to examine the processes used by government officials to make critical decisions involving interrelationships among energy, environment and public policy. Similar institutes were conducted during the summers of 1994 and 1995 resulting in nearly 160 science and social studies educators who had participated in the CEE programs. Collectively the participants represented 36 states, the Pacific Territories, Puerto Rico, and Japan.

  9. Free energy for a damped cold atom in SU(2) non-Abelian gauge potentials

    Science.gov (United States)

    Guingarey, Issoufou; Avossevou, Gabriel Y. H.

    2017-03-01

    Our main aim in this work is to find out the exact formula of the equilibrium free energy for a cold atom subjected to a harmonic potential in the background of an artificial non-Abelian uniform magnetic field and linearly coupled to a heat bath. The heat bath consists of a collection of independent quantum harmonic oscillators, while its interaction with the cold atom is modeled in terms of bilinear coupling between the coordinate variables of the cold atom and the oscillators. The main thermodynamic properties of such a system are modified in comparison with the Abelian case. For a non-Abelian magnetic field generated from the laser methods employing degenerate dark states, we evaluate the effect of the non-Abelian dynamics on the magnetic moment of the cold atom.

  10. Computational model for noncontact atomic force microscopy: energy dissipation of cantilever.

    Science.gov (United States)

    Senda, Yasuhiro; Blomqvist, Janne; Nieminen, Risto M

    2016-09-21

    We propose a computational model for noncontact atomic force microscopy (AFM) in which the atomic force between the cantilever tip and the surface is calculated using a molecular dynamics method, and the macroscopic motion of the cantilever is modeled by an oscillating spring. The movement of atoms in the tip and surface is connected with the oscillating spring using a recently developed coupling method. In this computational model, the oscillation energy is dissipated, as observed in AFM experiments. We attribute this dissipation to the hysteresis and nonconservative properties of the interatomic force that acts between the atoms in the tip and sample surface. The dissipation rate strongly depends on the parameters used in the computational model.

  11. A simple nonbinary scattering model applicable to atomic collisions is crystals at 1ow energies

    DEFF Research Database (Denmark)

    Andersen, Hans Henrik; Sigmund, Peter

    1966-01-01

    Presents the solution of a special scattering problem which may be important in the theory of slowing-down of atomic particles in crystals. A projectile moves along the centre axis of a regular ring of n equal atoms which are free and do not interact with each other. The interaction between...... the projectile and each ring atom is described by a Born-Mayer potential, and the scattering is assumed to be elastic and governed by the classical equations of motion. Because of symmetry, the problem can be reduced to plane motion of a particle in a potential of elliptic symmetry. The elliptic force field...... the asymptotic velocities of the ring atoms as well as the energy loss of the projectile. Furthermore, it can be decided whether the projectile is reflected by the ring. Both the feasibility of assumptions specifying the problem and the validity of different approximations made in the transformation from...

  12. Probing the energy flow in Bessel light beams using atomic photoionization

    Science.gov (United States)

    Surzhykov, A.; Seipt, D.; Fritzsche, S.

    2016-09-01

    The growing interest in twisted light beams also requires a better understanding of their complex internal structure. Particular attention is currently being given to the energy circulation in these beams as usually described by the Poynting vector field. In the present study we propose to use the photoionization of alkali-metal atoms as a probe process to measure (and visualize) the energy flow in twisted light fields. Such measurements are possible since the angular distribution of photoelectrons, emitted from a small atomic target, appears sensitive to and is determined by the local direction of the Poynting vector. To illustrate the feasibility of the proposed method, detailed calculations were performed for the ionization of sodium atoms by nondiffractive Bessel beams.

  13. Hydrogen atom wave function and eigen energy in the Rindler space

    Science.gov (United States)

    Dai, De-Chang

    2016-10-01

    We study the hydrogen atom eigenstate energy and wave function in the Rindler space. The probability distribution is tilted because the electric field of the nucleus is no longer spherically symmetric. The hydrogen atom therefore cannot be treated exactly in the same way as what it is in an inertial frame. We also find that if the external force accelerates only the nucleus and then the nucleus accelerates its surrounding electrons through electromagnetic force, the electrons can tunnel through the local energy gap and split the hydrogen atom into an ion. This is similar to what one expects from the Stark effect. However, the critical acceleration is about 3 ×1022 m /s2. It is well beyond the gravitational acceleration on a regular star surface.

  14. Hydrogen atom wave function and eigen energy in the Rindler space

    CERN Document Server

    Dai, De-Chang

    2016-01-01

    We study the hydrogen atom eigenstate energy and wave function in the Rindler space. The probability distribution is tilted because the electric field of the nucleus is no longer spherically symmetric. The hydrogen atom therefore cannot be treated exactly in the same way as what it is in an inertial frame. We also find that if the external force accelerates only the nucleus and then the nucleus accelerates its surrounding electrons through electromagnetic force, the electrons can tunnel through the local energy gap and split the hydrogen atom into an ion. This is similar to what one expects from the Stark effect. However, the critical acceleration is about $3\\times 10^{22} m/s^2$. It is well beyond the gravitational acceleration on a regular star surface.

  15. Nuclear energy in the service of biomedicine: the U.S. Atomic Energy Commission's radioisotope program, 1946-1950.

    Science.gov (United States)

    Creager, Angela N H

    2006-01-01

    The widespread adoption of radioisotopes as tools in biomedical research and therapy became one of the major consequences of the "physicists' war" for postwar life science. Scientists in the Manhattan Project, as part of their efforts to advocate for civilian uses of atomic energy after the war, proposed using infrastructure from the wartime bomb project to develop a government-run radioisotope distribution program. After the Atomic Energy Bill was passed and before the Atomic Energy Commission (AEC) was formally established, the Manhattan Project began shipping isotopes from Oak Ridge. Scientists and physicians put these reactor-produced isotopes to many of the same uses that had been pioneered with cyclotron-generated radioisotopes in the 1930s and early 1940s. The majority of early AEC shipments were radioiodine and radiophosphorus, employed to evaluate thyroid function, diagnose medical disorders, and irradiate tumors. Both researchers and politicians lauded radioisotopes publicly for their potential in curing diseases, particularly cancer. However, isotopes proved less successful than anticipated in treating cancer and more successful in medical diagnostics. On the research side, reactor-generated radioisotopes equipped biologists with new tools to trace molecular transformations from metabolic pathways to ecosystems. The U.S. government's production and promotion of isotopes stimulated their consumption by scientists and physicians (both domestic and abroad), such that in the postwar period isotopes became routine elements of laboratory and clinical use. In the early postwar years, radioisotopes signified the government's commitment to harness the atom for peace, particularly through contributions to biology, medicine, and agriculture.

  16. Kinetic-energy matrix elements for atomic Hylleraas-CI wave functions.

    Science.gov (United States)

    Harris, Frank E

    2016-05-28

    Hylleraas-CI is a superposition-of-configurations method in which each configuration is constructed from a Slater-type orbital (STO) product to which is appended (linearly) at most one interelectron distance rij. Computations of the kinetic energy for atoms by this method have been difficult due to the lack of formulas expressing these matrix elements for general angular momentum in terms of overlap and potential-energy integrals. It is shown here that a strategic application of angular-momentum theory, including the use of vector spherical harmonics, enables the reduction of all atomic kinetic-energy integrals to overlap and potential-energy matrix elements. The new formulas are validated by showing that they yield correct results for a large number of integrals published by other investigators.

  17. Using Uncertainty Principle to Find the Ground-State Energy of the Helium and a Helium-like Hookean Atom

    Science.gov (United States)

    Harbola, Varun

    2011-01-01

    In this paper, we accurately estimate the ground-state energy and the atomic radius of the helium atom and a helium-like Hookean atom by employing the uncertainty principle in conjunction with the variational approach. We show that with the use of the uncertainty principle, electrons are found to be spread over a radial region, giving an electron…

  18. Local group modes and the dynamics of intramolecular energy transfer across a heavy atom

    OpenAIRE

    Lopez, Vicente; Fairen, Victor; Lederman, Steven M.; Marcus, R.A

    1986-01-01

    The dynamics of energy transfer is discussed for a model system in which two ligands are separated by a heavy atom. Numerical and analytical results are given for the case that each ligand is a CC. In the quasiperiodic regime, the dynamics are interpreted using perturbation theory. Local group modes involved in an intramolecular energy localization which can occur in this regime are identified. An approximate separation of the primarily ligand–ligand motions from the primarily ligand–metal–li...

  19. An extension of the Eisberg-Resnick treatment for electron energies in many-electron atoms

    Science.gov (United States)

    Whitaker, M. A. B.; Bennett, I.

    1989-03-01

    Eisberg and Resnick present a simple argument for the energy of an electron in a multielectron atom using the concept of shielding from electrons in inner shells. The results of such a treatment are unfortunately confined so as to be out of range of experimental values. Here, the effect of electrons in outer shells is included, and, in the nonrelativistic region, energies are obtained for electrons in the first and second shells in reasonable agreement with experiment.

  20. The regularities of the Rydberg energy levels of many-valence electron atom Al

    Institute of Scientific and Technical Information of China (English)

    郑能武; 孙育杰

    2000-01-01

    Within the scheme of the weakest bound electron potential model theory, the concept of spectral-level-like series is presented by reasonably classifying the Rydberg energy level of atom Al. Based on this concept, the regularities of the Rydberg energy levels are systematically studied. The deviations of the calculated values from the experimental values are generally about several percent of 1 cm, which is of high accuracy.

  1. Energy Levels in Helium and Neon Atoms by an Electron-Impact Method.

    Science.gov (United States)

    Taylor, N.; And Others

    1981-01-01

    Electronic energy levels in noble gas atoms may be determined with a simple teaching apparatus incorporating a resonance potentials tube in which the electron beam intensity is held constant. The resulting spectra are little inferior to those obtained by more elaborate electron-impact methods and complement optical emission spectra. (Author/SK)

  2. Saturation of Energy Levels in Analytical Atomic Fluorescence Spectrometry. II. Experimental.

    Science.gov (United States)

    1981-01-30

    RESEARCH Contract N14-76-C-0838 Task Ao. NR 051-622 TECHNICAL REPORT NO. 34 SATURATION OF ENERGY LEVELS IN ANALYTICAL ATOMIC FLUORESCENCE SPECTROMETRY II...an assumption which is valid only if the daral o’l of 111, cxcilIatio n pulse is mucl ) longer than the fluorescence life- time of the tjaii!,ition

  3. Molecular markers predicting radiotherapy response: report and recommendations from an International Atomic Energy Agency technical meeting.

    NARCIS (Netherlands)

    West, C.M.; McKay, M.J.; Holscher, T.; Baumann, M.; Stratford, I.J.; Bristow, R.G.; Iwakawa, M.; Imai, T.; Zingde, S.M.; Anscher, M.S.; Bourhis, J.; Begg, A.C.; Haustermans, K.; Bentzen, S.M.; Hendry, J.H.

    2005-01-01

    PURPOSE: There is increasing interest in radiogenomics and the characterization of molecular profiles that predict normal tissue and tumor radioresponse. A meeting in Amsterdam was organized by the International Atomic Energy Agency to discuss this topic on an international basis. METHODS AND MATERI

  4. A New Method for the Atomic Ground-State Energy in the Screened Coulomb Potential

    Institute of Scientific and Technical Information of China (English)

    YU Peng-Peng; GUO Hua

    2001-01-01

    The new method proposed recently by Friedberg,Lee and Zhao is applied to the derivation of the atomic ground-state energy with the inclusion of the screening effect.The present results are compared with those obtained in the pure Coulomb potential and by the variational approach.The overall good results are obtained with this new method.``

  5. Financing the Civic Energy Sector:How financial institutions affect ownership models in Germany and the United Kingdom

    OpenAIRE

    Hall, Stephen; Foxon, Timothy J.; Bolton, Ronan

    2016-01-01

    This paper examines the relations between financinginstitutions and more local ownership structures for energy provision.This research defines municipal and civil society structures involved inenergy provision as the 'Civic Energy Sector'. It argues that thefinancial institutions of nations are key enabling institutions for thissector to contribute to a low carbon energy transition. The path ofdevelopment of these financial institutions helps to shape the ownershipstructures and technology ch...

  6. BP Group and CAS institute to co-establish an energy lab in Dalian

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    @@ The CAS Dalian Institute of Chemical Physics (DICP) and BP Group will join efforts to set up an Energy Innovation Laboratory (BP-DICP EIL) at DICP. The agreement for the new initiative was signed by DICP Director ZHANG Tao and BP Group Vice President Tony Meggs on 5 December, 2007 in Dalian.

  7. Zecotk receives MAPD solid-state photo detector order from Institute of high energy physics research

    CERN Multimedia

    2007-01-01

    "Zecotek Photonics Inc. (TSX VENTURE:ZMS)(FRANKFURT;W11), formerly Zecotek Medical Systemps Inc., today announced that it has received an order for a supply if its proprietary Micro-pixel Avalanche Photo Diodes (MAPD) solid-state photo detectors from the Institute of High Energy Physics Research (INR). (1 page)

  8. Zecotek receives MAPD solid-state photo detector order from Institute of High Energy Physics Research

    CERN Multimedia

    2007-01-01

    "Zecotk Photonics Inc., (TSX VENTURE: ZMS)(FRANKFURT:W11), formerly Zecotek Medical Systems Int., today announced that it has received an order for a supply of its proprietary Micro-pixel Avalanche Photo Diodes (MAPD) solid-state photo detectors from the Institute of High Energy Physics Research (INR). (2/3 page)

  9. Zecotk receives MPD solid-state photo detector order from Institute of high energy physics research

    CERN Multimedia

    2007-01-01

    "Zecotk Photonics Inc., (TSX VENTURE: ZMS)(FRANKFURT:W11), formerly Zecotek Medical Systems Int., today announced that it has received an order for a supply of its proprietary Micro-pixel Avalanche Photo Diodes (MAPD) solid-state photo detectors from the Institute of High Energy Physics Research (INR). (2/3 page)

  10. National Institute for Petroleum and Energy Research monthly progress report for December 1990

    Energy Technology Data Exchange (ETDEWEB)

    1991-01-22

    Research programs from the National Institute for Petroleum and Energy Research (NIPER) are briefly described. Topics include enhanced recovery, studies on reservoir rock, microbial EOR, development of analytical techniques for petroleum analysis, and imaging techniques applied to fluids study in porous media. (CBS)

  11. Discrete Energies of a Weakly Outcoupled Atom Laser Beam Outside the Bose–Einstein Condensate Region

    Directory of Open Access Journals (Sweden)

    Teguh Budi Prayitno

    2014-12-01

    Full Text Available We consider the possibility of a discrete set of energies of a weakly outcoupled atom laser beam to the homogeneous Schrödinger equation with anisotropic harmonic trap in Cartesian coordinates outside the Bose–Einstein condensate region. This treatment is used because working in the cylindrical coordinates is not really possible, even though we implement the cigar-shaped trap case. The Schrödinger equation appears to replace a set of two-coupled Gross– Pitaevskii equations by enabling the weak-coupling assumption. This atom laser can be produced in a simple way that only involves extracting the atoms in a condensate from by using the radio frequency field. We initially present the relation between condensates as sources and atom laser as an output by exploring the previous work of Riou et al. in the case of theoretical work for the propagation of atom laser beams. We also show that even though the discrete energies are obtained by means of an approaching harmonic oscillator, degeneracy is only available in two states because of the anisotropic external potential

  12. DEVELOPMENT OF ATOM-ECONOMICAL CATALYTIC PATHWAYS FOR CONVERSIONS OF SYNGAS TO ENERGY LIQUIDS

    Energy Technology Data Exchange (ETDEWEB)

    MAHAJAN,D.; WEGRZYN,J.E.; LEE,T.; GUREVICH,M.

    1999-03-01

    The subject of catalytic syngas conversions to fuels and chemicals is well studied (1--3). But globally, the recent focus is on development of technologies that offer an economical route to desired products (4). Economical transport of natural gas from remote locations and within clathrate hydrates is of continuing interest at Brookhaven National Laboratory (BNL). Under this project, a Liquid Phase Low Temperature (LPLT) concept is being applied to attain highly efficient transformations of natural-gas derived syngas to specific products. Furthermore, a more precise term ``Atom Economy'' has been recently introduced by Trost to describe development of highly efficient homogeneously catalyzed synthesis of organic molecules (5). Taken from reference 5, the term ``Atom Economy'' is defined as maximizing the number of atoms of all raw materials that end up in the product with any other reactant required on in catalytic amount. For application to methane transformations that may involve one or more steps, atom economy of each of these steps is critical. The authors, therefore, consider atom-economy synonymous with overall energy efficiency of a process. This paper describes potential liquid products from catalytic syngas conversions, i.e. gas to liquids (GTL) technologies and process considerations that are necessary for economical transport of natural gas. As such, the present study defines an atom-economical standard to directly compare competing GTL technologies.

  13. Effect of external energy on atomic, crystalline and powder characteristics of antimony and bismuth powders

    Indian Academy of Sciences (India)

    Vikram V Dabhade; Rama Mohan R Tallapragada; Mahendra Kumar Trivedi

    2009-10-01

    Next to atoms and molecules the powders are the smallest state of matter available in high purities and large quantities. The effect of any external energy on the shape, morphology and structure can thus be studied with relative ease. The present investigation deals with the effect of a non-contact external energy on the powders of antimony and bismuth. The characteristics of powders treated by external energy are compared with the as received powders (control). The average particle sizes, 50 and 99, the sizes below which 99% of the particles are present showed significant increase and decrease indicating that the energy had caused deformation and fracture as if the powders have been subjected to high energy milling. To be able to understand the reasons for these changes the powders are characterized by techniques such as X-ray diffraction (XRD), surface area determination (BET), thermal analytical techniques such as DTA–DTG, DSC–TGA and SDTA and scanning electron microscopy (SEM). The treated powder samples exhibited remarkable changes in the powder characteristics at all structural levels starting from polycrystalline particles, through single crystal to atoms. The external energy had changed the lattice parameters of the unit cell which in turn changed the crystallite size and density. The lattice parameters are then used to compute the weight and effective nuclear charge of the atom which showed significant variation. It is speculated that the external energy is acting on the nucleus through some reversible weak interaction of larger cross section causing changes in the proton to neutron ratios. Thus the effect is felt by all the atoms, and hence the unit cell, single crystal grain and grain boundaries. The stresses generated in turn may have caused deformation or fracture of the weak interfaces such as the crystallite and grain boundaries.

  14. Physics and Its Multiple Roles in the International Atomic Energy Agency

    Science.gov (United States)

    Massey, Charles D.

    2017-01-01

    The IAEA is the world's centre for cooperation in the nuclear field. It was set up as the world's ``Atoms for Peace'' organization in 1957 within the United Nations family. The Agency works with its Member States and multiple partners worldwide to promote the safe, secure and peaceful use of nuclear technologies. Three main areas of work underpin the IAEA's mission: Safety and Security, Science and Technology, and Safeguards and Verification. To carry out its mission, the Agency is authorized to encourage and assist research on, and development and practical application of, atomic energy for peaceful uses throughout the world; foster the exchange of scientific and technical information on peaceful uses of atomic energy; and encourage the exchange of training of scientists and experts in the field of peaceful uses of atomic energy. Nowadays, nuclear physics and nuclear technology are applied in a great variety of social areas, such as power production, medical diagnosis and therapies, environmental protection, security control, material tests, food processing, waste treatments, agriculture and artifacts analysis. This presentation will cover the role and practical application of physics at the IAEA, and, in particular, focus on the role physics has, and will play, in nuclear security.

  15. The role of thermal energy accommodation and atomic recombination probabilities in low pressure oxygen plasmas

    Science.gov (United States)

    Gibson, Andrew Robert; Foucher, Mickaël; Marinov, Daniil; Chabert, Pascal; Gans, Timo; Kushner, Mark J.; Booth, Jean-Paul

    2017-02-01

    Surface interaction probabilities are critical parameters that determine the behaviour of low pressure plasmas and so are crucial input parameters for plasma simulations that play a key role in determining their accuracy. However, these parameters are difficult to estimate without in situ measurements. In this work, the role of two prominent surface interaction probabilities, the atomic oxygen recombination coefficient γ O and the thermal energy accommodation coefficient α E in determining the plasma properties of low pressure inductively coupled oxygen plasmas are investigated using two-dimensional fluid-kinetic simulations. These plasmas are the type used for semiconductor processing. It was found that α E plays a crucial role in determining the neutral gas temperature and neutral gas density. Through this dependency, the value of α E also determines a range of other plasma properties such as the atomic oxygen density, the plasma potential, the electron temperature, and ion bombardment energy and neutral-to-ion flux ratio at the wafer holder. The main role of γ O is in determining the atomic oxygen density and flux to the wafer holder along with the neutral-to-ion flux ratio. It was found that the plasma properties are most sensitive to each coefficient when the value of the coefficient is small causing the losses of atomic oxygen and thermal energy to be surface interaction limited rather than transport limited.

  16. Circular dichroism in free-free transitions of high energy electron-atom scattering

    CERN Document Server

    Cionga, Aurelia; Zloh, Gabriela; 10.1103/PhysRevA.62.063406

    2013-01-01

    We consider high energy electron scattering by hydrogen atoms in the presence of a laser field of moderate power and higher frequencies. If the field is a superposition of a linearly and a circularly polarized laser beam in a particular configuration, then we can show that circular dichroism in two photon transitions can be observed not only for the differential but also for the integrated cross sections, provided the laser-dressing of the atomic target is treated in second order perturbation theory and the coupling between hydrogenic bound and continuum states is involved.

  17. Construction of the energy matrix for complex atoms. Part VI: Core polarization effects

    Science.gov (United States)

    Elantkowska, Magdalena; Ruczkowski, Jarosław; Dembczyński, Jerzy

    2016-12-01

    The continuation of series of papers concerning the construction of the energy matrix for complex atoms is presented. The second-order perturbation theory contributions originating from core polarization effects in the hyperfine structure are considered. Fifteen new formulae for angular coefficients of core polarization parameters are given. The complete set of corrections up to the second-order perturbation theory was taken into account and the accuracy of the wave functions in the intermediate coupling scheme, on the example of the lanthanum atom, was checked.

  18. Effective atomic numbers, electron densities and kinetic energy released in matter of vitamins for photon interaction

    Science.gov (United States)

    Shantappa, A.; Hanagodimath, S. M.

    2014-01-01

    Effective atomic numbers, electron densities of some vitamins (Retinol, Riboflavin, Niacin, Biotin, Folic acid, Cobalamin, Phylloquinone and Flavonoids) composed of C, H, O, N, Co, P and S have been calculated for total and partial photon interactions by the direct method for energy range 1 keV-100 GeV by using WinXCOM and kinetic energy released in matter (Kerma) relative to air is calculated in energy range of 1 keV-20 MeV. Change in effective atomic number and electron density with energy is calculated for all photon interactions. Variation of photon mass attenuation coefficients with energy are shown graphically only for total photon interaction. It is observed that change in mass attenuation coefficient with composition of different chemicals is very large below 100 keV and moderate between 100 keV and 10 MeV and negligible above 10 MeV. Behaviour of vitamins is almost indistinguishable except biotin and cobalamin because of large range of atomic numbers from 1(H) to 16 (S) and 1(H) to 27(Co) respectively. K a value shows a peak due to the photoelectric effect around K-absorption edge of high- Z constituent of compound for biotin and cobalamin.

  19. Quasiclassical approach to high-energy QED processes in strong laser and atomic fields

    CERN Document Server

    Di Piazza, A

    2012-01-01

    An approach, based on the use of the quasiclassical Green's function, is developed for investigating high-energy quantum electrodynamical processes in combined strong laser and atomic fields. Employing an operator technique, we derive the Green's function of the Dirac equation in an arbitrary plane wave and a localized potential. Then, we calculate the total cross section of high-energy electron-positron photoproduction in an atomic field of arbitrary charge number (Bethe-Heitler process) in the presence of a strong laser field. It is shown that the laser field substantially modifies the cross section at already available incoming photon energies and laser parameters. This makes it feasible to observe the analogous effect in a laser field of the Landau-Pomeranchuk-Migdal effect for the Bethe-Heitler process.

  20. The nuclear energy, public opinion and the awareness of work of nuclear institutions

    Energy Technology Data Exchange (ETDEWEB)

    Pastura, Valeria; Mol, Antonio Carlos de A.; Legey, Ana Paula; Lapa, Celso Marcelo F., E-mail: vpastura@ien.gov.br, E-mail: mol@ien.gov.br, E-mail: analegey@hotmail.com, E-mail: lapa@ien.gov.br [Instituto de Engenharia Nuclear (IEN/CNEN-RJ), Rio de Janeiro, RJ (Brazil). Programa de Pos-graduacao em Ciencia e Tecnologia Nucleares

    2015-07-01

    With Brazil facing a prospect of expanding its nuclear-energy sources and the development of new nuclear techniques there is a need for imminent integration in the nuclear industry with the tool information. In this paper we propose the creation of a program aimed at the servers of the institutions that make up the Brazilian Nuclear Sector, with a view to preparing these to become multipliers in the dissemination of activities developed by the institution so that they can, with strong arguments, defending the work of industry criticism of this form of energy. The goal is to create an important process of change of mentality and attitude among people who relate to the servers in the industry, expanding the debate on the subject, so that society, clearly and free of prejudices can understand the benefits the use of nuclear energy. (author)

  1. Kyiv institutional buildings sector energy efficiency program: Lending and implementation assessment

    Energy Technology Data Exchange (ETDEWEB)

    Secrest, T.J.; Freeman, S.L. [Pacific Northwest National Lab., Richland, WA (United States); Popelka, A. [Tysak Engineering, Acton, MA (United States); Shestopal, P.A.; Gagurin, E.V. [Agency for Rational Energy Use and Ecology, Kyiv (Ukraine)

    1997-08-01

    The government of Ukraine, through the State Committee of Energy Conservation (State Committee), is considering the implementation of energy efficiency measures in state and municipal institutional buildings in the city of Kyiv. The State Committee entered into a Memorandum of Cooperation with the US Department of Energy (DOE) to conduct an assessment of the institutional buildings sector efficiency potential. This assessment will be used to support a potential loan by the World Bank for implementing a buildings efficiency improvement program in Kyiv. This report provides an assessment of the options for structuring the lending scenarios and the implementation of the program. Components to the lending structure are options for the disbursement of funds, options for the loan service, and other financial options and considerations. Program implementation includes management structures, reporting, installation activities, and post-installation activities such as training and verification.

  2. Institutional applications of solar total-energy systems. Draft final report. Volume 2. Appendixes

    Energy Technology Data Exchange (ETDEWEB)

    None

    1978-07-01

    The appendices present the analytical basis for the analysis of solar total energy (STE) systems. A regional-climate model and a building-load requirements model are developed, along with fuel-price scenarios. Life-cycle costs are compared for conventional-utility, total energy, and STE systems. Thermal STE system design trade-offs are performed and thermal STE system performance is determined. The sensitivity of STE competitiveness to fuel prices is examined. The selection of the photovoltaic array is briefly discussed. The institutional-sector decision processes are analyzed. Hypothetical regional back-up rates and electrical-energy costs are calculated. The algorithms and equations used in operating the market model are given, and a general methodology is developed for projecting the size of the market for STE systems and applied to each of 8 institutional subsectors. (LEW)

  3. Investigation of energy thresholds of atomic and cluster sputtering of some elements under ion bombardment

    CERN Document Server

    Atabaev, B G; Lifanova, L F

    2002-01-01

    Threshold energies of sputtering of negative cluster ions from the Si(111) surface were measured at bombardment by Cs sup + , Rb sup + , and Na sup + ions with energy of 0.1-3.0 keV. These results are compared with the calculations of the similar thresholds by Bohdansky etc. formulas (3) for clusters Si sub n sup - and Cu sub n sup - with n=(1-5) and also for B, C, Al, Si, Fe, Cu atoms. Threshold energies of sputtering for the above elements were also estimated using the data from (5). Satisfactory agreement between the experimental and theoretical results was obtained. (author)

  4. Completion of Green Building by Korea Institute of Energy Research - Energy{center_dot}Conservation{center_dot}Environmental Technology

    Energy Technology Data Exchange (ETDEWEB)

    Park, Sang Dong [Korea Institute of Energy Research, Taejon (Korea)

    2001-04-01

    Korea Institute of Energy Research (KIER), which was fully aware that the effective utilization of energy could not only save energy but also reduce the environmental pollution due to a combustion exhaust gas, has built and operated 'the Ultra Energy Saving Building' whose energy consumption was only a fifth of general buildings as a example. KIER has started to research the project for the technology development and spread of Green Building in 'Enertech 21' - the most important research program of 1994 year - and has constructed the central building of the Institute with only the current available technology since the early of 1997 year, via researches by a step. Finally, KIER held the ceremony for the completion of Green Building in March sixth. This building is not just the first green building in Korea but also the representative building of energy environment research center, which will be marked out for a model for the domestic construction and construction industry in future. Therefore, this building has functions of exhibition, publicity, education, and experimentation for the building researchers as well as the office and researching place that is original function of this building. 4 figs., 5 tabs.

  5. Japan Returns to Atom. Current Status and Prospects of the Japanese Nuclear Energy

    Directory of Open Access Journals (Sweden)

    Łukasz Tolak

    2015-12-01

    Full Text Available In a year and a half after the events of March 2011, Japan excluded all their nuclear reactors, returning to fossil fuels as a basis in the energy field. The shock associated with nuclear disaster seemed to indicate an ultimate end of Japanese adventure with the atom. The situation has, however, significantly changed during the last several months, and the first nuclear reactor connected again to the electric network, is a proof of the change of the energy policy. The article aims to identify the current state of knowledge on the future of nuclear energy in the Japanese energy sector and adjustments proposed in the future energy mix. At the same time, it is an attempt to analyze the reasons that led the current Government of Prime Minister Abe to take very unpopular decisions to return to nuclear energy.

  6. Fiscal year 1990 program report: Water and Energy Research Institute, University of Guam

    Energy Technology Data Exchange (ETDEWEB)

    Khosrowpanah, S.

    1991-07-01

    The report summarizes the accomplishments of the University of Guam, Water and Energy Research Institute of the Western Pacific, during the Fiscal Year 1990 Water Research Institute Program Grant from the U.S. Geological Survey. These projects listed are: The Determination of Trace Metals in Biotic and Abiotic Components of the Major Rivers of Guam; Pollution Indicator and Pathogenic Bacteria in Guam's Coastal Sediments; The Occurrence of Radon in Ground and Drinking Water in Guam; and Forecasting Water Demand on Guam: 1991 to 1995.

  7. The study of multi-institutional collaborations in high-energy physics

    Energy Technology Data Exchange (ETDEWEB)

    Warnow-Blewett, Joan

    1991-01-01

    Since World War II, the organizational framework for scientific research is increasingly the multi-institutional collaboration, especially in high-energy physics. A broad preliminary survey, into the functioning of research collaborations involving three or more institutions is described. The study is designed to identify patterns of collaborations, define the scope of the documentation problems, field-test possible solutions, recommend future actions, and build an archives of oral history interviews and other resources for scholarly use. Once the study is completed, its findings will be used to promote systems to document significant collaborative research.

  8. Optical meta-atom for localization of light with quantized energy

    CERN Document Server

    Lannebère, Sylvain

    2015-01-01

    The capacity to confine light into a small region of space is of paramount importance in many areas of modern science. Here, we suggest a mechanism to store a quantized "bit" of light - with a very precise amount of energy - in an open core-shell plasmonic structure ("meta-atom") with a nonlinear optical response. Notwithstanding the trapped light state is embedded in the radiation continuum, its lifetime is not limited by the radiation loss. Interestingly, it is shown that the interplay between the nonlinear response and volume plasmons enables breaking fundamental reciprocity restrictions, and coupling very efficiently an external light source to the meta-atom. The collision of an incident optical pulse with the meta-atom may be used to release the trapped radiation "bit".

  9. Dynamics of Finite Energy Airy Beams Carrying Orbital Angular Momentum in Multilevel Atomic Vapors

    Science.gov (United States)

    Wu, Zhenkun; Wang, Shun; Hu, Weifei; Gu, Yuzong

    2016-10-01

    We numerically investigate the dynamics of inward circular finite-energy Airy beams carrying different orbital angular momentum (OAM) numbers in a close-Λ three-level atomic vapor with the electromagnetically induced transparency (EIT) window. We report that due to the EIT induced by the microwave field, the transverse intensity distribution properties of Airy beam can be feasibly manipulated and modulated through adjusting OAM numbers l and the frequency detuning, as well as the propagation distance, in the multi-level atomic systems. What's more, the rotation of the beam also can be observed with different positions in atomic ensembles. The investigation may provide a useful tool for studying particle manipulation, signal processing and propagation in graded-index (GRIN) fibers.

  10. Visualizing the large-$Z$ scaling of the kinetic energy density of atoms

    CERN Document Server

    Cancio, Antonio C

    2016-01-01

    The scaling of neutral atoms to large $Z$, combining periodicity with a gradual trend to homogeneity, is a fundamental probe of density functional theory, one that has driven recent advances in understanding both the kinetic and exchange-correlation energies. Although research focus is normally upon the scaling of energies, insights can also be gained from energy densities. We visualize the scaling of the positive-definite kinetic energy density (KED) in closed-shell atoms, in comparison to invariant quantities based upon the gradient and Laplacian of the density. We notice a striking fit of the KED within the core of any atom to a gradient expansion using both the gradient and the Laplacian, appearing as an asymptotic limit around which the KED oscillates. The gradient expansion is qualitatively different from that derived from first principles for a slowly-varying electron gas and is correlated with a nonzero Pauli contribution to the KED near the nucleus. We propose and explore orbital-free meta-GGA models...

  11. Climate policy studies by the Fridtjof Nansen Institute, ECON and Energy Data:10 Abstracts

    Energy Technology Data Exchange (ETDEWEB)

    Andresen, S.; Eikeland, P.O.; Eleri, E.O.; Fermann, G.; Fredriksen, O.; Halseth, A.; Hansen, S.; Haugland, T.; Malnes, R.; Skjaerseth, J.B.; Ottosen, R

    1993-07-01

    The overall focus is the relation between energy, environment and development on the national level and international co-operation concerning sustainable energy management and global environmental change. A series of country studies analyses the economic, political and institutional factors influencing energy, environment and climate policies. The role of non-state actors like NGOs and the energy industries in international environmental affairs is also closely examined. Strategies to enhance energy efficiency are studied with a particular focus on identifying and overcoming barriers to policy implementation. The ways in which developments in international energy markets affect the potential and scope of international environmental agreements are analysed, as are the impacts of different international environmental regimes on energy markets. Particular attention is paid on the opportunities and limitations of international institutions like the European Community, the United Nations, the multilateral development banks and GATT, in promoting international co-operation on energy and environmental issues. Strategies to overcome North/South conflicts over global environmental issues are examined, including issue linkages in international negotiations and North/South transfer of resources and technology. Another important area of sustainable production and consumption of energy in developing countries. Project titles are: 1) ''Leader'' and ''entrepreneur'' in international negotiations . A conceptual analysis. 2) Choosing climate policy. Decision theoretical premises. 3) Japan in the greenhouse responsibilities, policies and prospects for combating global warming. 4) Impacts on developing economies from changing trade regimes and growing international environmental concerns. 5) US energy policy in the greenhouse from the North slope forests to the Gulf Stream waters - this land was made for fossil fuels. 6) The climate policy of

  12. Spatial assignment of symmetry adapted perturbation theory interaction energy components: The atomic SAPT partition.

    Science.gov (United States)

    Parrish, Robert M; Sherrill, C David

    2014-07-28

    We develop a physically-motivated assignment of symmetry adapted perturbation theory for intermolecular interactions (SAPT) into atom-pairwise contributions (the A-SAPT partition). The basic precept of A-SAPT is that the many-body interaction energy components are computed normally under the formalism of SAPT, following which a spatially-localized two-body quasiparticle interaction is extracted from the many-body interaction terms. For electrostatics and induction source terms, the relevant quasiparticles are atoms, which are obtained in this work through the iterative stockholder analysis (ISA) procedure. For the exchange, induction response, and dispersion terms, the relevant quasiparticles are local occupied orbitals, which are obtained in this work through the Pipek-Mezey procedure. The local orbital atomic charges obtained from ISA additionally allow the terms involving local orbitals to be assigned in an atom-pairwise manner. Further summation over the atoms of one or the other monomer allows for a chemically intuitive visualization of the contribution of each atom and interaction component to the overall noncovalent interaction strength. Herein, we present the intuitive development and mathematical form for A-SAPT applied in the SAPT0 approximation (the A-SAPT0 partition). We also provide an efficient series of algorithms for the computation of the A-SAPT0 partition with essentially the same computational cost as the corresponding SAPT0 decomposition. We probe the sensitivity of the A-SAPT0 partition to the ISA grid and convergence parameter, orbital localization metric, and induction coupling treatment, and recommend a set of practical choices which closes the definition of the A-SAPT0 partition. We demonstrate the utility and computational tractability of the A-SAPT0 partition in the context of side-on cation-π interactions and the intercalation of DNA by proflavine. A-SAPT0 clearly shows the key processes in these complicated noncovalent interactions, in

  13. Reducing Energy Waste in Post-secondary Educational Institutions using Artificial Intelligence

    Science.gov (United States)

    Motta Cabrera, David Francisco

    This thesis focuses on computer-related and lighting energy consumption in post-secondary educational institutions. In this respect, artificial intelligence and data association mining are proposed as tools to identify and reduce energy waste. First, an artificial intelligence-based method for forecasting computer usage is proposed. Based on the models' forecast, workstations can be turned on and off, in order to strike a balance between energy savings and user comfort. The models are evaluated on different datasets and their results compared to commercially available alternatives. Second, a data association mining-based approach is proposed to uncover possible relationships between occupancy patterns and lighting-related energy waste in classrooms. A wireless data collection system is used to log data from both lighting consumption and occupancy states during a year. Next, energy savings results of using the proposed approach are compared to those of an occupancy-activated lighting control system for classrooms.

  14. Calculations of Self-diffusion Activation Energies for Alkaline Metals With Embedded Atom Method

    Institute of Scientific and Technical Information of China (English)

    欧阳义芳; 张邦维; 廖树帜

    1994-01-01

    Calculations were performed for the self-diffusion activation energies of monovacancy and both formation and binding energies of divacancies for alkaline metals Li, Na, K, Rb, Cs using the embedded atom method (EAM) model for bcc transition metals developed by the authors recently. The aim of the paper is to extend the application of the new model, to compare the calculated values for self-diffusion with the experimental data and those of previous calculations, and to discuss the intrinsic characteristic of self-diffusion in alkaline metals. The calculated monovacancy migration energies and activation energies are in excellent agreement with experimental data, and the calculated divacancy migration and activation energies are in good agreement with the experimental values available.

  15. 75 FR 65249 - Anthony R. Pietrangelo on Behalf of the Nuclear Energy Institute; Receipt of Petition for Rulemaking

    Science.gov (United States)

    2010-10-22

    ...; ] NUCLEAR REGULATORY COMMISSION 10 CFR Part 26 Anthony R. Pietrangelo on Behalf of the Nuclear Energy Institute; Receipt of Petition for Rulemaking AGENCY: Nuclear Regulatory Commission. ACTION: Petition for... the NRC by Anthony R. Pietrangelo on behalf of the Nuclear Energy Institute (NEI). The petition...

  16. Development of the work on fuel cells in the Ministry for Atomic Energy of Russian Federation

    Energy Technology Data Exchange (ETDEWEB)

    Lubovin, B.Y.; Novitski, E.Z.

    1996-04-01

    This paper describes research on fuel cells in the Russian Federation. The beginning of the practical work on fuel cells in Russia dates back to the 50`s and 60`s when the Ural Electrochemical Plant and the Ural Electromechanical Plant of the Ministry of Medium Machine-Building of the USSR, all Russian Research Institute of the power sources and many other institutes of the Ministry of Electrotechnical Industry of the USSR got to the development of the alkaline fuel cells for the spaceships according to the tasks of the SPC `Energy` and for the submarines on the tasks of the Ministry of Defense.

  17. Electronic torsional sound in linear atomic chains: chemical energy transport at 1000 km/s

    CERN Document Server

    Kurnosov, Arkady A; Maksymov, Andrii A; Burin, Alexander L

    2016-01-01

    We investigate entirely electronic torsional vibrational modes in linear cumulene chains. The carbon nuclei of a cumulene are positioned along the primary axis so they can participate only in transverse and longitudinal motions. However, the interatomic electronic clouds behave as a torsion spring with remarkable torsional stiffness. The collective dynamics of these clouds can be described in terms of electronic vibrational quanta, which we name torsitons. It is shown that the group velocity of the wavepacket of torsitons is much higher than the typical speed of sound, because of the small mass of participating electrons compared to the atomic mass. For the same reason the maximum energy of the torsitons in cumulenes is as high as a few electronvolts, while the minimum possible energy is evaluated as a few hundred wavenumbers and this minimum is associated with asymmetry of zero point atomic vibrations. Molecular systems for experimental evaluation of the predictions are proposed.

  18. Atomic Energy Act (AtG) and subordinate legislation. Collections. 33. ed.; Atomgesetz mit Verordnungen. Textsammlung

    Energy Technology Data Exchange (ETDEWEB)

    Ziegler, Eberhard (ed.)

    2014-07-01

    The 33rd edition of the present statute book contains the Site Selection Law (StandAG) of 25 July 2013, which specifies the procedure for selecting sites for final disposal of high-level radioactive wastes, and the Law on the Establishment of a Federal Office for Disposal of Radioactive Wastes, promulgated as Art. 3 of the Site Selection Law. Some regulations of the StandAG already took effect on 27 July 2013, while others are to be enacted on 1 January 2014 along with amendments to the Atomic Energy Law, the Schedule of Costs to the Atomic Energy Law and the Law on Environmental Impact Assessments that result from the StandAG. The new edition also includes legislative amendments that were passed after the publication of the previous edition, namely those to the Food Irradiation Ordinance, the Law on the Establishment of the Federal Radiation Protection Office and to relevant regulations of the Criminal Code.

  19. Formation of nanostructures on HOPG surface in presence of surfactant atom during low energy ion irradiation

    Energy Technology Data Exchange (ETDEWEB)

    Ranjan, M., E-mail: ranjanm@ipr.res.in; Joshi, P.; Mukherjee, S.

    2016-07-15

    Low energy ions beam often develop periodic patterns on surfaces under normal or off-normal incidence. Formation of such periodic patterns depends on the substrate material, the ion beam parameters, and the processing conditions. Processing conditions introduce unwanted contaminant atoms, which also play strong role in pattern formation by changing the effective sputtering yield of the material. In this work we have analysed the effect of Cu, Fe and Al impurities introduced during low energy Ar{sup +} ion irradiation on HOPG substrate. It is observed that by changing the species of foreign atoms the surface topography changes drastically. The observed surface topography is co-related with the modified sputtering yield of HOPG. Presence of Cu and Fe amplify the effective sputtering yield of HOPG, so that the required threshold for the pattern formation is achieved with the given fluence, whereas Al does not lead to any significant change in the effective yield and hence no pattern formation occurs.

  20. Protein structure prediction by all-atom free-energy refinement

    Directory of Open Access Journals (Sweden)

    Wenzel Wolfgang

    2007-03-01

    Full Text Available Abstract Background The reliable prediction of protein tertiary structure from the amino acid sequence remains challenging even for small proteins. We have developed an all-atom free-energy protein forcefield (PFF01 that we could use to fold several small proteins from completely extended conformations. Because the computational cost of de-novo folding studies rises steeply with system size, this approach is unsuitable for structure prediction purposes. We therefore investigate here a low-cost free-energy relaxation protocol for protein structure prediction that combines heuristic methods for model generation with all-atom free-energy relaxation in PFF01. Results We use PFF01 to rank and cluster the conformations for 32 proteins generated by ROSETTA. For 22/10 high-quality/low quality decoy sets we select near-native conformations with an average Cα root mean square deviation of 3.03 Å/6.04 Å. The protocol incorporates an inherent reliability indicator that succeeds for 78% of the decoy sets. In over 90% of these cases near-native conformations are selected from the decoy set. This success rate is rationalized by the quality of the decoys and the selectivity of the PFF01 forcefield, which ranks near-native conformations an average 3.06 standard deviations below that of the relaxed decoys (Z-score. Conclusion All-atom free-energy relaxation with PFF01 emerges as a powerful low-cost approach toward generic de-novo protein structure prediction. The approach can be applied to large all-atom decoy sets of any origin and requires no preexisting structural information to identify the native conformation. The study provides evidence that a large class of proteins may be foldable by PFF01.

  1. NATO Advanced Research Institute on the Application of Systems Science to Energy Policy Planning

    CERN Document Server

    Cherniavsky, E; Laughton, M; Ruff, L

    1981-01-01

    The Advanced Research Institute (ARI) on "The Application of Systems Science to Energy Policy Planning" was held under the auspices of the NATO Special Programme Panel on Systems Science in collaboration with the National Center for Analysis of Energy Sys­ tems, Brookhaven National Laboratory, USA, as a part of the NATO Science Committee's continuous effort to promote the advancement of science through international cooperation. Advanced Research Institutes are sponsored by the NATO Science Committee for the purposes of bringing together senior scientists to seek consensus on an assessment of the present state of knowl­ edge on a specific topic and to make recommendations for future research directions. Meetings are structured to encourage inten­ sive group discussion. Invitees are carefully selected so that the group as a whole will contain the experience and expertise neces­ sary to make the conclusions valid and significant. A final report is published presenting the various viewpoints and conclusions....

  2. Precision X-ray spectroscopy of kaonic atoms as a probe of low-energy kaon-nucleus interaction

    CERN Document Server

    Shi, H; Beer, G; Bellotti, G; Berucci, C; Bragadireanu, A M; Bosnar, D; Cargnelli, M; Curceanu, C; Butt, A D; d'Uffizi, A; Fiorini, C; Ghio, F; Guaraldo, C; Hayano, R S; Iliescu, M; Ishiwatari, T; Iwasaki, M; Sandri, P Levi; Marton, J; Okada, S; Pietreanu, D; Piscicchia, K; Vidal, A Romero; Sbardella, E; Scordo, A; Sirghi, D L; Sirghi, F; Tatsuno, H; Doce, O Vazquez; Widmann, E; Zmeskal, J

    2016-01-01

    In the exotic atoms where one atomic $1s$ electron is replaced by a $K^{-}$, the strong interaction between the $K^{-}$ and the nucleus introduces an energy shift and broadening of the low-lying kaonic atomic levels which are determined by only the electromagnetic interaction. By performing X-ray spectroscopy for Z=1,2 kaonic atoms, the SIDDHARTA experiment determined with high precision the shift and width for the $1s$ state of $K^{-}p$ and the $2p$ state of kaonic helium-3 and kaonic helium-4. These results provided unique information of the kaon-nucleus interaction in the low energy limit.

  3. Atomically thick bismuth selenide freestanding single layers achieving enhanced thermoelectric energy harvesting.

    Science.gov (United States)

    Sun, Yongfu; Cheng, Hao; Gao, Shan; Liu, Qinghua; Sun, Zhihu; Xiao, Chong; Wu, Changzheng; Wei, Shiqiang; Xie, Yi

    2012-12-19

    Thermoelectric materials can realize significant energy savings by generating electricity from untapped waste heat. However, the coupling of the thermoelectric parameters unfortunately limits their efficiency and practical applications. Here, a single-layer-based (SLB) composite fabricated from atomically thick single layers was proposed to optimize the thermoelectric parameters fully. Freestanding five-atom-thick Bi(2)Se(3) single layers were first synthesized via a scalable interaction/exfoliation strategy. As revealed by X-ray absorption fine structure spectroscopy and first-principles calculations, surface distortion gives them excellent structural stability and a much increased density of states, resulting in a 2-fold higher electrical conductivity relative to the bulk material. Also, the surface disorder and numerous interfaces in the Bi(2)Se(3) SLB composite allow for effective phonon scattering and decreased thermal conductivity, while the 2D electron gas and energy filtering effect increase the Seebeck coefficient, resulting in an 8-fold higher figure of merit (ZT) relative to the bulk material. This work develops a facile strategy for synthesizing atomically thick single layers and demonstrates their superior ability to optimize the thermoelectric energy harvesting.

  4. Energy corrugation in atomic-scale friction on graphite revisited by molecular dynamics simulations

    Science.gov (United States)

    Sun, Xiao-Yu; Qi, Yi-Zhou; Ouyang, Wengen; Feng, Xi-Qiao; Li, Qunyang

    2016-08-01

    Although atomic stick-slip friction has been extensively studied since its first demonstration on graphite, the physical understanding of this dissipation-dominated phenomenon is still very limited. In this work, we perform molecular dynamics (MD) simulations to study the frictional behavior of a diamond tip sliding over a graphite surface. In contrast to the common wisdom, our MD results suggest that the energy barrier associated lateral sliding (known as energy corrugation) comes not only from interaction between the tip and the top layer of graphite but also from interactions among the deformed atomic layers of graphite. Due to the competition of these two subentries, friction on graphite can be tuned by controlling the relative adhesion of different interfaces. For relatively low tip-graphite adhesion, friction behaves normally and increases with increasing normal load. However, for relatively high tip-graphite adhesion, friction increases unusually with decreasing normal load leading to an effectively negative coefficient of friction, which is consistent with the recent experimental observations on chemically modified graphite. Our results provide a new insight into the physical origins of energy corrugation in atomic scale friction.

  5. Energy corrugation in atomic-scale friction on graphite revisited by molecular dynamics simulations

    Institute of Scientific and Technical Information of China (English)

    Xiao-Yu Sun; Yi-Zhou Qi; Wengen Ouyang; Xi-Qiao Feng; Qunyang Li

    2016-01-01

    Although atomic stick–slip friction has been extensively studied since its first demonstration on graphite, the physical understanding of this dissipation-dominated phenomenon is still very limited. In this work, we perform molecular dynamics (MD) simulations to study the frictional behavior of a diamond tip sliding over a graphite surface. In contrast to the common wisdom, our MD results suggest that the energy barrier associated lateral sliding (known as energy corrugation) comes not only from interaction between the tip and the top layer of graphite but also from interactions among the deformed atomic layers of graphite. Due to the competi-tion of these two subentries, friction on graphite can be tuned by controlling the relative adhesion of different interfaces. For relatively low tip-graphite adhesion, friction behaves nor-mally and increases with increasing normal load. However, for relatively high tip-graphite adhesion, friction increases unusually with decreasing normal load leading to an effec-tively negative coefficient of friction, which is consistent with the recent experimental observations on chemically modified graphite. Our results provide a new insight into the physical origins of energy corrugation in atomic scale friction.

  6. The International Atomic Energy Agency's activities in radiation medicine and cancer: promoting global health through diplomacy.

    Science.gov (United States)

    Deatsch-Kratochvil, Amanda N; Pascual, Thomas Neil; Kesner, Adam; Rosenblatt, Eduardo; Chhem, Rethy K

    2013-02-01

    Global health has been an issue of seemingly low political importance in comparison with issues that have direct bearing on countries' national security. Recently, health has experienced a "political revolution" or a rise in political importance. Today, we face substantial global health challenges, from the spread of infectious disease, gaps in basic maternal and child health care, to the globalization of cancer. A recent estimate states that the "overall lifetime risk of developing cancer (both sexes) is expected to rise from more than one in three to one in two by 2015." These issues pose significant threats to international health security. To successfully combat these grave challenges, the international community must embrace and engage in global health diplomacy, defined by scholars Thomas Novotny and Vicanne Adams as a political activity aimed at improving global health, while at the same time maintaining and strengthening international relations. The IAEA (International Atomic Energy Agency) is an international organization with a unique mandate to "accelerate and enlarge the contribution of atomic energy to peace, health, and prosperity throughout the world." This article discusses global health diplomacy, reviews the IAEA's program activities in human health by focusing on radiation medicine and cancer, and the peaceful applications of atomic energy within the context of global health diplomacy.

  7. The global institutional frameworks and the diffusion of renewable energy technologies in the BRICS countries

    OpenAIRE

    Bodas Freitas, I.M.; E. Dantas; Iizuka, M

    2010-01-01

    This paper examines the role of the global institutional frameworks on the national processes of innovation diffusion. we focus on the influence of the Kyoto mechanisms on the diffusion of renewable energy technologies in the BRICS countries i.e. Brazil, China India, Russia and South Africa. Our preliminary analysis suggests that the Kyoto Mechanisms may support the diffusion of some simple, low cost and mature technologies which are already diffused in the host countries, rather than the dif...

  8. Paul Scherrer Institut annual report 1996. Annex V: PSI general energy technology newsletter 1996

    Energy Technology Data Exchange (ETDEWEB)

    Daum, C.; Leuenberger, J. [eds.

    1997-06-01

    Surveying the results of General Energy Research in 1996, three major trends can be identified. First, in areas where research results have reached an advanced stage, decisive steps have been taken to promote a transfer towards industrial realization; examples include biomass gasification, advanced battery concepts, and combustion research. Second, in projects with longer term orientation, several options are being evaluated by exploratory studies, e.g. in solar chemistry and reaction analysis. Third, in line with the strategic planning of our institute, the development and characterization of materials for energy research has received increased attention. (author) figs., tabs., refs.

  9. 2012 U.S. Department of Energy: Joint Genome Institute: Progress Report

    Energy Technology Data Exchange (ETDEWEB)

    Gilbert, David [DOE JGI Public Affairs Manager

    2013-01-01

    The mission of the U.S. Department of Energy Joint Genome Institute (DOE JGI) is to serve the diverse scientific community as a user facility, enabling the application of large-scale genomics and analysis of plants, microbes, and communities of microbes to address the DOE mission goals in bioenergy and the environment. The DOE JGI's sequencing efforts fall under the Eukaryote Super Program, which includes the Plant and Fungal Genomics Programs; and the Prokaryote Super Program, which includes the Microbial Genomics and Metagenomics Programs. In 2012, several projects made news for their contributions to energy and environment research.

  10. Essays on the Impacts of Geography and Institutions on Access to Energy and Public Infrastructure Services

    Science.gov (United States)

    Archibong, Belinda

    While previous literature has emphasized the importance of energy and public infrastructure services for economic development, questions surrounding the implications of unequal spatial distribution in access to these resources remain, particularly in the developing country context. This dissertation provides evidence on the nature, origins and implications of this distribution uniting three strands of research from the development and political economy, regional science and energy economics fields. The dissertation unites three papers on the nature of spatial inequality of access to energy and infrastructure with further implications for conflict risk , the historical institutional and biogeographical determinants of current distribution of access to energy and public infrastructure services and the response of households to fuel price changes over time. Chapter 2 uses a novel survey dataset to provide evidence for spatial clustering of public infrastructure non-functionality at schools by geopolitical zone in Nigeria with further implications for armed conflict risk in the region. Chapter 3 investigates the drivers of the results in chapter 2, exploiting variation in the spatial distribution of precolonial institutions and geography in the region, to provide evidence for the long-term impacts of these factors on current heterogeneity of access to public services. Chapter 4 addresses the policy implications of energy access, providing the first multi-year evidence on firewood demand elasticities in India, using the spatial variation in prices for estimation.

  11. Institutional support for the Utah Consortium for Energy Research and Education. Annual report

    Energy Technology Data Exchange (ETDEWEB)

    1979-06-01

    The Utah Consortium for Energy Research and Education is made up of three colleges and universities in Utah. The scope of the Consortium plan is the marshalling of the academic research resources, as well as the appropriate non-academic resources within Utah to pursue, as appropriate, energy-related research activities. The heart of this effort has been the institutional contract between DOE and the University of Utah, acting as fiscal agent for the Consortium. Sixteen programs are currently being funded, but only ten of the projects are described in this report. Three projects are on fission/fusion; three on environment and safety; four on fossil energy; three on basic energy sciences; one each on conservation, geothermal, and solar.

  12. International Atomic Energy Agency specialists meeting on experience in ageing, maintenance, and modernization of instrumentation and control systems for improving nuclear power plant availability

    Energy Technology Data Exchange (ETDEWEB)

    1993-10-01

    This report presents the proceedings of the Specialist`s Meeting on Experience in Aging, Maintenance and Modernization of Instrumentation and Control Systems for Improving Nuclear Power Plant Availability that was held at the Ramada Inn in Rockville, Maryland on May 5--7, 1993. The Meeting was presented in cooperation with the Electric Power Research Institute, Oak Ridge National Laboratory and the International Atomic Energy Agency. There were approximately 65 participants from 13 countries at the Meeting. Individual reports have been cataloged separately.

  13. X-ray energies of circular transitions and electrons screening in kaonic atoms

    CERN Document Server

    Santos, J P; Desclaux, J P; Indelicato, P J; Parente, F; Indelicato, Paul; ccsd-00002661, ccsd

    2004-01-01

    The QED contribution to the energies of the circular (n,l=n-1), 2 ≤ n ≤ 19 transitions have been calculated for several kaonic atoms throughout the periodic table, using the current world average kaon mass. Calculations were done in the framework of the Klein-Gordon equation, with finite nuclear size and all-order Uelhing vacuum polarization corrections, as well as Kallen and Sabry and Wichmann and Kroll corrections. These energy level values are compared with other computed values. The circular transition energies are compared with available measured and theoretical transition energy. Electron screening is evaluated using a Dirac-Fock model for the electronic part of the wave function. The effect of electronic wavefunction correlation is evaluated for the first time.

  14. Stacking fault energy in FCC plutonium with multiple reference states in the modified embedded atom method

    Science.gov (United States)

    Valone, S. M.; Baskes, M. I.; Rudin, S. P.

    2012-03-01

    Basic concepts from the multi-reference state formalism for determining the functions for the modified embedded atom method (MEAM) are adopted to modeling elemental plutonium (Pu). In the case of elemental Pu, the focus is on the background electron density. Here we utilize a portion of the formalism that determines the structure of the background density necessary to capture correct phase ordering between fcc and ideal hcp crystal structures. The critical information comes from cold curves, that is the energy/volume relationships, for these phases. Practically speaking, the energy difference between these two phases determines the stacking fault energy of the material. At the same time, the simple monoclinic phase of elemental Pu also becomes higher in energy at the equilibrium volume of the fcc phase. The new model is based on first-principles electronic structure calculations and captures the basic phase ordering of those calculations.

  15. ENTNEA: A concept for enhancing regional atomic energy cooperation for securing nuclear transparency in northeast Asia

    Energy Technology Data Exchange (ETDEWEB)

    Shin, S. T. [Korea Institute for Defence Analyses, Seoul (Korea)

    2000-11-01

    Nuclear energy continues to be a strong and growing component of economic development in Northeast Asia. A broad range of nuclear energy systems already exists across the region and vigorous growth is projected. Associated with these capabilities and plans are various concerns about operational safety, environmental protection, and accumulation of spent fuel and other nuclear materials. We consider cooperative measures that might address these concerns. The confidence building measures suggested here center on the sharing of information to lessen concerns about nuclear activities or to solve technical problems. These activities are encompassed by an Enhanced Nuclear Transparency in Northeast Asia (ENTNEA) concept that would be composed of near-term, information-sharing activities and an eventual regional institution. The near-term activities would address specific concerns and build a tradition of cooperation; examples include radiation measurements for public safety and emergency response, demonstration of safe operations at facilities and in transportation, and material security in the back end of the fuel cycle. Linkages to existing efforts and organizations would be sought to maximize the benefits of cooperation. In the longer term, the new cooperative tradition might evolve into an ENTNEA institution. In institutional form, ENTNEA could combine the near-term activities and new cooperative activities, which might require an institutional basis, for the mutual benefit and security of regional parties. 28 refs., 23 figs., 5 tabs. (Author)

  16. Energy and Greenhouse Gas Emissions in China: Growth, Transition, and Institutional Change

    Science.gov (United States)

    Kahrl, Fredrich James

    support further improvements in efficiency and scale up renewable generation at an acceptable level of cost and reliability. Chapter 6 examines energy use and GHG emissions from nitrogen fertilizer use, arguing that energy use and GHG emissions from nitrogen fertilizer use in China are high relative to other countries because of China's historical support for small and medium-sized enterprises using domestic technology; its continued provision of energy subsidies to fertilizer producers; and its lack of a well-functioning agricultural extension system. The case studies illustrate the limits of energy and climate policy in China without institutional reform. China's leaders have historically relied on economic growth to defer the difficult changes in political economy that accompany economic and social transition. However, many of the challenges of energy and climate policy require political decisions that reallocate resources among stakeholders. For instance, restructuring the Chinese economy away from heavy industrial investment and toward a higher GDP share of consumption will require financial sector reforms, such as interest rate liberalization or higher dividend payments for state-owned enterprises, that reallocate income from the industrial sector to households. Increasing power system flexibility will require price reforms that reallocate revenues and costs among generators, between generators and the grid companies, between producers and ratepayers, among ratepayer classes, and between and among provinces. Strong public interest institutions are needed to make these changes, which suggests that China's energy and GHG emissions trajectories will be determined, to a large extent, by the politics of institutional reform.

  17. New generation polyphase resonant converter-modulators for the Korean atomic energy research institute

    Energy Technology Data Exchange (ETDEWEB)

    Reass, William A [Los Alamos National Laboratory; Baca, David M [Los Alamos National Laboratory; Gribble, Robert F [Los Alamos National Laboratory

    2009-01-01

    This paper will present operational data and performance parameters of the newest generation polyphase resonant high voltage converter modulator (HVCM) as developed and delivered to the KAERI 100 MeV ''PEFP'' accelerator [1]. The KAERI design realizes improvements from the SNS and SLAC designs [2]. To improve the IGBT switching performance at 20 kHz for the KAERI system, the HVCM utilizes the typical zero-voltage-switching (ZVS) at turn on and as well as artificial zero-current-switching (ZCS) at turn-off. The new technique of artificial ZCS technique should result in a 6 fold reduction of IGBT switching losses (3). This improves the HCVM conversion efficiency to better than 95% at full average power, which is 500 kW for the KAERI two klystron 105 kV, 50 A application. The artificial ZCS is accomplished by placing a resonant RLC circuit across the input busswork to the resonant boost transformer. This secondary resonant circuit provides a damped ''kick-back'' to assist in IGBT commutation. As the transformer input busswork is extremely low inductance (< 10 nH), the single RLC network acts like it is across each of the four IGBT collector-emitter terminals of the H-bridge switching network. We will review these topological improvements and the overall system as delivered to the KAERI accelerator and provide details of the operational results.

  18. Electromagnetic separation of stable isotopes at China Institute of Atomic Energy

    Science.gov (United States)

    Meiqin, Xiao; Hongyou, Lu; Shijun, Su; Zhizhou, Lin

    1993-09-01

    Electromagnetic separation of stable isotopes at CIAE is described. The separators, the ion sources used, the isotopes separated and their applications are introduced. The improvement of a 180° production separator is also described.

  19. Monte Carlo Study of a 137Cs calibration field of the China institute of atomic energy

    CERN Document Server

    Gao, Fei

    2015-01-01

    The MCNP code was used to study the characteristics of gamma radiation field with collimated beam geometry. A close-to-reality simulation model of the facility was used for calculation air-kerma along the whole range of source-detector-distance (SDD) along the central beam and air-kerma off-axis beam profiles at two different source-detector-distance (SDD). The simulation results were tested by the measured results which were acquired in the Radiation Metrology Center of CIAE. Other characteristics such as the individual contributions of photons scattered in collimator, floor, walls, mobile platform and other parts of the irradiation halls to the total air kerma rate on the beam axis were calculated for the purpose of future improvement of metrological parameters in CIAE. Finally, factors which influence the simulation results were investigated, including e.g., detector volume effects or source density effects.

  20. Studies of high-level waste form performance at Japan Atomic Energy Research Institute

    Energy Technology Data Exchange (ETDEWEB)

    Banba, Tsunetaka; Mitamura, Hisayoshi; Kuramoto, Kenichi; Kamizono, Hiroshi [Japan Atomic Energy Research Inst., Tokai, Ibaraki (Japan). Tokai Research Establishment; Inagaki, Yahohiro

    1998-02-01

    The JAERI studies on the properties of the glass and ceramic waste forms, which have been done in the last several years, are described briefly. For the long-term evaluation of glass waste form performance under repository condition, leachability has studied from the standpoints of understanding of alteration layers, effects of groundwater and effects of redox condition using the radioactive or non-radioactive glass samples. The studies revealed that (1) the reactions in the alteration layers, such as crystal growth, continue after the apparent release of elements from the glass almost ceases, (2) under somewhat reducing conditions, Fe dissolves easily into leachates, and hydrated silicate surface layer tends to dissolve more easily with Fe in reduced synthetic groundwater than in deionized water, (3) precipitation of PuO{sub 2}{center_dot}xH{sub 2}O(am) is controlling the leaching of soluble species of Pu under both redox conditions, and the dominant soluble species is Pu(OH){sub 4}{sup 0} under reducing condition. Ceramics are considered as most promising materials for the actinide-rich wastes arising from partitioning and transmutation processes because of their outstanding durability for long term. In the present study, {alpha}-decay damage effects on the density and leaching behavior of perovskite (1 of 3 main minerals forming Synroc) were investigated by an accelerated experiment using the actinide doping technique. A decrease in density of Cm-doped perovskite reaches 1.3% at a dose of 9x10{sup 17} {alpha}-decays{center_dot}g{sup -1}. The leach rate of perovskite increases with an increase in accumulated {alpha}-decay doses. Application of zirconia- and alumina-based ceramics for incorporating actinides was also investigated by inactive laboratory tests with an emphasis on crystallographic phase stability and chemical durability. The yttria-stabilized zirconia is stable crystallographically in the wide ranges of Ce and/or Nd content and have excellent chemical durability. (author)

  1. Electrode surface engineering by atomic layer deposition: A promising pathway toward better energy storage

    KAUST Repository

    Ahmed, Bilal

    2016-04-29

    Research on electrochemical energy storage devices including Li ion batteries (LIBs), Na ion batteries (NIBs) and supercapacitors (SCs) has accelerated in recent years, in part because developments in nanomaterials are making it possible to achieve high capacities and energy and power densities. These developments can extend battery life in portable devices, and open new markets such as electric vehicles and large-scale grid energy storage. It is well known that surface reactions largely determine the performance and stability of electrochemical energy storage devices. Despite showing impressive capacities and high energy and power densities, many of the new nanostructured electrode materials suffer from limited lifetime due to severe electrode interaction with electrolytes or due to large volume changes. Hence control of the surface of the electrode material is essential for both increasing capacity and improving cyclic stability of the energy storage devices.Atomic layer deposition (ALD) which has become a pervasive synthesis method in the microelectronics industry, has recently emerged as a promising process for electrochemical energy storage. ALD boasts excellent conformality, atomic scale thickness control, and uniformity over large areas. Since ALD is based on self-limiting surface reactions, complex shapes and nanostructures can be coated with excellent uniformity, and most processes can be done below 200. °C. In this article, we review recent studies on the use of ALD coatings to improve the performance of electrochemical energy storage devices, with particular emphasis on the studies that have provided mechanistic insight into the role of ALD in improving device performance. © 2016 Elsevier Ltd.

  2. Low energy neutral atom imaging on the Moon with the SARA instrument aboard Chandrayaan-1 mission

    Indian Academy of Sciences (India)

    Anil Bhardwaj; Stas Barabash; Yoshifumi Futaana; Yoichi Kazama; Kazushi Asamura; David McCann; R Sridharan; Mats Holmstrom; Peter Wurz; Rickard Lundin

    2005-12-01

    This paper reports on the Sub-keV Atom Reflecting Analyzer (SARA)experiment that will be flown on the first Indian lunar mission Chandrayaan-1.The SARA is a low energy neutral atom (LENA)imaging mass spectrometer,which will perform remote sensing of the lunar surface via detection of neutral atoms in the energy range from 10 eV to 3 keV from a 100 km polar orbit.In this report we present the basic design of the SARA experiment and discuss various scientific issues that will be addressed.The SARA instrument consists of three major subsystems:a LENA sensor (CENA),a solar wind monitor (SWIM),and a digital processing unit (DPU).SARA will be used to image the solar wind –surface interaction to study primarily the surface composition and surface magnetic anomalies and associated mini-magnetospheres.Studies of lunar exosphere sources and space weathering on the Moon will also be attempted.SARA is the first LENA imaging mass spectrometer of its kind to be flown on a space mission.A replica of SARA is planned to fly to Mercury onboard the BepiColombo mission.

  3. Cyclotron laboratory of the Institute for Nuclear Research and Nuclear Energy

    Science.gov (United States)

    Tonev, D.; Goutev, N.; Georgiev, L. S.

    2016-06-01

    An accelerator laboratory is presently under construction in Sofia at the Institute for Nuclear Research and Nuclear Energy, Bulgarian Academy of Sciences. The laboratory will use a TR24 type of cyclotron, which provides a possibility to accelerate a proton beam with an energy of 15 to 24 MeV and current of up to 0.4 mA. An accelerator with such parameters allows to produce a large variety of radioisotopes for development of radiopharmaceuticals. The most common radioisotopes that could be produced with such a cyclotron are PET isotopes like: 11C, 13N, 15O, 18F, 124I, 64Cu, 68Ge/68Ga, and SPECT isotopes like: 123I, 111In, 67Ga, 57Co, 99m Tc. Our aim is to use the cyclotron facility for research in the fields of radiopharmacy, radiochemistry, radiobiology, nuclear physics, solid state physics, applied research, new materials and for education in all these fields including nuclear energy. The building of the laboratory will be constructed nearby the Institute for Nuclear Research and Nuclear Energy and the cyclotron together with all the equipment needed will be installed there.

  4. Recent Development of Advanced Electrode Materials by Atomic Layer Deposition for Electrochemical Energy Storage.

    Science.gov (United States)

    Guan, Cao; Wang, John

    2016-10-01

    Electrode materials play a decisive role in almost all electrochemical energy storage devices, determining their overall performance. Proper selection, design and fabrication of electrode materials have thus been regarded as one of the most critical steps in achieving high electrochemical energy storage performance. As an advanced nanotechnology for thin films and surfaces with conformal interfacial features and well controllable deposition thickness, atomic layer deposition (ALD) has been successfully developed for deposition and surface modification of electrode materials, where there are considerable issues of interfacial and surface chemistry at atomic and nanometer scale. In addition, ALD has shown great potential in construction of novel nanostructured active materials that otherwise can be hardly obtained by other processing techniques, such as those solution-based processing and chemical vapor deposition (CVD) techniques. This review focuses on the recent development of ALD for the design and delivery of advanced electrode materials in electrochemical energy storage devices, where typical examples will be highlighted and analyzed, and the merits and challenges of ALD for applications in energy storage will also be discussed.

  5. Correlation energies beyond the random-phase approximation: ISTLS applied to spherical atoms and ions

    CERN Document Server

    Gould, Tim

    2012-01-01

    The inhomogeneous Singwi, Tosi, Land and Sjolander (ISTLS) correlation energy functional of Dobson, Wang and Gould [PRB {\\bf 66} 081108(R) (2008)] has proved to be excellent at predicting correlation energies in semi-homogeneous systems, showing promise as a robust `next step' fifth-rung functional by using dynamic correlation to go beyond the limitations of the direct random-phase approximation (dRPA), but with similar numerical scaling with system size. In this work we test the functional on fourteen spherically symmetric, neutral and charged atomic systems and find it gives excellent results (within 2mHa/$e^-$ except Be) for the absolute correlation energies of the neutral atoms tested, and good results for the ions (within 4mHa/$e^-$). In all cases it performs better than the dRPA. When combined with the previous successes, these new results point to the ISTLS functional being a prime contender for high-accuracy, benchmark DFT correlation energy calculations.

  6. Institutional constraints on alternative water for energy: a guidebook for regional assessments

    Energy Technology Data Exchange (ETDEWEB)

    1980-11-01

    Basic information is presented about the legal, political, and social constraints faced by energy developers in the acquisition of water from underground, irrigation return flow, municipal waste, and saline sources. It is a guide to those institutional constraints which are general and pronounced enough to be important for regional assessments. First, attention was focused on the acquisition phase of the water use cycle. Second, constraints were analyzed primarily from a regional, rather than state-by-state, perspective. Emphasis was placed generally on the West - particularly the synfuel-rich Rocky Mountain states, the East, and Mid-West, in that order. Alaska and Hawaii were not surveyed. Third, the study focuses on the constraints associated with groundwater, municipal waste, irrigation return flow, and sea water, in that order. The phrase, institutional constraints, as used in the study, means legal, social, economic, and political restrictions, requirements, circumstances, or conditions that must be anticipated or responded to in order to acquire water for energy development. The study focuses primarily on legal constraints and secondarily on political constraints, because they tend to encompass or reflect other forms of institutional constraints.

  7. Atomic energy law after the opt-out. Alive and fascinating. Report about the 14{sup th} German atomic energy law symposium 2012; Atomrecht nach dem Ausstieg. Lebendig und spannend. Tagungsbericht 14. Deutsches Atomrechtssymposium 2012

    Energy Technology Data Exchange (ETDEWEB)

    Leidinger, Tobias [Gleiss Lutz Rechtsanwaelte, Duesseldorf (Germany)

    2013-01-15

    Atomic energy law remains a living, fascinating subject matter. Nearly 200 participants were convinced of this impression at the 14{sup th} German Atomic Energy Law Symposium held in Berlin on November 19-20, 2012. Under the scientific chairmanship of Professor Dr. Martin Burgi, Ludwig Maximilian University of Munich, the German Federal Ministry for the Environment, Nature Conservation and Nuclear Safety (BMU), after an interruption of 5 years, again organized a scientific conference about practice-related topics of atomic energy and radiation protection law. Atomic energy law once again proved to be a reference area for sophisticated issues of constitutional law and administrative law above and beyond its technical confines. The agenda of the 14{sup th} German Atomic Energy Law Symposium featured a broad spectrum of topics ranging from backfitting of nuclear power plants to European atomic energy and radiation protection law, to challenges facing national legal systems in the execution of atomic energy law, to legal issues connected with decommissioning and waste management, and on to the topical subject of finding a repository site. The 14{sup th} German Atomic Energy Law Symposium, on the whole, again demonstrated that an open discourse between science and practice is able to furnish important contributions to the implementation of laws in a balanced way rooted in practice. Especially the contributions dealing with the independence of public authorities and their organization, the doctrine of the reservation of functions of the executive branch, and planning by laws contain additional provisions able to influence the continued development of administrative law also above and beyond atomic energy law. The BMU also referred to a decision just heard from Brussels to the effect that a new European Safety Directive would be published as early as in 2013. As a consequence of the nuclear stress tests conducted EU-wide, the Directive is to lay down provisions about

  8. An Apparatus for the Measurement of Various Scattering Processes in Intermediate Energy, Ion - Atom Collisions

    Energy Technology Data Exchange (ETDEWEB)

    Kvale, T. J.; Seely, D. G.

    1998-07-01

    This paper summarizes the main features of an apparatus constructed at the University of Toledo for the study of various scattering processes in intermediate energy, ion - atom collisions. The main purpose of this facility is to provide experimental data which serve as benchmarks to test current scattering theories for those processes. Recent measurements of single electron detachment (SED) and double electron detachment (DED) total cross sections for 5-50 keV H{sup -} ions incident on noble gases and for 10-50 keV H{sup -} ions incident on CH{sub 4} molecules were conducted in this laboratory. As a result of an analysis of the scattered beam growth curves, information about other charge-changing cross sections in the hydrogen-atom (molecule) collision systems were obtain, as well.

  9. Demystifying Introductory Chemistry. Part 4: An Approach to Reaction Thermodynamics through Enthalpies, Entropies, and Free Energies of Atomization.

    Science.gov (United States)

    Spencer, James N.; And Others

    1996-01-01

    Presents an alternative approach to teaching reaction thermodynamics in introductory chemistry courses using calculations of enthalpies, entropies, and free energies of atomization. Uses a consistent concept, that of decomposition of a compound to its gaseous atoms, to discuss not only thermodynamic parameters but also equilibrium and…

  10. 78 FR 56944 - Strata Energy, Inc. (Ross In Situ Recovery Uranium Project); Notice of Atomic Safety and...

    Science.gov (United States)

    2013-09-16

    ... From the Federal Register Online via the Government Publishing Office NUCLEAR REGULATORY COMMISSION Strata Energy, Inc. (Ross In Situ Recovery Uranium Project); Notice of Atomic Safety and Licensing Board Reconstitution Pursuant to 10 CFR 2.313(c) and 2.321(b), the Atomic Safety and Licensing...

  11. On the combination of a low energy hydrogen atom beam with a cold multipole ion trap

    Energy Technology Data Exchange (ETDEWEB)

    Borodi, Gheorghe

    2008-12-09

    The first part of the activities of this thesis was to develop a sophisticated ion storage apparatus dedicated to study chemical processes with atomic hydrogen. The integration of a differentially pumped radical beam source into an existing temperature variable 22- pole trapping machine has required major modifications. Since astrophysical questions have been in the center of our interest, the introduction first gives a short overview of astrophysics and -chemistry. The basics of ion trapping in temperature variable rf traps is well-documented in the literature; therefore, the description of the basic instrument (Chapter 2) is kept rather short. Much effort has been put into the development of an intense and stable source for hydrogen atoms the kinetic energy of which can be changed. Chapter 3 describes this module in detail with emphasis on the integration of magnetic hexapoles for guiding the atoms and special treatments of the surfaces for reducing H-H recombination. Due to the unique sensitivity of the rf ion trapping technique, this instrument allows one to study a variety of reactions of astrochemical and fundamental interest. The results of this work are summarized in Chapter 4. Reactions of CO{sub 2}{sup +} with hydrogen atoms and molecules have been established as calibration standard for in situ determination of H and H{sub 2} densities over the full temperature range of the apparatus (10 K-300 K). For the first time, reactions of H- and D-atoms with the ionic hydrocarbons CH{sup +}, CH{sub 2}{sup +}, and CH{sub 4}{sup +} have been studied at temperatures of interstellar space. A very interesting, not yet fully understood collision system is the interaction of protonated methane with H. The outlook presents some ideas, how to improve the new instrument and a few reaction systems are mentioned which may be studied next. (orig.)

  12. Heating Water with Solar Energy Costs Less at the Phoenix Federal Correctional Institution

    Energy Technology Data Exchange (ETDEWEB)

    None

    2004-09-01

    A large solar thermal system installed at the Phoenix Federal Correctional Institution (FCI) in 1998 heats water for the prison and costs less than buying electricity to heat that water. This renewable energy system provides 70% of the facility's annual hot water needs. The Federal Bureau of Prisons did not incur the up-front cost of this system because it was financed through an Energy Savings Performance Contract (ESPC). The ESPC payments are 10% less than the energy savings so that the prison saves an average of $6,700 per year, providing an immediate payback. The solar hot water system produces up to 50,000 gallons of hot water daily, enough to meet the needs of 1,250 inmates and staff who use the kitchen, shower, and laundry facilities. This publication details specifications of the parabolic trough solar system and highlights 5 years of measured performance data.

  13. A model for energy transfer in collisions of atoms with highly excited molecules.

    Science.gov (United States)

    Houston, Paul L; Conte, Riccardo; Bowman, Joel M

    2015-05-21

    A model for energy transfer in the collision between an atom and a highly excited target molecule has been developed on the basis of classical mechanics and turning point analysis. The predictions of the model have been tested against the results of trajectory calculations for collisions of five different target molecules with argon or helium under a variety of temperatures, collision energies, and initial rotational levels. The model predicts selected moments of the joint probability distribution, P(Jf,ΔE) with an R(2) ≈ 0.90. The calculation is efficient, in most cases taking less than one CPU-hour. The model provides several insights into the energy transfer process. The joint probability distribution is strongly dependent on rotational energy transfer and conservation laws and less dependent on vibrational energy transfer. There are two mechanisms for rotational excitation, one due to motion normal to the intermolecular potential and one due to motion tangential to it and perpendicular to the line of centers. Energy transfer is found to depend strongly on the intermolecular potential and only weakly on the intramolecular potential. Highly efficient collisions are a natural consequence of the energy transfer and arise due to collisions at "sweet spots" in the space of impact parameter and molecular orientation.

  14. Evaluation of atomic electron binding energies for Monte Carlo particle transport

    CERN Document Server

    Pia, Maria Grazia; Batic, Matej; Begalli, Marcia; Kim, Chan Hyeong; Quintieri, Lina; Saracco, Paolo

    2011-01-01

    A survey of atomic binding energies used by general purpose Monte Carlo systems is reported. Various compilations of these parameters have been evaluated; their accuracy is estimated with respect to experimental data. Their effects on physics quantities relevant to Monte Carlo particle transport are highlighted: X-ray fluorescence emission, electron and proton ionization cross sections, and Doppler broadening in Compton scattering. The effects due to different binding energies are quantified with respect to experimental data. The results of the analysis provide quantitative ground for the selection of binding energies to optimize the accuracy of Monte Carlo simulation in experimental use cases. Recommendations on software design dealing with these parameters and on the improvement of data libraries for Monte Carlo simulation are discussed.

  15. Double-electron capture by highly-ionized atoms isolated at very low energy

    Science.gov (United States)

    Fogwell Hoogerheide, Shannon; Dreiling, Joan M.; Sahiner, Arda; Tan, Joseph N.

    2016-05-01

    Charge exchange with background gases, also known as electron capture processes, is important in the study of comets, controlled fusion energy, anti-matter atoms, and proposed one-electron ions in Rydberg states. However, there are few experiments in the very low energy regime that could be useful for further theoretical development. At NIST, highly-charged ions extracted from an electron-beam ion trap can be isolated with energy state. Analysis using a system of rate equations yields information about the ion cloud expansion and single-electron capture rates. A substantial amount of double-electron capture is also observed. We present the relative rates and discuss the error budget. SFH and JMD were funded by National Research Council Research Associateship Awards during some of this work.

  16. APPLICATION OF CORRELATION—POLARIZA TION POTENTIAL TO THE LOW—ENERGY ELECTRON SCATTERING WITH ATOMS AND MOLECULES

    Institute of Scientific and Technical Information of China (English)

    Zhijie; JianminYuan

    1990-01-01

    Applicability of the correlation potential,which is currently used in the local density functional theory,to the low-energy electron-atom and molecule scattering is investigated with some examples of scattering processes.

  17. Renewable Energy Legislation in China:Political and Institutional Strategy for Effective Implementation

    Institute of Scientific and Technical Information of China (English)

    Ren Dongming; Joanna Lewis

    2004-01-01

    Over the past decade, the Chinese government has developed several plans regulations and policy measures related to the development of renewable energy technologies and has implemented a series of pilot projects. Chinese policymakers have spent several years studying how renewable energy policy models that have been used internationally could be implemented in China. Programs are currently underway to implement pilot renewable portfolio standards, or mandatory market shares (MMS) for renewable energy, in several provinces.This paper examines the primary institutions that are involved in promoting renewable policies in China, the structure of the policies that currently are being drafted, and the status of the complementary,national-level renewable energy law being drafted to provide a legal basis for ongoing local and nationallevel policies. It then examines the legal requirements for promoting renewable energy legislation under the Chinese law-making system. Finally, it provides recommendations for strategies to ensure the smooth implementation of a multi-faceted national renewable energy policy and legal framework.

  18. New atomic energy law - international and national developments. Proceedings; Neues Atomenergierecht - internationale und nationale Entwicklungen. Tagungsbericht

    Energy Technology Data Exchange (ETDEWEB)

    Pelzer, N. [ed.] [Goettingen Univ. (Germany). Inst. fuer Voelkerrecht

    1995-12-31

    Two of the working sessions of the meeting were devoted to aspects of international atomic energy law; the international character of the meeting was also reflected by the home countries of the members of the panel discussion concluding the working sessions. There was substantial reason to put emphasis on the international dimension of the topics discussed. In June 1994, the Nuclear Safety Convention had been signed in Vienna by diplomatic representatives of the signatory countries, and this Convention marks a signpost in the history of international atomic energy law. At the time the meeting was held, negotiations for improving the international nuclear lability law, which had been dragging on since 1989, had come to a stalemate. The meeting offered a suitable forum for taking a scientific approach to tackle the complex problems involved in reshaping the law on nuclear safety and nuclear liability. The third working session of the meeting has been discussing topics relating to the implementation of the German Atomgesetz (Atomic Energy Act). (orig./HP) [Deutsch] Zwei der Arbeitssitzungen waren Fragen des internationalen Atomenergierechts gewidmet; auch die Zusammensetzung der Teilnehmer des abschliessenden Rundtischgespraechs wiesen die internationalen Aspekte als den Schwerpunkt der Veranstaltung aus. Fuer diese Gewichtung bestand begruendeter Anlass. Im Juni 1994 hatte eine diplomatische Konferenz in Wien die sogenannte Nukleare Sicherheitskonvention verabschiedet, die einen Meilenstein in der Entwicklung des internationalen Atomrechts darstellt. Die bereits seit 1989 andauernden Verhandlungen zur Verbesserung des internationalen Atomhaftungsrechts fanden sich zur Zeit der Tagung in einer krisenhaften Situation. Dies bot Anlass zur wissenschaftlichen Aufarbeitung der Komplexe nukleare Sicherheit und Atomhaftungsrecht. In einer dritten Arbeitssitzung wurden aktuelle Themen aus dem Bereich des Vollzugs des Atomgesetzes eroertert. (orig./HP)

  19. Application of an excited state LDA exchange energy functional for the calculation of transition energy of atoms within time-independent density functional theory

    Energy Technology Data Exchange (ETDEWEB)

    Shamim, Md; Harbola, Manoj K, E-mail: sami@iitk.ac.i, E-mail: mkh@iitk.ac.i [Department of Physics, Indian Institute of Technology, Kanpur 208 016 (India)

    2010-11-14

    Transition energies of a new class of excited states (two-gap systems) of various atoms are calculated in time-independent density functional formalism by using a recently proposed local density approximation exchange energy functional for excited states. It is shown that the excitation energies calculated with this functional compare well with those calculated with exact exchange theories.

  20. 75 FR 64306 - Shell Energy North America (US), LP; Notice of Institution of Proceeding and Refund Effective Date

    Science.gov (United States)

    2010-10-19

    ... Energy Regulatory Commission Shell Energy North America (US), LP; Notice of Institution of Proceeding and... U.S.C. 824e (2005), concerning the justness and reasonableness of Shell Energy North America (US), LP's market- based rate authority in the Central and Southwest balancing authority area. Shell...

  1. The University of Rochester Atomic Energy Project quarterly report, April 1, 1950--June 30, 1950

    Energy Technology Data Exchange (ETDEWEB)

    Blair, H.A.

    1950-12-31

    This quarterly progress report gives an overview of the University of Rochester Atomic Energy Project for April 1, 1950 thru June 30, 1950. Sections included are entitled (1) Biological Effects of External Radiation (X-rays and gamma rays), (2) Biological Effects of External Radiation (Infra-red and ultraviolet), (3) Biological effects of radioactive materials (polonium, radon, thoron, and miscellaneous project materials), (4) Uranium, (5) Beryllium, (7) thorium, (8) fluoride, (9) zirconium, (10) special materials, (11) Isotopes, (12) Outside services, (12) Project health, (13) Health physics, (14) Special Clinical Service, and (15) Instrumentation (Spectroscopy, electron microscopy, x-ray and nuclear radiation detectors, x-ray diffraction, and electronics).

  2. Atomic layer epitaxy of hematite on indium tin oxide for application in solar energy conversion

    Energy Technology Data Exchange (ETDEWEB)

    Martinson, Alex B.; Riha, Shannon; Guo, Peijun; Emery, Jonathan D.

    2016-07-12

    A method to provide an article of manufacture of iron oxide on indium tin oxide for solar energy conversion. An atomic layer epitaxy method is used to deposit an uncommon bixbytite-phase iron (III) oxide (.beta.-Fe.sub.2O.sub.3) which is deposited at low temperatures to provide 99% phase pure .beta.-Fe.sub.2O.sub.3 thin films on indium tin oxide. Subsequent annealing produces pure .alpha.-Fe.sub.2O.sub.3 with well-defined epitaxy via a topotactic transition. These highly crystalline films in the ultra thin film limit enable high efficiency photoelectrochemical chemical water splitting.

  3. Scaled-energy spectroscopy of helium \\|M\\|=1 Rydberg atoms in a static electric field

    Science.gov (United States)

    Kips, Annemieke; Vassen, Wim; Hogervorst, Wim; Dando, Paul A.

    1998-10-01

    We present scaled-energy spectra on helium Rydberg atoms in a static electric field. \\|M\\|=1 states were studied in excitation from the 2 1S0 metastable state. Spectra were recorded for ɛ=-2.940(4), ɛ=-2.350(4), both below the saddle point, and ɛ=-1.760(4), above the saddle point. Closed-orbit theory was applied to interpret the spectra. A recent extension to closed-orbit theory, incorporating core effects, was used. This significantly improved agreement between experiment and theory.

  4. X-alpha calculation of transition energies in multiply ionized atoms

    Science.gov (United States)

    Ringers, D. A.; Chen, M. H.

    1974-01-01

    It is shown that the accuracy of calculations can be improved if appropriate (different) values of alpha are used for each configuration. Alternatively, the Slater Transition state can be used, wherein a total energy difference is related to a difference in single electron eigenvalues. By a series expansion, the value of alpha for an excited configuration can be related to its value for the ground state configuration. The terms Delta alpha (delta Epsilon/delta alpha) exhibit a similar dependence on atomic number as the ground state values of alpha. Results of sample calculations are reported and compared with experiment.

  5. Energy landscape investigation by wavelet transform analysis of atomic force spectroscopy data in a biorecognition experiment.

    Science.gov (United States)

    Bizzarri, Anna Rita

    2016-01-01

    Force fluctuations recorded in an atomic force spectroscopy experiment, during the approach of a tip functionalized with biotin towards a substrate charged with avidin, have been analyzed by a wavelet transform. The observation of strong transient changes only when a specific biorecognition process between the partners takes place suggests a drastic modulation of the force fluctuations when biomolecules recognize each other. Such an analysis allows to investigate the peculiar features of a biorecognition process. These results are discussed in connection with the possible role of energy minima explored by biomolecules during the biorecognition process.

  6. Real-time study of the adiabatic energy loss in an atomic collision with a metal cluster.

    Science.gov (United States)

    Baer, Roi; Siam, Nidal

    2004-10-01

    Gas-phase hydrogen atoms are accelerated towards metallic surfaces in their vicinity. As it approaches the surface, the velocity of an atom increases and this motion excites the metallic electrons, causing energy loss to the atom. This dissipative dynamics is frequently described as atomic motion under friction, where the friction coefficient is obtained from ab initio calculations assuming a weak interaction and slow atom. This paper tests the aforementioned approach by comparing to a real-time Ehrenfest molecular dynamics simulation of such a process. The electrons are treated realistically using standard approximations to time-dependent density functional theory. We find indeed that the electronic excitations produce a friction-like force on the atom. However, the friction coefficient strongly depends on the direction of the motion of the atom: it is large when the atom is moving towards the cluster and much smaller when the atom is moving away. It is concluded that a revision of the model for energy dissipation at metallic surfaces, at least for clusters, may be necessary.

  7. Atomic Structure Calculations for Neutral Oxygen

    OpenAIRE

    Norah Alonizan; Rabia Qindeel; Nabil Ben Nessib

    2016-01-01

    Energy levels and oscillator strengths for neutral oxygen have been calculated using the Cowan (CW), SUPERSTRUCTURE (SS), and AUTOSTRUCTURE (AS) atomic structure codes. The results obtained with these atomic codes have been compared with MCHF calculations and experimental values from the National Institute of Standards and Technology (NIST) database.

  8. Enhanced creation of dispersive monolayer phonons in Xe/Pt(111) by inelastic helium atom scattering at low energies

    DEFF Research Database (Denmark)

    Hansen, Flemming Yssing; Bruch, Ludwig Walter

    2007-01-01

    Conditions likely to lead to enhanced inelastic atomic scattering that creates shear horizontal (SH) and longitudinal acoustic (LA) monolayer phonons are identified, specifically examining the inelastic scattering of He-4 atoms by a monolayer solid of Xe/Pt(111) at incident energies of 2-25 me...... an absorbing potential at large distance. The times now extend to beyond 100 ps and enable a clarification of processes involving transient trapping of the He atoms. The wave packet is made more monochromatic by significantly increasing the spatial width of the initial Gaussian shape. The narrower energy...

  9. Low-energy electron elastic scattering from Os atom: New electron affinity

    Science.gov (United States)

    Felfli, Z.; Kiros, F.; Msezane, A. Z.

    2013-05-01

    Bilodeau and Haugan measured the binding energies (BEs) of the ground state and the excited state of the Os- ion to be 1.07780(12) eV and 0.553(3) eV, respectively. These values are consistent with those calculated in. Here our investigation, using the recent complex angular momentum methodology wherein is embedded the crucial electron-electron correlations and the vital core polarization interaction, has found that the near threshold electron-Os elastic scattering total cross section (TCS) is characterized by three stable bound states of the Os- ion formed as resonances during the slow electron collision, with BEs of 1.910 eV, 1.230 eV and 0.224 eV. The new extracted electron affinity (EA) value from the TCS of 1.910 eV for the Os atom is significantly different from that measured in. Our calculated elastic differential cross sections (DCSs) also yield the relevant BEs for the ground and the two excited states of the Os- ion. The complex characteristic resonance structure in the TCS for the Os atom is ideal for catalysis, but makes it difficult to execute the Wigner threshold law in describing the threshold detachment behavior of complex atoms and extracting the reliable attendant EAs. Supported by U.S. DOE, AFOSR and CAU CFNM, NSF-CREST Program.

  10. A Terrestrial Search for Dark Contents of the Vacuum, Such as Dark Energy, Using Atom Interferometry

    Energy Technology Data Exchange (ETDEWEB)

    Adler, Ronald J.; /Stanford U., HEPL /San Francisco State U.; Muller, Holger; /UC, Berkeley; Perl, Martin L.; /KIPAC, Menlo Park /SLAC

    2012-06-11

    We describe the theory and first experimental work on our concept for searching on earth for the presence of dark contents of the vacuum (DCV) using atom interferometry. Specifically, we have in mind any DCV that has not yet been detected on a laboratory scale, but which might manifest itself as dark energy on the cosmological scale. The experimental method uses two atom interferometers to cancel the effect of earth's gravity and diverse noise sources. It depends upon two assumptions: first, that the DCV possesses some space inhomogeneity in density, and second that it exerts a sufficiently strong nongravitational force on matter. The motion of the apparatus through the DCV should then lead to an irregular variation in the detected matter-wave phase shift. We discuss the nature of this signal and note the problem of distinguishing it from instrumental noise. We also discuss the relation of our experiment to what might be learned by studying the noise in gravitational wave detectors such as LIGO. The paper concludes with a projection that a future search of this nature might be carried out using an atom interferometer in an orbiting satellite. The laboratory apparatus is now being constructed.

  11. Magnetizabilities of relativistic hydrogenlike atoms in some arbitrary discrete energy eigenstates

    CERN Document Server

    Stefańska, Patrycja

    2016-01-01

    We present the results of numerical calculations of magnetizability ($\\chi$) of the relativistic one-electron atoms with a pointlike, spinless and motionless nuclei of charge $Ze$. Exploiting the analytical formula for $\\chi$ recently derived by us [P. Stefa{\\'n}ska, 2015], valid for an arbitrary discrete energy eigenstate, we have found the values of the magnetizability for the ground state and for the first and the second set of excited states (i.e.: $2s_{1/2}$, $2p_{1/2}$, $2p_{3/2}$, $3s_{1/2}$, $3p_{1/2}$, $3p_{3/2}$, $3d_{3/2}$, and $3d_{5/2}$) of the Dirac one-electron atom. The results for ions with the atomic number $1 \\leqslant Z \\leqslant 137$ are given in 14 tables. The comparison of the numerical values of magnetizabilities for the ground state and for each states belonging to the first set of excited states of selected hydrogenlike ions, obtained with the use of two different values of the fine-structure constant, i.e.: $\\alpha^{-1}=137.035 999 139$ (CODATA 2014) and $\\alpha^{-1}=137.035 999 074...

  12. Paul Scherrer Institut annual report 1994. Annex IV: PSI nuclear energy and safety research progress report 1994

    Energy Technology Data Exchange (ETDEWEB)

    Williams, T.; Kallfelz, J.M.; Mathews, D. [eds.] [Paul Scherrer Inst. (PSI), Villigen (Switzerland)

    1995-10-01

    Nuclear energy research in Switzerland is concentrated at PSI. It is explicitly mentioned in the Institute`s official charter and commands about one fifth of the Institute`s federal resources. Presently, PSI invests approx. 200 py/a in nuclear energy research, one third of this being externally funded; the share of external funding in investment costs totals approx. 50%. This funding is provided by the Swiss utilities and the NAGRA, the Safety Authority (HSK) and the former National Fund for Energy Research (NEFF). PSI`s activities in nuclear research concentrate on three main areas: safety of operating plants, safety features of future reactor concepts and waste management. 7% of personnel are invested in addressing global aspects of energy. (author) figs., tabs., refs.

  13. The institutional space of community initiatives for renewable energy: a comparative case study of the Netherlands, Germany and Denmark

    NARCIS (Netherlands)

    Oteman, M.I.; Wiering, M.A.; Helderman, J.K.

    2014-01-01

    Background Community initiatives for renewable energy are emerging across Europe but with varying numbers, success rates and strategies. A literature overview identifies structural, strategic and biophysical conditions for community success. Our analysis focuses on institutional structure, as we de

  14. US/ECRE and renewable energy market development: An institutional perspective

    Energy Technology Data Exchange (ETDEWEB)

    Siegel, J.M.

    1997-12-01

    The author presents a summary of the structure and program of the US Export Council for Renewable Energy (US/ECRE). This organization was founded in 1982 as a consortium of US renewable energy trade associations, and is the non-profit/industry counterpart of CORECT. It serves to accelerate the diffusion of sustainable renewable energy services worldwide, and to enhance US industry`s position in this expanded marketplace. The projected energy growth in the next 20 years is expected to favor developing countries. Barriers in the way of renewable energy development include technology awareness, financing and risk reception, policy decisions, and institutional barriers. The industrial team hopes to address this problem through several different programs: strategic alliances; end-user outreach; industry market development; policy/project development; financing and facilitation. The program involves several phases: first, market conditioning; second, regional conferences and exhibitions; third, follow-up and implementation. There are currently four major focus areas for US effort: Latin America and the Caribbean; southern Africa; Asia; Russia and the FSU. The status of programs addressed toward these markets is described in more detail.

  15. NATO Advanced Study Institute on Statistical Treatments for Estimation of Mineral and Energy Resources

    CERN Document Server

    Fabbri, A; Sinding-Larsen, R

    1988-01-01

    This volume contains the edited papers prepared by lecturers and participants of the NATO Advanced Study Institute on "Statistical Treatments for Estimation of Mineral and Energy Resources" held at II Ciocco (Lucca), Italy, June 22 - July 4, 1986. During the past twenty years, tremendous efforts have been made to acquire quantitative geoscience information from ore deposits, geochemical, geophys ical and remotely-sensed measurements. In October 1981, a two-day symposium on "Quantitative Resource Evaluation" and a three-day workshop on "Interactive Systems for Multivariate Analysis and Image Processing for Resource Evaluation" were held in Ottawa, jointly sponsored by the Geological Survey of Canada, the International Association for Mathematical Geology, and the International Geological Correlation Programme. Thirty scientists from different countries in Europe and North America were invited to form a forum for the discussion of quantitative methods for mineral and energy resource assessment. Since then, not ...

  16. Environmental Survey preliminary report, National Institute for Petroleum and Energy Research, Bartlesville, Oklahoma

    Energy Technology Data Exchange (ETDEWEB)

    1989-01-01

    This report presents the preliminary findings of the first phase of the Environmental Survey of the US Department of Energy's (DOE) National Institute for Petroleum and Energy Research (NIPER), conducted February 29 through March 4, 1988. The Survey is being conducted by an interdisciplinary team of environmental specialists, led and managed by the Office of Environment, Safety and Health's Office of Environmental Audit. Team members are being provided by private contractors. The objective of the Survey is to identify environmental problems and areas of environmental risk associated with NIPER. The Survey covers all environmental media and all areas of environmental regulation. It is being performed in accordance with the DOE Environmental Survey Manual. The on-site phase of the Survey involves the review of existing site environmental data, observations of the operations carried on at NIPER and interviews with site personnel. 35 refs., 8 figs., 15 tabs.

  17. The genome portal of the Department of Energy Joint Genome Institute: 2014 updates

    Energy Technology Data Exchange (ETDEWEB)

    Nordberg, Henrik [USDOE Joint Genome Institute (JGI), Walnut Creek, CA (United States); Cantor, Michael [USDOE Joint Genome Institute (JGI), Walnut Creek, CA (United States); Dusheyko, Serge [USDOE Joint Genome Institute (JGI), Walnut Creek, CA (United States); Hua, Susan [USDOE Joint Genome Institute (JGI), Walnut Creek, CA (United States); Poliakov, Alexander [USDOE Joint Genome Institute (JGI), Walnut Creek, CA (United States); Shabalov, Igor [USDOE Joint Genome Institute (JGI), Walnut Creek, CA (United States); Smirnova, Tatyana [USDOE Joint Genome Institute (JGI), Walnut Creek, CA (United States); Grigoriev, Igor V. [USDOE Joint Genome Institute (JGI), Walnut Creek, CA (United States); Dubchak, Inna [USDOE Joint Genome Institute (JGI), Walnut Creek, CA (United States)

    2013-11-12

    The U.S. Department of Energy (DOE) Joint Genome Institute (JGI), a national user facility, serves the diverse scientific community by providing integrated high-throughput sequencing and computational analysis to enable system-based scientific approaches in support of DOE missions related to clean energy generation and environmental characterization. The JGI Genome Portal (http://genome.jgi.doe.gov) provides unified access to all JGI genomic databases and analytical tools. The JGI maintains extensive data management systems and specialized analytical capabilities to manage and interpret complex genomic data. A user can search, download and explore multiple data sets available for all DOE JGI sequencing projects including their status, assemblies and annotations of sequenced genomes. In this paper, we describe major updates of the Genome Portal in the past 2 years with a specific emphasis on efficient handling of the rapidly growing amount of diverse genomic data accumulated in JGI.

  18. United States of America activities relative to the International Atomic Energy Agency (IAEA) initiative: Records management for deep geologic repositories

    Energy Technology Data Exchange (ETDEWEB)

    Warner, P.J.

    1997-03-01

    The International Atomic Energy Agency (IAEA) has conducted consultant and advisory meetings to prepare a Technical Document which is intended to provide guidance to all IAEA Member States (otherwise known as countries) that are currently planning, designing, constructing or operating a deep or near surface geological repository for the storage and protection of vitrified high-level radioactive waste, spent fuel waste and TRU-waste (transuranic). Eleven countries of the international community are presently in various stages of siting, designing, or constructing deep geologic repositories. Member States of the IAEA have determined that the principle safety of such completed and operation sites must not rely solely on long term institutional arrangements for the retention of information. It is believed that repository siting, design, operation and postoperation information should be gathered, managed and retained in a manner that will provide information to future societies over a very long period of time. The radionuclide life is 10,000 years thus the retention of information must outlive current societies, languages, and be continually migrated to new technology to assure retrieval. This presentation will provide an overview of the status of consideration and implementation of these issues within the United States efforts relative to deep geologic repository projects.

  19. Concept of effective atomic number and effective mass density in dual-energy X-ray computed tomography

    Energy Technology Data Exchange (ETDEWEB)

    Bonnin, Anne, E-mail: annebonnin@free.fr [ESRF, 6 Jules Horowitz, F-38073 Grenoble Cedex (France); LVA, Vibrations and Acoustic Laboratory, INSA-Lyon, Université de Lyon, F-69621 Villeurbanne Cedex (France); Duvauchelle, Philippe, E-mail: philippe.duvauchelle@insa-lyon.fr [LVA, Vibrations and Acoustic Laboratory, INSA-Lyon, Université de Lyon, F-69621 Villeurbanne Cedex (France); Kaftandjian, Valérie [LVA, Vibrations and Acoustic Laboratory, INSA-Lyon, Université de Lyon, F-69621 Villeurbanne Cedex (France); Ponard, Pascal [Thales Electron Devices SAS, 2 Rue Marcel Dassault, BP23 78141 Vélizy, Villacoublay Cedex (France)

    2014-01-01

    This paper focuses on dual-energy X-ray computed tomography and especially the decomposition of the measured attenuation coefficient in a mass density and atomic number basis. In particular, the concept of effective atomic number is discussed. Although the atomic number is well defined for chemical elements, the definition of an effective atomic number for any compound is not an easy task. After reviewing different definitions available in literature, a definition related to the method of measurement and X-ray energy, is suggested. A new concept of effective mass density is then introduced in order to characterize material from dual-energy computed tomography. Finally, this new concept and definition are applied on a simulated case, focusing on explosives identification in luggage.

  20. Self-Energy Correction to the Two-Photon Decay Width in Hydrogenlike Atoms

    CERN Document Server

    Jentschura, U D

    2004-01-01

    We investigate the gauge invariance of the leading logarithmic radiative correction to the two-photon decay width in hydrogenlike atoms. It is shown that an effective treatment of the correction using a Lamb-shift "potential" leads to equivalent results in both the length as well as the velocity gauges provided all relevant correction terms are taken into account. Specifically, the relevant radiative corrections are related to the energies that enter into the propagator denominators, to the Hamiltonian, to the wave functions, and to the energy conservation condition that holds between the two photons; the form of all of these effects is different in the two gauges, but the final result is shown to be gauge invariant, as it should be. Although the actual calculation only involves integrations over nonrelativistic hydrogenic Green functions, the derivation of the leading logarithmic correction can be regarded as slightly more complex than that of other typical logarithmic terms. The dominant radiative correctio...

  1. Atomic structure of "multilayer silicene" grown on Ag(111): Dynamical low energy electron diffraction analysis

    Science.gov (United States)

    Kawahara, Kazuaki; Shirasawa, Tetsuroh; Lin, Chun-Liang; Nagao, Ryo; Tsukahara, Noriyuki; Takahashi, Toshio; Arafune, Ryuichi; Kawai, Maki; Takagi, Noriaki

    2016-09-01

    We have investigated the atomic structure of the "multilayer silicene" grown on the Ag(111) single crystal surface by using low energy electron diffraction (LEED) and scanning tunneling microscopy (STM). We measured the intensity of the LEED spot as a function of the incident electron energy (I-V curve) and analyzed the I-V curve using a dynamical LEED theory. We have found that the Si(111)(√{ 3} ×√{ 3})-Ag model well reproduces the I-V curve whereas the models consisting of the honeycomb structure of Si do not. The bias dependence of the STM image of multilayer silicene agrees with that of the Si(111)(√{ 3} ×√{ 3})-Ag reconstructed surface. Consequently, we have concluded that the multilayer silicene grown on Ag(111) is identical to the Si(111)(√{ 3} ×√{ 3})-Ag reconstructed structure.

  2. Geothermal research and development program of the US Atomic Energy Commission

    Science.gov (United States)

    Werner, L. B.

    1974-01-01

    Within the overall federal geothermal program, the Atomic Energy Commission has chosen to concentrate on development of resource utilization and advanced research and technology as the areas most suitable to the expertise of its staff and that of the National Laboratories. The Commission's work in geothermal energy is coordinated with that of other agencies by the National Science Foundation, which has been assigned lead agency by the Office of Management and Budget. The objective of the Commission's program, consistent with the goals of the total federal program is to facilitate, through technological advancement and pilot plant operations, achievement of substantial commercial production of electrical power and utilization of geothermal heat by the year 1985. This will hopefully be accomplished by providing, in conjunction with industry, credible information on the economic operation and technological reliability of geothermal power and use of geothermal heat.

  3. Solution of the Energy Level of Hydrogen-Like Atom for the Debye Shidlding Potential

    Institute of Scientific and Technical Information of China (English)

    HUXian-Quan; HUWen-Jiang; 等

    2002-01-01

    The first-order revision and the approximation analytical formula of the energy levels for hydrogen-like atoms under the condition of Debye shielding potential are achieved by means of the Rayleigh-Schroedinger perturbation theory.meanwhile,the corresponding recurrence relations are obtained from the use of the solution of power series,Based on the above solutions and with the use of energy consistent method the equivalent value of second-order reversion under the condition of Debye shielding potential is produced as well and the esult is compared with the data obtained by the numerical method.Besides,the critical bond-state and corresponding cut-off conditions are discussed.

  4. Charge-state-dependent energy loss of slow ions. II. Statistical atom model

    Science.gov (United States)

    Wilhelm, Richard A.; Möller, Wolfhard

    2016-05-01

    A model for charge-dependent energy loss of slow ions is developed based on the Thomas-Fermi statistical model of atoms. Using a modified electrostatic potential which takes the ionic charge into account, nuclear and electronic energy transfers are calculated, the latter by an extension of the Firsov model. To evaluate the importance of multiple collisions even in nanometer-thick target materials we use the charge-state-dependent potentials in a Monte Carlo simulation in the binary collision approximation and compare the results to experiment. The Monte Carlo results reproduce the incident charge-state dependence of measured data well [see R. A. Wilhelm et al., Phys. Rev. A 93, 052708 (2016), 10.1103/PhysRevA.93.052708], even though the experimentally observed charge exchange dependence is not included in the model.

  5. Localized description of surface energy gap effects in the resonant charge exchange between atoms and surfaces

    Energy Technology Data Exchange (ETDEWEB)

    Iglesias-Garcia, A; Garcia, Evelina A; Goldberg, E C, E-mail: aiglesiasg@santafe-conicet.gov.ar [Instituto de Desarrollo Tecnologico para la Industria Quimica (INTEC-CONICET-UNL), Gueemes 3450, CC91, (S3000GLN) Santa Fe (Argentina)

    2011-02-02

    The resonant charge exchange between atoms and surfaces is described by considering a localized atomistic view of the solid within the Anderson model. The presence of a surface energy gap is treated within a simplified tight-binding model of the solid, and a proper calculation of the Hamiltonian terms based on a LCAO expansion of the solid eigenstates is performed. It is found that interference terms jointly with a surface projected gap maximum at the {Gamma} point and the Fermi level inside it, lead to hybridization widths negligible around the Fermi level. This result can explain experimental observations related to long-lived adsorbate states and anomalous neutral fractions of low energy ions in alkali/Cu(111) systems.

  6. Imaging the heliosphere using neutral atoms from solar wind energy down to 15 eV

    Energy Technology Data Exchange (ETDEWEB)

    Galli, A.; Wurz, P. [Physics Institute, University of Bern, Bern 3012 (Switzerland); Fuselier, S. A.; McComas, D. J. [Southwest Research Institute, San Antonio, TX 78228 (United States); Bzowski, M.; Sokół, J. M.; Kubiak, M. A. [Space Research Centre, Polish Academy of Sciences, Warsaw 00-716 (Poland); Möbius, E. [University of New Hampshire, Durham, NH 03824 (United States)

    2014-11-20

    We study the spatial and temporal distribution of hydrogen energetic neutral atoms (ENAs) from the heliosheath observed with the IBEX-Lo sensor of the Interstellar Boundary EXplorer (IBEX) from solar wind energies down to the lowest available energy (15 eV). All available IBEX-Lo data from 2009 January until 2013 June were included. The sky regions imaged when the spacecraft was outside of Earth's magnetosphere and when the Earth was moving toward the direction of observation offer a sufficient signal-to-noise ratio even at very low energies. We find that the ENA ribbon—a 20° wide region of high ENA intensities—is most prominent at solar wind energies whereas it fades at lower energies. The maximum emission in the ribbon is located near the poles for 2 keV and closer to the ecliptic plane for energies below 1 keV. This shift is an evidence that the ENA ribbon originates from the solar wind. Below 0.1 keV, the ribbon can no longer be identified against the globally distributed ENA signal. The ENA measurements in the downwind direction are affected by magnetospheric contamination below 0.5 keV, but a region of very low ENA intensities can be identified from 0.1 keV to 2 keV. The energy spectra of heliospheric ENAs follow a uniform power law down to 0.1 keV. Below this energy, they seem to become flatter, which is consistent with predictions. Due to the subtraction of local background, the ENA intensities measured with IBEX agree with the upper limit derived from Lyα observations.

  7. Interactions and low energy collisions between an alkali ion and an alkali atom of different nucleus

    CERN Document Server

    Rakshit, Arpita; Berriche, Hamid; Deb, Bimalendu

    2015-01-01

    We study theoretically interaction potentials and low energy collisions between different alkali atoms and alkali ions. Specifically, we consider systems like X + Y$^{+}$, where X(Y$^{+})$ is either Li(Cs$^+$) or Cs((Li$^+$), Na(Cs$^+$) or Cs(Na$^+$) and Li(Rb$^+$) or Rb(Li$^+$). We calculate the molecular potentials of the ground and first two excited states of these three systems using pseudopotential method and compare our results with those obtained by others. We calculate ground-state scattering wave functions and cross sections of these systems for a wide range of energies. We find that, in order to get convergent results for the total scattering cross sections for energies of the order $1$ K, one needs to take into account at least 60 partial waves. In the low energy limit ($< 1 \\mu$K), elastic scattering cross sections exhibit Wigner law threshold behavior while in the high energy limit the cross sections go as $E^{-1/3}$. We discuss qualitatively the possibilities of forming cold molecular ion by ...

  8. Saving of electrical energy in educative institutions; Ahorro de energia electrica en instituciones educativas

    Energy Technology Data Exchange (ETDEWEB)

    Castillo Medina, Gabino [Instituto Tecnologico y de Estudios Superiores de Monterrey Campus Estado de Mexico, (Mexico)

    2003-07-01

    The present work looks for integrating the actions of energy saving that can be applied in educative institutions, not concerning the level or size of the same ones. The actions go from questions of making aware the student population until those involved in the change in the operation, migration and implementation of technology. Without overlooking the formative aspect that the educative institutions have and the social commitment of these last ones. It is important that the saving measures have as mission to achieve a culture focussed to make efficient use of the resources, of energy as well as material. This culture must be born from the classrooms and must transform the way to be and act of the student community that will permeate itself with the society. Let us remember that actions are worth more than words, so the educative institutions must preach with the example. [Spanish] El presente trabajo busca integrar las acciones de ahorro de energia que pueden ser aplicadas en instituciones educativas, no importando el nivel o tamano de las mismas. Las acciones van desde cuestiones de concienciar a la poblacion estudiantil hasta las que involucran el cambio en la operacion, migracion e implementacion de tecnologia. Sin perder de vista el aspecto formativo que tienen las instituciones educativas y el compromiso social de estas ultimas. Es importante que las medidas de ahorro tengan como mision lograr una cultura enfocada a hacer uso eficiente de los recursos, tanto energeticos como materiales. Dicha cultura debe nacer desde las aulas y debe transformar la manera de ser y actuar, de la comunidad estudiantil que se permeara con la sociedad. Recordemos que las acciones valen mas que las palabras, asi que las instituciones educativas deben predicar con el ejemplo.

  9. Incorporating the nuclear vibrational energies into the -atom in molecules- analysis: An analytical study

    CERN Document Server

    Gharabaghi, Masumeh

    2016-01-01

    The orthodox quantum theory of atoms in molecules (QTAIM) is based on the clamped nucleus paradigm and working solely with the electronic wavefunctions, so unable to include nuclear vibrations in the AIM analysis. On the other hand, the recently extended version of the QTAIM, called the multi-component QTAIM (MC-QTAIM), incorporates both electrons and quantum nuclei, i.e. those nuclei treated as quantum waves instead of clamped point charges, into the AIM analysis using non-adiabatic wavefunctions. Thus, the MC-QTAIM is the natural framework to incorporate the role of nuclear vibrations into the AIM analysis. In this study, within the context of the MC-QTAIM, the formalism of including nuclear vibrational energy in the atomic basin energy is developed in detail and its contribution is derived analytically using the recently proposed non-adiabatic Hartree product nuclear wavefunction. It is demonstrated that within the context of this wavefunction the quantum nuclei may be conceived pseudo-adiabatically as qua...

  10. Pairwise energies for polypeptide coarse-grained models derived from atomic force fields

    Science.gov (United States)

    Betancourt, Marcos R.; Omovie, Sheyore J.

    2009-05-01

    The energy parametrization of geometrically simplified versions of polypeptides, better known as polypeptide or protein coarse-grained models, is obtained from molecular dynamics and statistical methods. Residue pairwise interactions are derived by performing atomic-level simulations in explicit water for all 210 pairs of amino acids, where the amino acids are modified to closer match their structure and charges in polypeptides. Radial density functions are computed from equilibrium simulations for each pair of residues, from which statistical energies are extracted using the Boltzmann inversion method. The resulting models are compared to similar potentials obtained by knowledge based methods and to hydrophobic scales, resulting in significant similarities in spite of the model simplicity. However, it was found that glutamine, asparagine, lysine, and arginine are more attractive to other residues than anticipated, in part, due to their amphiphilic nature. In addition, equally charged residues appear more repulsive than expected. Difficulties in the calculation of knowledge based potentials and hydrophobicity scale for these cases, as well as sensitivity of the force field to polarization effects are suspected to cause this discrepancy. It is also shown that the coarse-grained model can identify native structures in decoy databases nearly as well as more elaborate knowledge based methods, in spite of its resolution limitations. In a test conducted with several proteins and corresponding decoys, the coarse-grained potential was able to identify the native state structure but not the original atomic force field.

  11. Addressing the Need for Alternative Transportation Fuels: The Joint BioEnergy Institute

    Energy Technology Data Exchange (ETDEWEB)

    Blanch, Harvey; Adams, Paul; Andrews-Cramer, Katherine; Frommer, Wolf; Simmons, Blake; Keasling, Jay

    2008-01-18

    activity of enzymes used to deconstruct biomass, and the inhibitory effect of fuels and processing byproducts on organisms responsible for producing fuels from biomass monomers. The Joint BioEnergy Institute (JBEI) is a U.S. Department of Energy (DOE) Bioenergy Research Center that will address these roadblocks in biofuels production. JBEI draws on the expertise and capabilities of three national laboratories (Lawrence Berkeley National Laboratory (LBNL), Sandia National Laboratories (SNL), and Lawrence Livermore National Laboratory (LLNL)), two leading U.S. universities (University of California campuses at Berkeley (UCB) and Davis (UCD)), and a foundation (Carnegie Institute for Science, Stanford) to develop the scientific and technological base needed to convert the energy stored in lignocellulose into transportation fuels and commodity chemicals. Established scientists from the participating organizations are leading teams of researchers to solve the key scientific problems and develop the tools and infrastructure that will enable other researchers and companies to rapidly develop new biofuels and scale production to meet U.S. transportation needs and to develop and rapidly transition new technologies to the commercial sector. JBEI's biomass-to-biofuels research approach is based in three interrelated scientific divisions and a technologies division. The Feedstocks Division will develop improved plant energy crops to serve as the raw materials for biofuels. The Deconstruction Division will investigate the conversion of this lignocellulosic plant material to sugar and aromatics. The Fuels Synthesis Division will create microbes that can efficiently convert sugar and aromatics into ethanol and other biofuels. JBEI's cross-cutting Technologies Division will develop and optimize a set of enabling technologies including high-throughput, chipbased, and omics platforms; tools for synthetic biology; multi-scale imaging facilities; and integrated data analysis to

  12. Intrinsic Resolution of Molecular Electronic Wave Functions and Energies in Terms of Quasi-atoms and Their Interactions.

    Science.gov (United States)

    West, Aaron C; Schmidt, Michael W; Gordon, Mark S; Ruedenberg, Klaus

    2017-02-09

    A general intrinsic energy resolution has been formulated for strongly correlated wave functions in the full molecular valence space and its subspaces. The information regarding the quasi-atomic organization of the molecular electronic structure is extracted from the molecular wave function without introducing any additional postulated model state wave functions. To this end, the molecular wave function is expressed in terms of quasi-atomic molecular orbitals, which maximize the overlap between subspaces of the molecular orbital space and the free-atom orbital spaces. As a result, the molecular wave function becomes the superposition of a wave function representing the juxtaposed nonbonded quasi-atoms and a wave function describing the interatomic electron migrations that create bonds through electron sharing. The juxtaposed nonbonded quasi-atoms are shown to consist of entangled quasi-atomic states from different atoms. The binding energy is resolved as a sum of contributions that are due to quasi-atom formation, quasiclassical electrostatic interactions, and interatomic interferences caused by electron sharing. The contributions are further resolved according to orbital interactions. The various transformations that generate the analysis are determined by criteria that are independent of the working orbital basis used for calculating the molecular wave function. The theoretical formulation of the resolution is quantitatively validated by an application to the C2 molecule.

  13. NATO Advanced Study Institute on Magnetic Resonance : Introduction, Advanced Topics and Applications to Fossil Energy

    CERN Document Server

    Fraissard, Jacques

    1984-01-01

    This volume contains the lectures presented at an Advanced Study Institute on "Magnetic Resonance Techniques in Fossil Energy Problems," which was held at the village of Maleme, Crete, in July of 1983. As of this writing, a different popular attitude prevails from that when the ASI was proposed as far as how critical the world energy picture is. In the popular press, a panglossian attitude (the "petroleum glut" of the 80's) has replaced the jeremiads of the 70's ( a catastrophic "energy crisis"). Yet, there are certain important constants: (a) for the foreseeable future, fossil energy sources (petroleum, coal, oil shale, etc. ) will continue to be of paramount importance; and (b) science and technology of the highest order are needed to extend the fossil ener~y resource base and to utilize it in a cost-effective manner that is also environmentally acceptable. It is precisely this second item that this volume addresses. The volume introduces the phenomenology of magnetic resonance ~n a unified and detailed man...

  14. Observing Planets and Small Bodies in Sputtered High Energy Atom (SHEA) Fluxes

    Science.gov (United States)

    Milillo, A.; Orsini, S.; Hsieh, K. C.; Baragiola, R.; Fama, M.; Johnson, R.; Mura, A.; Plainaki, Ch.; Sarantos, M.; Cassidy, T. A.; DeAngelis, E; Desai, M.; Goldstein, R.; Lp, W.-H.; Killen, R.; Livi, S.

    2012-01-01

    The evolution of the surfaces of bodies unprotected by either strong magnetic fields or thick atmospheres in the Solar System is caused by various processes, induced by photons, energetic ions and micrometeoroids. Among these processes, the continuous bombardment of the solar wind or energetic magnetospheric ions onto the bodies may significantly affect their surfaces, with implications for their evolution. Ion precipitation produces neutral atom releases into the exosphere through ion sputtering, with velocity distribution extending well above the particle escape limits. We refer to this component of the surface ejecta as sputtered high-energy atoms (SHEA). The use of ion sputtering emission for studying the interaction of exposed bodies (EB) with ion environments is described here. Remote sensing in SHEA in the vicinity of EB can provide mapping of the bodies exposed to ion sputtering action with temporal and mass resolution. This paper speculates on the possibility of performing remote sensing of exposed bodies using SHEA The evolution of the surfaces of bodies unprotected by either strong magnetic fields or thick atmospheres in the Solar System is caused by various processes, induced by photons, energetic ions and micrometeoroids. Among these processes, the continuous bombardment of the solar wind or energetic magnetospheric ions onto the bodies may significantly affect their surfaces, with implications for their evolution. Ion precipitation produces neutral atom releases into the exosphere through ion sputtering, with velocity distribution extending well above the particle escape limits. We refer to this component of the surface ejecta as sputtered high-energy atoms (SHEA). The use of ion sputtering emission for studying the interaction of exposed bodies (EB) with ion environments is described here. Remote sensing in SHEA in the vicinity of EB can provide mapping of the bodies exposed to ion sputtering action with temporal and mass resolution. This paper

  15. Background report for the formerly utilized Manhattan Engineer District/Atomic Energy Commission sites program

    Energy Technology Data Exchange (ETDEWEB)

    None

    1980-09-01

    The Department of Energy is conducting a program to determine radiological conditions at sites formerly used by the Army Corps of Engineers' Manhattan Engineer District and the Atomic Energy Commission in the early years of nuclear energy development. Also included in the program are sites used in the Los Alamos plutonium development program and the Trinity atomic bomb test site. Materials, equipment, buildings, and land became contaminated, primarily with naturally occurring radioactive nuclides. They were later decontaminated in accordance with the standards and survey methods in use at that time. Since then, however, radiological criteria, and proposed guidelines for release of such sites for unrestricted use have become more stringent as research on the effects of low-level radiation has progressed. In addition, records documenting some of these decontamination efforts cannot be found, and the final radiological conditions of the sites could not be adequately determined from the records. As a result, the Formerly Utilized Sites Program was initiated in 1974 to identify these formerly used sites and to reevaluate their radiological status. This report covers efforts through June 1980 to determine the radiological status of sites for which the existing conditions could not be clearly defined. Principal contractor facilities and associated properties have already been identified and activities are continuing to identify additional sites. Any new sites located will probably be subcontractor facilities and areas used for disposal of contractor waste or equipment; however, only limited information regarding this equipment and material has been collected to date. As additional information becomes available, supplemental reports will be published.

  16. 10 CFR 8.2 - Interpretation of Price-Anderson Act, section 170 of the Atomic Energy Act of 1954.

    Science.gov (United States)

    2010-01-01

    ... upon the legislative history, stated that the problem of a reactor accident in the United States... Atomic Energy Act of 1954. 8.2 Section 8.2 Energy NUCLEAR REGULATORY COMMISSION INTERPRETATIONS § 8.2... caused outside the United States by a nuclear incident occurring within the United States. (b)...

  17. Dependence of the atomic energy levels on a superstrong magnetic field with account of a finite nucleus radius and mass

    Science.gov (United States)

    Godunov, S. I.; Vysotsky, M. I.

    2013-06-01

    The influence of the finiteness of the proton radius and mass on the energies of a hydrogen atom and hydrogenlike ions in a superstrong magnetic field is studied. The finiteness of the nucleus size pushes the ground energy level up leading to a nontrivial dependence of the value of the critical nucleus charge on the external magnetic field.

  18. A new exact quantum mechanical rovibrational kinetic energy operator for penta-atomic systems in internal coordinates

    Institute of Scientific and Technical Information of China (English)

    陈光巨; 李玉学

    1999-01-01

    The concrete molecule-fixed (MF) kinetic energy operator for penta-atomic molecules is expressed in terms of the parameterδ, the matrix element G?, and angular momentum operator (?). The applications of the operator are also discussed. Finally, a general compact form of kinetic energy operator suitable for calculating the rovibrational spectra of polyatomie molecules is presented.

  19. Influence on electron energy loss spectroscopy of the niobium-substituted uranium atom: A density functional theory study

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    We present the electronic structure and electron energy loss spectroscopy (EELS) for uranium, niobium and U3Nb in which uranium is substituted by niobium. Comparing the electronic structures and optical properties for uranium, niobium and U3Nb, we found that when niobium atom replaces uranium atom in the center lattice, density of state (DOS) of U3Nb shifts downward to low energy. Niobium affects DOS forfand d electrons more than that for p and s electrons. U3Nb is similar to uranium for the electronic energy loss spectra.

  20. Precise atomic-scale investigations of material sputtering process by light gas ions in pre-threshold energy region

    CERN Document Server

    Suvorov, A L

    2002-01-01

    Foundation and prospects of the new original technique of the sputtering yield determination of electro-conducting materials and sub-atomic layers on their surface by light gas ions the pre-threshold energy region (from 10 to 500 eV) are considered. The technique allows to identify individual surface vacancies, i.e., to count individual sputtered atoms directly. A short review of the original results obtained by using the developed techniques is given. Data are presented and analyzed concerning energy thresholds of the sputtering onset and energy dependences of sputtering yield in the threshold energy region for beryllium, tungsten, tungsten oxide, alternating tungsten-carbon layers, three carbon materials as well as for sub-atomic carbon layers on surface of certain metals at their bombardment by hydrogen, deuterium and/or helium ions

  1. Collisions of low-energy antiprotons and protons with atoms and molecules

    Energy Technology Data Exchange (ETDEWEB)

    Luehr, Armin

    2010-02-18

    Antiproton (anti p) collisions have evolved to a powerful tool for the testing of dynamic electron correlations in atoms and molecules. While advances in the understanding of anti p collisions with the simplest one- and two-electron atoms, H and He, have been achieved experiment and theory did not agree for low-energy anti p+He collisions (<40 keV), stimulating a vivid theoretical activity. On the other hand, only very few theoretical anti p studies can be found considering molecular as well as other atomic targets, in contrast to proton (p) collisions. This is in particular true for anti p impacts on H{sub 2} despite its fundamental role in representing the simplest two-electron molecule. The obtained results may be useful for the anti p experiments at CERN (e.g., antihydrogen production) and in particular for the facility design of low-energy anti p storage rings (e.g., at FLAIR) where a precise knowledge of the anti p interaction with the dominant residual-gas molecule H{sub 2} is needed. In this work a nonperturbative, time-dependent numerical approach is developed which describes ionization and excitation of atoms or molecules by either anti p or p impact based on the impact-parameter method. A spectral close-coupling method is employed for solving the time-dependent Schroedinger equation in which the scattering wave function is expanded in (effective) one- or two-electron eigenstates of the target. This includes for the first time a full two-electron, two-center description of the H{sub 2} molecule in anti p collisions. The radial part of the one-electron eigenstates is expanded in B splines while the two-electron basis is obtained with a configurationinteraction approach. Calculations are performed for anti p collisions with H, H{sub 2}{sup +}, and H{sub 2} as well as with He and alkali-metal atoms Li, Na, K, and Rb. Additionally, data are obtained for p collisions with H{sub 2}, Li, Na, and K. The developed method is tested and validated by detailed

  2. Oak Ridge Institute for Science and Education: A guide to record series supporting epidemiologic studies conducted for the Department of Energy

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    1995-07-17

    This guide describes record series that pertain to epidemiologic and health-related studies at the Center for Epidemiologic Research (CER) of the Oak Ridge Institute for Science and Education (ORISE). These records document the health and safety monitoring of employees and contract employees of the Department of Energy (DOE) and its predecessor organizations, the Manhattan Engineer District (MED), the Atomic Energy Commission (AEC), and the Energy Research and Development Administration (ERDA). History Associates Incorporated (HAI) prepared this guide as part of DOE`s Epidemiologic Records Inventory Project. This introduction briefly describes the Epidemiologic Records Inventory Project, HAI`s role in the project, the history of the DOE and its epidemiologic research program, and the history of the Oak Ridge Reservation and the Oak Ridge Institute for Science and Education. It also furnishes information on the procedures that HAI sued to select, inventory, and describe pertinent records; the methodology used to produce the guide; the arrangement of the record series descriptions; the location of the records; and procedures for accessing records repositories.

  3. Groundwater assessment in water resources management at Nuclear and Energy Research Institute, Brazil

    Energy Technology Data Exchange (ETDEWEB)

    Soares, Sabrina M.V.; Marques, Joyce R.; Monteiro, Lucilena R.; Stellato, Thamiris B.; Silva, Tatiane B.S.C.; Faustino, Mainara G.; Silva, Douglas B. da; Cotrim, Marycel E.B.; Pires, Maria Aparecida F., E-mail: sabrinamoura@usp.br, E-mail: joyce.marques@usp.br, E-mail: luciremo@uol.com.br, E-mail: thamistellato@gmail.com, E-mail: tatianebscs@live.com, E-mail: mainarag@usp.br, E-mail: douglas.sbatista@yahoo.com.br, E-mail: mecotrim@ipen.br, E-mail: mapires@ipen.br [Instituto de Pesquisas Energeticas e Nucleares (IPEN/CNEN-SP), Sao Paulo, SP (Brazil)

    2015-07-01

    To comply with the guidelines for environmental control and legal requirements, the Nuclear and Energy Research Institute (IPEN/ CNEN - Brazil/ SP) performs the Environmental Monitoring Program for Chemical Stable Compounds (PMA-Q) since 2007, in attendance to the Term for the Adjustment of Conduct (TAC) signed between IPEN and the Brazilian Institute of Environment and Renewable Natural Resources (IBAMA). The PMA-Q program includes the assessment of the IPEN's wastewater released in water body, and the groundwater assessment, which is carried out in nine monitoring wells. In groundwater is analyzed, by ion chromatography, species regulated by CONAMA 396/08 [01] fluoride, chloride, nitrite-N, nitrate-N, sulfate, sodium, potassium, ammonium, magnesium and calcium, besides other parameters. Furthermore, based on legal requirements, each year the program is reviewed and improvement actions are planned and implemented. Therefore, the integrated monitoring of groundwater should provide information on the quality and dynamics of the aquifer compared to seasonal variations and anthropogenic effects. Thus, this study intends to evaluate the chemical features of the institute groundwater, evaluating the database of the monitoring program from 2011 to 2014, for the ions chloride, nitrate-N, sulfate, sodium, potassium, magnesium, calcium and bicarbonate, using these information diagrams will be developed for the characterization of the wells. This assessment will be essential to support the control actions of environmental pollution and the management of water resources. Making possible the establishment of groundwater Quality Reference Figures (QRF), according to the CONAMA 396/08 [01] rating, in order to demonstrate that the activities developed at IPEN are not affecting on the aquifer features. (author)

  4. Energy Landscape of Alginate-Epimerase Interactions Assessed by Optical Tweezers and Atomic Force Microscopy.

    Directory of Open Access Journals (Sweden)

    Armend Gazmeno Håti

    Full Text Available Mannuronan C-5 epimerases are a family of enzymes that catalyze epimerization of alginates at the polymer level. This group of enzymes thus enables the tailor-making of various alginate residue sequences to attain various functional properties, e.g. viscosity, gelation and ion binding. Here, the interactions between epimerases AlgE4 and AlgE6 and alginate substrates as well as epimerization products were determined. The interactions of the various epimerase-polysaccharide pairs were determined over an extended range of force loading rates by the combined use of optical tweezers and atomic force microscopy. When studying systems that in nature are not subjected to external forces the access to observations obtained at low loading rates, as provided by optical tweezers, is a great advantage since the low loading rate region for these systems reflect the properties of the rate limiting energy barrier. The AlgE epimerases have a modular structure comprising both A and R modules, and the role of each of these modules in the epimerization process were examined through studies of the A- module of AlgE6, AlgE6A. Dynamic strength spectra obtained through combination of atomic force microscopy and the optical tweezers revealed the existence of two energy barriers in the alginate-epimerase complexes, of which one was not revealed in previous AFM based studies of these complexes. Furthermore, based on these spectra estimates of the locations of energy transition states (xβ, lifetimes in the absence of external perturbation (τ0 and free energies (ΔG# were determined for the different epimerase-alginate complexes. This is the first determination of ΔG# for these complexes. The values determined were up to 8 kBT for the outer barrier, and smaller values for the inner barriers. The size of the free energies determined are consistent with the interpretation that the enzyme and substrate are thus not tightly locked at all times but are able to relocate

  5. Impact of international financial institutions on markets for solar energy systems

    Energy Technology Data Exchange (ETDEWEB)

    Day, J.F. III; Sacks, R.

    1979-10-01

    In support of the International Photovoltaic Program Plan prepared for DOE by SERI, Strategies Unlimited has conducted a study to assess the impact of international financial institutions on the markets for solar electric systems, especially on photovoltaic power systems. This report reviews the sources and uses of funds for economic development in the Third World. The origin of development funds since 1970 is quantified, the channels through which funds reach the developing countries are examined, and the economic sectors within the developing countries where funds are applied are detailed. This report includes a review of the World Bank, principal regional development banks, OPEC institutions, US Export-Import Bank, principal US commercial banks, and the Euro-currency markets of the world as they finance the developing world. Both concessional and nonconcessional transfers are identified, including both official and private sources. Development bank loan practices are reviewed, including an analysis of sectors, priorities, and trends. US commercial bank international activities are reviewed including the identification of bank exposure by developing country. The report also discusses selected solar energy projects funded by the development banks. Recommendations are prepared for government policy to accelerate the widespread use of photovoltaic systems in international markets.

  6. Estimation of metal pollutant loads from Nuclear and Energy Research Institute (Brazil)

    Energy Technology Data Exchange (ETDEWEB)

    Marques, Joyce R.; Monteiro, Lucilena R.; Soares, Sabrina M.V.; Stellato, Thamiris B.; Silva, Tatiane B.S.C.; Silva, Douglas B. da; Faustino, Mainara G.; Pires, Maria A.F.; Cotrim, Marycel E.B., E-mail: joyce.marques@usp.br [Instituto de Pesquisas Energeticas e Nucleares (IPEN/CNEN-SP), Sao Paulo, SP (Brazil)

    2015-07-01

    According to National Environmental Council's (CONAMA) Resolution 357/05, pollutant load can be defined as the amount of a particular pollutant released in receiving water body; it is commonly expressed in a mass-time ratio. As specified in CONAMA's Resolution 430/11, the responsible for the pollutant source must present the Pollutant Load Declaration to environmental authorities. However, pollutant load knowledge is also important to the water quality maintenance and its environmental rating that must be kept to meet the requirements of the most restrictive use. In the control of metals releases is also important due public health matters, since they can cause harmful environmental contamination and major public health issues. Therefore this work aims to present the estimated metal pollutant load released by Nuclear and Energy Research Institute (IPEN/CNEN - Brazil), between 2013 and 2014. Results of cadmium, lead, copper, chromium, zinc, nickel, manganese, iron, barium, silver, boron and tin in composite samples (weekly) via Inductively Coupled Plasma Optical Emission Spectrometry (ICP-OES) and bromide (Br-) released as a tracer, to measure the wastewater flow were used to estimate IPEN's Metal Pollutant load. This study is part of the environmental assessment Program at IPEN, instituted since 2006 to the attendance of the current environmental legislation (CONAMA's Resolution 430/11, Article 19-A of State Decree 8.468/76 and State Decree 15.425/80). (author)

  7. Status of contamination monitoring in radiation activities of National Atomic Energy Agency (NAEA) in Indonesia

    Energy Technology Data Exchange (ETDEWEB)

    Suhariyono, Gatot [National Atomic Energy Agency, Jakarta (Indonesia)

    1997-06-01

    National Atomic Energy Agency (NAEA) or Badan Tenaga Atom Nasional (BATAN) is a non departmental governmental agency, headed by a Director General who is directly responsible to the President. Center for Standardization and Radiation Safety Research (CSRSR) is one of the research centers within the deputy for the assessment of nuclear science and technology of the NAEA. The main task of the CSRSR is to implement research and development program, development and services in the field of radiation safety, standardization, dosimetry, radiation health as well as the application of nuclear techniques in medicine, according to the policy confirmed by the director general of BATAN. Task of radiation protection division is to set up programs and to develop radiation protection, personal monitoring system and radiation level of the working areas and their surroundings as well as dose limitation system, to carry out technical up grading of radiation protection officials skill and to help coping with radiation accident. The key factor on contamination monitoring is to reduce human error and mechanical failures. These problems can be achieved to the highest degree by developing knowledge and skill of staffs via trainings or courses on contamination and decontamination, so that they are hoped to become trained and qualified staffs. (G.K.)

  8. A terrestrial search for dark contents of the vacuum, such as dark energy, using atom interferometry

    CERN Document Server

    Adler, Ronald J; Perl, Martin L

    2011-01-01

    We describe the theory and first experimental work on our concept for searching on earth for the presence of dark content of the vacuum (DCV) using atom interferometry. Specifically, we have in mind any DCV that has not yet been detected on a laboratory scale, but might manifest itself as dark energy on the cosmological scale. The experimental method uses two atom interferometers to cancel the effect of earth's gravity and diverse noise sources. It depends upon two assumptions: first, that the DCV possesses some space inhomogeneity in density, and second that it exerts a sufficiently strong non-gravitational force on matter. The motion of the apparatus through the DCV should then lead to an irregular variation in the detected matter-wave phase shift. We discuss the nature of this signal and note the problem of distinguishing it from instrumental noise. We also discuss the relation of our experiment to what might be learned by studying the noise in gravitational wave detectors such as LIGO.The paper concludes ...

  9. Greatly enhanced intensity-difference squeezing via energy-level modulations in hot atomic media

    CERN Document Server

    Zhang, Da; Zhang, Zhaoyang; Zhang, Yiqi; Zhang, Yanpeng; Xiao, Min

    2016-01-01

    Narrow-band intensity-difference squeezing (IDS) beams have important applications in quantum metrology and quantum information. The best way to generate narrow-band IDS is to employ parametrically-amplified (PA) four-wave mixing (FWM) process in high-gain atomic media. Such IDS can be further enhanced by cascading multiple PA-FWM processes in separate atomic media. The complicated experimental setup, added losses and mechanical stability can limit the wide uses of such scheme in practical applications. Here, we show that by modulating/dressing the internal energy level(s) with additional laser(s), the degree of original IDS can be substantially increased. With an initial IDS of $-4.0\\pm0.1$ dB using PA-non-degenerate-FWM process in a three-level $\\Lambda$-type configuration, the degree of IDS can be enhanced to $-7.0\\pm0.1$ dB/$-8.1\\pm0.1$ dB when we use one/two laser beam(s) to modulate the involved ground/excited state(s). Our results show a low-loss, robust and efficient way to produce high degree of IDS ...

  10. Lyman- photodissociation of CH3CFCl2 (HCFC-141b): Quantum yield and translational energy of hydrogen atoms

    Indian Academy of Sciences (India)

    Almuth Laeuter; Hans-Robert Volpp; Jai P Mittal; Rajesh K Vatsa

    2007-07-01

    The collision-free, room temperature gas-phase photodissociation dynamics of CH3CFCl2 (HCFC-141b) was studied using Lyman- laser radiation (121.6 nm) by the laser photolysis/laserinduced fluorescence `pump/probe’ technique. Lyman- radiation was used both to photodissociate the parent molecule and to detect the nascent H atom products via (22P → 12S) laser-induced fluorescence. Absolute H atom quantum yield, H = (0.39 ± 0.09) was determined by calibration method in which CH4 photolysis at 121.6 nm was used as a reference source of well-defined H atom concentrations. The line shapes of the measured H atom Doppler profiles indicate a Gaussian velocity distribution suggesting the presence of indirect H atom formation pathways in the Lyman- photodissociation of CH3CFCl2. The average kinetic energy of H atoms calculated from Doppler profiles was found to be T(lab) = (50 ± 3) kJ/mol. The nearly statistical translational energy together with the observed Maxwell-Boltzmann velocity distribution indicates that for CH3CFCl2 the H atom forming dissociation process comes closer to the statistical limit.

  11. Molecular Dynamics Study on Interfacial Energy and Atomic Structure of Ag/Ni and Cu/Ni Heterophase System

    Institute of Scientific and Technical Information of China (English)

    Haijiang LIU; Shaoqing WANG; An DU; Caibei ZHANG

    2004-01-01

    The results of molecular dynamics calculations on the interfacial energies and atomic structures of Ag/Ni and Cu/Ni interaces are presented. Calculation on Ag/Ni interfaces with low-index planes shows that those containing the (111) plane have the lowest energies, which is in agreement with the experiments. Comparing surface energy with interracial energy, it is found the order of the interfacial energies of Ag/Ni and Cu/Ni containing the planes fall in the same order as solid-vapor surface energies of Ag, Cu and Ni. In this MD simulation, the relaxed atomic structure and dislocation network of (110)Ag||(110)Ni interface are coincident to HREM observations.

  12. Latitude, Energy, and Time Variations of Energetic Neutral Atom Spectral indices Measured by IBEX

    Science.gov (United States)

    Desai, Mihir; Heerikhuisen, Jacob; McComas, David; Funsten, Herbert; Pogorelov, Nikolai; Zank, Gary; Schwadron, Nathan; Fuselier, Stephen; Allegrini, Frederic; Dayeh, Maher A.

    2016-07-01

    We investigate the latitude, energy, and time variations of the globally distributed 0.5-6 keV energetic neutral atom (ENA) spectra measured by the Interstellar Boundary Explorer (IBEX) during the first 5 years of the mission. Our previous results based on the first 3 years of IBEX observations showed that the ENA spectral indices at the two lowest energies (0.89 and 1.47 keV) exhibit no clear trend with ecliptic latitude θ, while those at ˜2.29 and ˜3.41 keV exhibit a clear latitudinal pattern; flatter spectra occur above 60° latitude and steeper spectra occur within ±30° of the equator. While these results confirmed the previously reported latitudinal organization of the ENA spectra and their remarkable similarity to that of the solar wind (SW) speed observed by Ulysses in the inner heliosphere, we also showed that, unlike previous reports, the ˜0.5-6 keV globally distributed ENA spectral indices could not be represented as single power laws over much of the sky, and that they depend on energy and latitude. In this paper we extend the above results to include years 4 and 5 of IBEX observations and investigate if the spectral indices vary as a function of time. Finally, we discuss implications of our results on models and simulations that seek to map the IBEX ENA observations back to the latitudinal profile of the SW speed structure observed in the inner heliosphere.

  13. Atoms in Agriculture

    Energy Technology Data Exchange (ETDEWEB)

    Osborne, Thomas S. [University of Tennessee

    1965-01-01

    Agriculture benefits from the applications of research. Radioactive techniques have been used to study soils, plants, microbes, insects, farm animals, and new ways to use and preserve foodstuffs. Radioactive atoms are not used directly by farmers but are used in research directed by the U. S. Department of Agriculture and Atomic Energy Commission, by the agricultural experiment stations of the various states, and by numerous public and private research institutions. From such research come improved materials and methods which are used on the farm.

  14. Testing the validity of the International Atomic Energy Agency (IAEA) safety culture model.

    Science.gov (United States)

    López de Castro, Borja; Gracia, Francisco J; Peiró, José M; Pietrantoni, Luca; Hernández, Ana

    2013-11-01

    This paper takes the first steps to empirically validate the widely used model of safety culture of the International Atomic Energy Agency (IAEA), composed of five dimensions, further specified by 37 attributes. To do so, three independent and complementary studies are presented. First, 290 students serve to collect evidence about the face validity of the model. Second, 48 experts in organizational behavior judge its content validity. And third, 468 workers in a Spanish nuclear power plant help to reveal how closely the theoretical five-dimensional model can be replicated. Our findings suggest that several attributes of the model may not be related to their corresponding dimensions. According to our results, a one-dimensional structure fits the data better than the five dimensions proposed by the IAEA. Moreover, the IAEA model, as it stands, seems to have rather moderate content validity and low face validity. Practical implications for researchers and practitioners are included.

  15. Solid Hydrogen Experiments for Atomic Propellants: Particle Formation Energy and Imaging Analyses

    Science.gov (United States)

    Palaszewski, Bryan

    2002-01-01

    This paper presents particle formation energy balances and detailed analyses of the images from experiments that were conducted on the formation of solid hydrogen particles in liquid helium during the Phase II testing in 2001. Solid particles of hydrogen were frozen in liquid helium and observed with a video camera. The solid hydrogen particle sizes and the total mass of hydrogen particles were estimated. The particle formation efficiency is also estimated. Particle sizes from the Phase I testing in 1999 and the Phase II testing in 2001 were similar. Though the 2001 testing created similar particles sizes, many new particle formation phenomena were observed. These experiment image analyses are one of the first steps toward visually characterizing these particles and it allows designers to understand what issues must be addressed in atomic propellant feed system designs for future aerospace vehicles.

  16. Cell Evolutionary Algorithm: a New Optimization Method on Ground-State Energy of the Atomic

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    The purpose of this paper is to present a new general approach to solve ground-state energies of the double-electron systems in a uniform magnetic field, in which the basic element of evolution is the set in the solution space, rather than the point. The paper defines the Cell Evolutionary Algorithm, which imple-ments such a view of the evolution mechanism. First, the optimal set in which the optimal solution may be ob-tained. Then this approach applies the embedded search method to get the optimal solution. We tested this approach on the atomic structure, and the results show that it can improve not only the efficiency but also the accuracy of the calculations as it relates to this specific problem.

  17. Disposal of radioactive wastes arising in the United Kingdom from the peaceful uses of atomic energy

    CERN Document Server

    Bryant, P M

    1971-01-01

    This paper describes United Kingdom policy in relation to radioactive waste and summarises the relevant legislation ad methods of control. Data are given on the amounts of radioactivity discharged as waste from establishments of the United Kingdom Atomic Energy Authority, the nuclear power stations operated by the Electricity Generating Boards and other users of radioactive materials. Studies of the behaviour of radioactivity in the environment are reported with particular reference to food chains and other potential sources of irradiation of the public. The results of environmental monitoring are presented and estimates are made of radiation doses received by individual members of the public and larger population groups as a result of waste disposal. It is concluded that the doses received are all within the appropriate limits recommended by the International Commission on Radiological Protection, and in most cases are trivial.

  18. Negotiating supranational rules - The genesis of the International Atomic Energy Agency Safeguards System

    Energy Technology Data Exchange (ETDEWEB)

    Forland, Astrid

    1998-12-31

    The object of this thesis is the evolution from 1954-56 up until the mid 1970s of the nuclear safeguards system administered by the International Atomic Energy Agency (IAEA) in Vienna. The evolution is traced not through the practical implementation of the safeguards system, but through the various multilateral negotiations through which it was created. The focus is on analysing the arguments advanced in the various negotiations, and the main objective is to single out the factors determining the result. The discussion is organised into the following chapters: (1) The statute of the IAEA, (2) The IAEA 1961 safeguard document (INFCIRC/26), (3) The IAEA 1965 safeguards document (INFCIRC/66), (4) The non-proliferation treaty, (5) NPT safeguards. 92 refs.

  19. Lifetime Measurements of $ \\pi ^+ \\pi ^- $ and $\\pi^{+-} K^{-+}$ Atoms to Test Low-Energy QCD Predictions

    CERN Multimedia

    Ponta, T C; Dumitriu, D E; Afanasyev, L; Zhabitskiy, M; Rykalin, V; Hons, Z; Schacher, J; Yazkov, V; Gerndt, J; Detraz, C C; Guaraldo, C; Dreossi, D; Smolik, J; Gorchakov, O; Nikitin, M; Dudarev, A; Kluson, J; Hansroul, M; Okada, K; Constantinescu, S; Kruglov, V; Komarov, V; Takeutchi, F; Tarta, P D; Kuptsov, A; Nemenov, L; Karpukhin, V; Shliapnikov, P; Brekhovskikh, V; Saborido silva, J J; Drijard, D; Rappazzo, G F; Pentia, M C; Gugiu, M M; Kruglova, L; Pustylnik, Z; Trojek, T; Vrba, T; Iliescu, M A; Duma, M; Ciocarlan, C; Kulikov, A; Ol'shevskiy, V; Ryazantsev, A; Chiba, M; Anania, A; Tarasov, A; Gritsay, K; Lapchine, V; Cechak, T; Lopez aguera, A

    2002-01-01

    %PS212 \\\\ \\\\ The proposed experiment aims to measure the lifetime of $ \\pi ^+ \\pi ^- $ atoms in the ground state with 10\\% precision, using the 24~GeV/c proton beam of the CERN Proton Synchrotron. As the value of the above lifetime of order 10$ ^- ^{1} ^{5} $s is dictated by a strong interaction at low energy, the precise measurement of this quantity enables to determine a combination of S-wave pion scattering lengths to 5\\%. Pion scattering lengths have been calculated in the framework of chiral perturbation theory and values predicted at the same level of accuracy have, up to now, never been confronted with accurate experimental data. Such a measurement would submit the understanding of chiral symmetry breaking of QCD to a crucial test.

  20. Determining Nuclear Fingerprints: Glove Boxes, Radiation Protection, and the International Atomic Energy Agency.

    Science.gov (United States)

    Rentetzi, Maria

    2017-03-15

    In a nuclear laboratory, a glove box is a windowed, sealed container equipped with two flexible gloves that allow the user to manipulate nuclear materials from the outside in an ostensibly safe environment. As a routine laboratory device, it invites neglect from historians and storytellers of science. Yet, since especially the Gulf War, glove boxes have put the interdependence of science, diplomacy, and politics into clear relief. Standing at the intersection of history of science and international history, technological materials and devices such as the glove box can provide penetrating insight into the role of international diplomatic organizations to the global circulation and control of scientific knowledge. The focus here is on the International Atomic Energy Agency.

  1. Energy of the Isolated Metastable Iron-Nickel FCC Nanocluster with a Carbon Atom in the Tetragonal Interstice.

    Science.gov (United States)

    Bondarenko, Natalya V; Nedolya, Anatoliy V

    2017-12-01

    The energy of the isolated iron-nickel nanocluster was calculated by molecular mechanics method using Lennard-Jones potential. The cluster included a carbon atom that drifted from an inside octahedral interstice to a tetrahedral interstice in [Formula: see text] direction and after that in direction to the surface. In addition, one of 14 iron atoms was replaced by a nickel atom, the position of which was changing during simulation.The energy of the nanocluster was estimated at the different interatomic distances. As a result of simulation, the optimal interatomic distances of Fe-Ni-C nanocluster was chosen for the simulation, in which height of the potential barrier was maximal and face-centered cubic (FCC) nanocluster was the most stable.It is shown that there were three main positions of a nickel atom that significantly affected nanocluster's energy.The calculation results indicated that position of the carbon atom in the octahedral interstice was more energetically favorable than tetrahedral interstice in the case of FCC nanocluster. On the other side, the potential barrier was smaller in the direction [Formula: see text] than in the direction .This indicates that there are two ways for carbon atom to drift to the surface of the nanocluster.

  2. Elemental mapping in achromatic atomic-resolution energy-filtered transmission electron microscopy

    Energy Technology Data Exchange (ETDEWEB)

    Forbes, B.D. [School of Physics, University of Melbourne, Parkville, VIC 3010 (Australia); Houben, L. [Ernst Ruska-Centre for Microscopy and Spectroscopy with Electrons and Peter Gruenberg Institute, Forschungszentrum Jülich, D-52425 Jülich (Germany); Mayer, J. [Ernst Ruska-Centre for Microscopy and Spectroscopy with Electrons and Peter Gruenberg Institute, Forschungszentrum Jülich, D-52425 Jülich (Germany); Central Facility for Electron Microscopy, RWTH Aachen University, D-52074 Aachen (Germany); Dunin-Borkowski, R.E. [Ernst Ruska-Centre for Microscopy and Spectroscopy with Electrons and Peter Gruenberg Institute, Forschungszentrum Jülich, D-52425 Jülich (Germany); Allen, L.J., E-mail: lja@unimelb.edu.au [School of Physics, University of Melbourne, Parkville, VIC 3010 (Australia)

    2014-12-15

    We present atomic-resolution energy-filtered transmission electron microscopy (EFTEM) images obtained with the chromatic-aberration-corrected FEI Titan PICO at the Ernst-Ruska Centre, Jülich, Germany. We find qualitative agreement between experiment and simulation for the background-subtracted EFTEM images of the Ti–L{sub 2,3} and O–K edges for a specimen of SrTiO{sub 3} oriented down the [110] zone axis. The simulations utilize the transition potential formulation for inelastic scattering, which permits a detailed investigation of contributions to the EFTEM image. We find that energy-filtered images of the Ti–L{sub 2,3} and O–K edges are lattice images and that the background-subtracted core-loss maps may not be directly interpretable as elemental maps. Simulations show that this is a result of preservation of elastic contrast, whereby the qualitative details of the image are determined primarily by elastic, coherent scattering. We show that this effect places a constraint on the range of specimen thicknesses which could theoretically yield directly useful elemental maps. In general, interpretation of EFTEM images is ideally accompanied by detailed simulations. - Highlights: • Achromatic atomic-resolution EFTEM images were obtained for STO 〈110〉. • Simulations were in qualitative agreement with Ti–L{sub 2,3} and O–K edge maps. • The experimental EFTEM maps are not directly interpretable as elemental maps. • Image intensities are strongly determined by preservation of elastic contrast. • Interpretation of EFTEM images is ideally accompanied by detailed simulations.

  3. Charge-transfer energy in closed-shell ion-atom interactions. [for H and Li ions in He

    Science.gov (United States)

    Alvarez-Rizzatti, M.; Mason, E. A.

    1975-01-01

    The importance of charge-transfer energy in the interactions between closed-shell ions and atoms is investigated. Ab initio calculations on H(plus)-He and Li(plus)-He are used as a guide for the construction of approximate methods for the estimation of the charge-transfer energy for more complicated systems. For many alkali ion-rate gas systems the charge-transfer energy is comparable to the induction energy in the region of the potential minimum, although for doubly charged alkaline-earth ions in rare gases the induction energy always dominates. Surprisingly, an empirical combination of repulsion energy plus asymptotic induction energy plus asymptotic dispersion energy seems to give a fair representation of the total interaction, especially if the repulsion energy is parameterized, despite the omission of any explicit charge-transfer contribution. More refined interaction models should consider the charge-transfer energy contribution.

  4. Ultrafast triggered transient energy storage by atomic layer deposition into porous silicon for integrated transient electronics

    Science.gov (United States)

    Douglas, Anna; Muralidharan, Nitin; Carter, Rachel; Share, Keith; Pint, Cary L.

    2016-03-01

    Here we demonstrate the first on-chip silicon-integrated rechargeable transient power source based on atomic layer deposition (ALD) coating of vanadium oxide (VOx) into porous silicon. A stable specific capacitance above 20 F g-1 is achieved until the device is triggered with alkaline solutions. Due to the rational design of the active VOx coating enabled by ALD, transience occurs through a rapid disabling step that occurs within seconds, followed by full dissolution of all active materials within 30 minutes of the initial trigger. This work demonstrates how engineered materials for energy storage can provide a basis for next-generation transient systems and highlights porous silicon as a versatile scaffold to integrate transient energy storage into transient electronics.Here we demonstrate the first on-chip silicon-integrated rechargeable transient power source based on atomic layer deposition (ALD) coating of vanadium oxide (VOx) into porous silicon. A stable specific capacitance above 20 F g-1 is achieved until the device is triggered with alkaline solutions. Due to the rational design of the active VOx coating enabled by ALD, transience occurs through a rapid disabling step that occurs within seconds, followed by full dissolution of all active materials within 30 minutes of the initial trigger. This work demonstrates how engineered materials for energy storage can provide a basis for next-generation transient systems and highlights porous silicon as a versatile scaffold to integrate transient energy storage into transient electronics. Electronic supplementary information (ESI) available: (i) Experimental details for ALD and material fabrication, ellipsometry film thickness, preparation of gel electrolyte and separator, details for electrochemical measurements, HRTEM image of VOx coated porous silicon, Raman spectroscopy for VOx as-deposited as well as annealed in air for 1 hour at 450 °C, SEM and transient behavior dissolution tests of uniformly coated VOx on

  5. Task Force on Integrated Energy and Environmental Planning: The Netherlands - Poland. Working Paper 2: Government institutions of the energy sector in the EC countries

    Energy Technology Data Exchange (ETDEWEB)

    Kant, A.D. [Unit ECN Policy Studies, Netherlands Energy Research Foundation, Petten (Netherlands); Verhagen, H.M. [Dutch Ministry of Economic Affairs, The Hague (Netherlands)

    1993-07-01

    The Polish Government is interested in a broad perspective of institutional arrangements in the national energy sector. A brief review of energy administrations in the EC countries illustrates that only a few of the energy ministries established in 1970`s after the oil crisis still remain. At present, energy departments are incorporated in a ministry of economic affairs or trade and industry and have broad energy policy responsibilities. Their subdivisions are oriented towards energy resources and in some cases also with energy conservation. Energy is not treated as a common commodity, but is strongly controlled by legislation. Germany and United Kingdom have the most strongly privatized energy sectors in EC but nevertheless still have a plethora of laws concerning pricing, investment, organization, monopolies, supply areas, grid development, maintenance, etc. Government involvement in energy sector is still far greater than set by EC policies directed to privatisation and competition. Comparison of energy administrations of Poland and EC countries is hampered by incomparable key economic figures and different political and cultural traditions; however the overall institutional set-up for energy has some common characteristics in the EC countries: Energy departments within a ministry of economic affairs are subdivided according to energy carriers and include energy conservation and energy planning units in general energy policy units. Polish parliament is responsible for election and establishment of an adequate and competent energy administration structure. Energy planning plays an important role in EC countries. National energy plans are strongly related to key economic figures for economic sectors and subsectors and are usually commissioned by general policy units in the department of energy and updated at regular intervals. They function as anchor points for industry, thus providing basic data.

  6. Quality assurance and quality control programme in the Personal Dosimetry Department of the Greek Atomic Energy Commission.

    Science.gov (United States)

    Kamenopoulou, V; Drikos, G; Carinou, E; Papadomarkaki, E; Askounis, P; Kyrgiakou, H; Kefalonitis, N

    2002-01-01

    A quality assurance (QA) and quality control (QC) programme was applied to the personal monitoring department (TLD based) of the Greek Atomic Energy Commission (GAEC). This programme was designed according to the recommendations of international bodies such as the International Organization for Standardization (ISO), the International Electrotechnical Commission (IEC), the International Atomic Energy Agency (IAEA) and the European Commission (CEC). This paper deals with the presentation of the QA/QC programme which includes administrative data and information, technical checking of the equipment, acceptance tests of new equipment and dosemeters, issuing and processing of the dosemeters, dose evaluation, record keeping and reporting, traceability and reproducibility, handling of complaints, internal reviews and external audits.

  7. Fully differential cross sections for low to intermediate energy perpendicular plane ionization of xenon atoms

    Energy Technology Data Exchange (ETDEWEB)

    Purohit, G., E-mail: ghanshyam.purohit@spsu.ac.in; Singh, P.; Patidar, V.

    2014-12-15

    Highlights: • We present triply differential cross section (TDCS) results for the perpendicular plane ionization of xenon atoms. • The TDCS has been calculated in the modified distorted wave Born approximation formalism. • The effects of target polarization and post collision interaction have also been included. • The polarization potential, higher order effects and PCI has been found to be useful in the description of TDCS. - Abstract: Triple differential cross section (TDCS) results are reported for the perpendicular plane ionization of Xe (5p) at incident electron energies 5 eV, 10 eV, 20 eV, and 40 eV above ionization potential. The modified distorted wave Born approximation formalism with first as well as the second order Born terms has been used to calculate the TDCS. Effects of target polarization and post collision interaction have also been included. We compare the (e, 2e) TDCS results of our calculation with the recent available experimental data and theoretical results and discuss the process contributing to structure seen in the differential cross section. It has been observed from the present study that the second order effect and target polarization make significant contribution in description of collision dynamics of xenon at the low and intermediate energy for the perpendicular emission of electrons.

  8. Survival probability and energy modification of hydrogen Energetic Neutral Atoms on their way from the termination shock to Earth orbit

    CERN Document Server

    Bzowski, M

    2008-01-01

    Contect: With the forthcoming launch of a NASA SMEX mission IBEX devoted to imaging of heliospheric interface by in-situ detection of Energetic Neutral Atoms (ENA) an important issue becomes recognizing of transport of these atoms from the termination shock of the solar wind to Earth orbit. Aims: Investigate modifications of energy and of survival probability of the H ENA detectable by IBEX (0.01 -- 6 keV) between the termination shock and Earth orbit taking into account the influence of the variable and anisotropic solar wind and solar EUV radiation. Methods: Energy change of the atoms is calculated by numerical simulations of orbits of the H ENA atoms from ~100 AU from the Sun down to Earth orbit, taking into account solar gravity and Lyman-$\\alpha$ radiation pressure, which is variable in time and depends on radial velocity of the atom. To calculate survival probabilities of the atoms against onization, a detailed 3D and time-dependent model of H ENA ionization based on observations of the solar wind and E...

  9. THE DEVELOPMENT OF AN ENTERPRISE RESOURCE PLANNING SYSTEM (ERP FOR A RESEARCH AND TECHNOLOGY INSTITUTE: THE CASE OF THE NUCLEAR AND ENERGY RESEARCH INSTITUTE -IPEN

    Directory of Open Access Journals (Sweden)

    Willy Hoppe de Souza

    2011-05-01

    Full Text Available This paper reports the history of the development of an enterprise resource planning (ERP dedicated to managing the technical activities of the Nuclear and Energy Research Institute, a governmental research and technology institute in Brazil. After the implementation of the new planning process, the development of a new management information system named SIGEPI was immediately initiated. The implementation of this system followed a strategy of integrating databases already available and developing new ones in order to facilitate the data collecting process and to improve the quality and the reliability of these data. This paper describes the evolution of SIGEPI, its main features and it also reports the difficulties faced for almost ten years of developments. The success factors of the case were classified into three groups: strategic, technical and behavioral ones. The impact of these factors and recommendation for future similar developments are presented.

  10. THE DEVELOPMENT OF AN ENTERPRISE RESOURCE PLANNING SYSTEM (ERP FOR A RESEARCH AND TECHNOLOGY INSTITUTE: THE CASE OF THE NUCLEAR AND ENERGY RESEARCH INSTITUTE -IPEN

    Directory of Open Access Journals (Sweden)

    Willy Hoppe de Souza

    2011-01-01

    Full Text Available This paper reports the history of the development of an enterprise resource planning (ERPdedicated to managing the technical activities of the Nuclear and Energy Research Institute, agovernmental research and technology institute in Brazil. After the implementation of the newplanning process, the development of a new management information system named SIGEPIwas immediately initiated. The implementation of this system followed a strategy of integratingdatabases already available and developing new ones in order to facilitate the data collectingprocess and to improve the quality and the reliability of these data. This paper describes theevolution of SIGEPI, its main features and it also reports the difficulties faced for almost tenyears of developments. The success factors of the case were classified into three groups:strategic, technical and behavioral ones. The impact of these factors and recommendation forfuture similar developments are presented.

  11. DNA Free Energy Landscapes and RNA Nano-Self-Assembly Using Atomic Force Microscopy

    Science.gov (United States)

    Frey, Eric William

    There is an important conceptual lesson which has long been appreciated by those who work in biophysics and related interdisciplinary fields. While the extraordinary behavior of biological matter is governed by its detailed atomic structure and random fluctuations, and is therefore difficult to predict, it can nevertheless be understood within simplified frameworks. Such frameworks model the system as consisting of only one or a few components, and model the behavior of the system as the occupation of a single state out of a small number of states available. The emerging widespread application of nanotechnology, such as atomic force microscopy (AFM), has expanded this understanding in eye-opening new levels of detail by enabling nano-scale control, measurement, and visualization of biological molecules. This thesis describes two independent projects, both of which illuminate this understanding using AFM, but which do so from very different perspectives. The organization of this thesis is as follows. Chapter 1 begins with an experimental background and introduction to AFM, and then describes our setup in both single-molecule manipulation and imaging modes. In Chapter 2, we describe the first project, the motivation for which is to extend methods for the experimental determination of the free energy landscape of a molecule. This chapter relies on the analysis of single-molecule manipulation data. Chapter 3 describes the second project, the motivation for which is to create RNA-based nano-structures suitable for future applications in living mammalian cells. This chapter relies mainly on imaging. Chapters 2 and 3 can thus be read and understood separately.

  12. Determination of deposited flux and energy of sputtered tungsten atoms on every stages of transport in HiPIMS discharge

    Science.gov (United States)

    Desecures, M.; de Poucques, L.; Bougdira, J.

    2017-02-01

    A time-resolved tunable diode-laser (DL) induced fluorescence (TR-TDLIF) technique has been used to identify different populations of atoms (on different stages of transport) to determine their corresponding deposited energy and flux. The temporal dimension permits the splitting of the processes of sputtering during the discharge and particles transport in the post-discharge where atoms and flux velocity distribution functions (AVDF, FVDF) of each population were measured varying the discharge parameters (power, voltage, pressure, and distance from target). Tungsten (W) was chosen, being an interesting case in terms of sputtered atom transport, considering its weight which implies weak changes of directivity or energy transfer after collisions with the buffer gas. The high temporal and spectral resolutions of TR-TDLIF are the keys for the distinction of the atoms populations and the stage corresponding to the transition from the ballistic to diffusive regime of transport was observed for the first time and named quasi-diffusive regime. Thus, the ability to dissociate populations of atoms and to determine their deposited flux and energy may be of great interest to adjust film properties as desired for applications.

  13. Austin's Home Performance with Energy Star Program: Making a Compelling Offer to a Financial Institution Partner

    Energy Technology Data Exchange (ETDEWEB)

    Zimring, Mark

    2011-03-18

    Launched in 2006, over 8,700 residential energy upgrades have been completed through Austin Energy's Home Performance with Energy Star (HPwES) program. The program's lending partner, Velocity Credit Union (VCU) has originated almost 1,800 loans, totaling approximately $12.5 million. Residential energy efficiency loans are typically small, and expensive to originate and service relative to larger financing products. National lenders have been hesitant to deliver attractive loan products to this small, but growing, residential market. In response, energy efficiency programs have found ways to partner with local and regional banks, credit unions, community development finance institutions (CDFIs) and co-ops to deliver energy efficiency financing to homeowners. VCU's experience with the Austin Energy HPwES program highlights the potential benefits of energy efficiency programs to a lending partner.

  14. Analysis of H atoms in a negative ion source plasma with the non-equilibrium electron energy distribution function.

    Science.gov (United States)

    Koga, S; Shibata, T; Terasaki, R; Kameyama, N; Hatayama, A; Bacal, M; Tsumori, K

    2012-02-01

    In negative ion sources for the neutral beam injection, it is important to calculate H atom flux onto the plasma grid (PG) surface for the evaluation of H(-) production on the PG surface. We have developed a neutral (H(2) molecules and H atoms) transport code. In the present study, the neutral transport code is applied to the analysis of the H(2) and H transport in a NIFS-R&D ion source in order to calculate the flux onto the PG surface. Taking into account non-equilibrium feature of the electron energy distribution function (EEDF), i.e., the fast electron component, we have done the neutral transport simulation. The results suggest that the precise evaluation of the EEDF, especially in the energy range 15 eV < E < 30 eV is important for the dissociation rate of H(2) molecules by the electron impact collision and the resultant H atom flux on the PG.

  15. Calculation of Energies of the Ground and Low Excited States of a Confined Helium Atom in a Spherical Parabolic Well

    Institute of Scientific and Technical Information of China (English)

    XIE Wen-Fang

    2006-01-01

    @@ Making use of the adiabatic hyperspherical approach, we report a calculation for the energy spectrum of the ground and low-excited states of the confined helium atom in a spherical parabolic well. We find that the energies of a spherical parabolic well are in good agreement with those of an impenetrable spherical box for the larger confined potential radius. However, the energy values of a spherical parabolic well are much lower than those of an impenetrable spherical box for small values of re. We also find that the confinement may cause accidental degeneracies between levels with different low-excited states and the inversion of the energy values.

  16. Using Concept Maps as Instructional Materials to Foster the Understanding of the Atomic Model and Matter-Energy Interaction

    Science.gov (United States)

    Aguiar, Joana G.; Correia, Paulo R. M.

    2016-01-01

    In this paper, we explore the use of concept maps (Cmaps) as instructional materials prepared by teachers, to foster the understanding of chemistry. We choose fireworks as a macroscopic event to teach basic chemical principles related to the Bohr atomic model and matter-energy interaction. During teachers' Cmap navigation, students can experience…

  17. Scaled-energy spectroscopy of helium vertical bar M vertical bar=1 Rydberg atoms in a static electric field

    NARCIS (Netherlands)

    Kips, A.; Vassen, W.; Hogervorst, W.; Dando, P.A.

    1998-01-01

    We present scaled-energy spectra on helium Rydberg atoms in a static electric field. /M/ = 1 states were studied in excitation from the 2 S-1(0) metastable state. Spectra were recorded for epsilon = -2.940(4), epsilon = -2.350(4), both below the saddle point, and epsilon = -1.760(4), above the saddl

  18. 77 FR 27113 - Export and Import of Nuclear Equipment and Material; Export of International Atomic Energy Agency...

    Science.gov (United States)

    2012-05-09

    ... / Wednesday, May 9, 2012 / Rules and Regulations#0;#0; ] NUCLEAR REGULATORY COMMISSION 10 CFR Part 110 RIN 3150-AJ04 Export and Import of Nuclear Equipment and Material; Export of International Atomic Energy Agency Safeguards Samples AGENCY: Nuclear Regulatory Commission. ACTION: Final rule. SUMMARY: The...

  19. Absolute measurement of the effective atomic number and the electron density by using dual-energy CT images

    Science.gov (United States)

    Kim, Dae-Hong; Lee, Won-Hyung; Jeon, Sung-Soo; Kim, Hee-Joung

    2012-12-01

    Material decomposition using dual-energy and material-selective techniques was performed using computed-tomography (CT)-generated reconstructed images. Previous work using the dual-energy method focused on extracting the effective atomic number and the electron density of materials to confirm the dosimetric accuracy in radiation therapy. Dual-energy methods mostly depend on the device generating the X-rays, such as a synchrotron, and on dose verification for radiation treatment planning. Information obtained from CT imaging is important both in diagnosis and in planning radiation therapy. In a clinical setting, CT images are usually displayed as Houndsfield units (HU), which are extracted from the attenuation coefficient of a material. The attenuation coefficient is calculated using the effective atomic number and the electron density of a material; thus, information expressed in HU can be converted into the effective atomic number and the electron density by using the dual-energy equation. This study was performed using realistic Xray spectra to differentiate between the contrast media and plaque in vascular images. Our results suggest that the effective atomic number and electron density are useful in distinguishing between two adjacent materials with similar HUs.

  20. University Leadership in Energy and Environmental Design: How Postsecondary Institutions Use the LEEDRTM Green Building Rating System

    Science.gov (United States)

    Chance, Shannon Massie

    2010-01-01

    This descriptive, exploratory study focused on how institutions of higher education have used the United States Green Building Council's (USGBC) Leadership in Energy and Environmental Design (LEED[R]) Green Building Rating system. It employed statistical methods to assess which types of universities have used LEED, what ratings they earned, and…

  1. Renewable Energy Institute International (REII): Cooperative Research and Development Final Report, CRADA Number CRD-10-387

    Energy Technology Data Exchange (ETDEWEB)

    Carpenter, D.

    2014-11-01

    NREL will provide the Renewable Energy Institute with detailed on-site biomass gasifier syngas monitoring, using the NREL transportable Molecular Beam Mass Spectrometer. This information will be used to optimize the parameters of the gasifier operation, insuring the quality of the syngas made in the Red Lion Bioenergy gasifier and its compatibility with catalytic conversion to fuels.

  2. Finding attractive markets for the educational programs of the Energy Delta Institute (EDI) : Market research in three European regions

    NARCIS (Netherlands)

    Meijerhof, Jos

    2005-01-01

    The Energy Delta Institute, a provider of courses on many subjects related to natural gas, wants to know the market potential of the different national natural gas markets and market players in three European regions. This research uses data about thirty-nine national natural gas markets to make a r

  3. Watching the dynamics of electrons and atoms at work in solar energy conversion

    Energy Technology Data Exchange (ETDEWEB)

    Canton, S. E.; Zhang, X.; Liu, Y.; Zhang, J.; Pápai, M.; Corani, A.; Smeigh, A. L.; Smolentsev, G.; Attenkofer, K.; Jennings, G.; Kurtz, C. A.; Li, F.; Harlang, T.; Vithanage, D.; Chabera, P.; Bordage, A.; Sun, L.; Ott, S.; Wärnmark, K.; Sundström, V.

    2015-07-06

    The photochemical reactions performed by transition metal complexes have been proposed as viable routes towards solar energy conversion and storage into other forms that can be conveniently used in our everyday applications. In order to develop efficient materials, it is necessary to identify, characterize and optimize the elementary steps of the entire process on the atomic scale. To this end, we have studied the photoinduced electronic and structural dynamics in two heterobimetallic ruthenium–cobalt dyads, which belong to the large family of donor–bridge–acceptor systems. Using a combination of ultrafast optical and X-ray absorption spectroscopies, we can clock the light-driven electron transfer processes with element and spin sensitivity. In addition, the changes in local structure around the two metal centers are monitored. These experiments show that the nature of the connecting bridge is decisive for controlling the forward and the backward electron transfer rates, a result supported by quantum chemistry calculations. More generally, this work illustrates how ultrafast optical and X-ray techniques can disentangle the influence of spin, electronic and nuclear factors on the intramolecular electron transfer process. Finally, some implications for further improving the design of bridged sensitizer-catalysts utilizing the presented methodology are outlined.

  4. Cooperation between the US and the USSR in the peaceful uses of atomic energy

    Energy Technology Data Exchange (ETDEWEB)

    Seaborg, G.T.

    1989-10-01

    The decade of the 1960's saw a marked expansion of cooperation between the United States and the Soviet Union for the peaceful uses of atomic energy. In my opinion, this development constituted one of the most encouraging elements in the international scene. Until 1955 contacts between American and Soviet nuclear scientists were virtually nonexistent, as indeed (after World War II) were US-USSR contacts in other fields except as required in formal intergovernmental relations. Then, in July 1955, the discussions of the Heads of Government meeting in Geneva led to the declaration of a policy with the following aims: to lower the barriers which now impede the interchange of information and ideas between our peoples; to lower the barriers which now impede the opportunities of people to travel anywhere in the world for peaceful, friendly purposes, so that all will have a chance to know each other face to face; and to create conditions which will encourage nations to increase the exchange of peaceful goods throughout the world. 8 figs.

  5. The Russian Federation's Ministry of Atomic Energy: Programs and Developments

    Energy Technology Data Exchange (ETDEWEB)

    Johnson, Craig M.

    2000-07-24

    The Ministry of Atomic Energy of the Russian Federation (Minatom) is one of Russia's largest and most influential federal bodies. Throughout 1999 its head, Yevgeny Adamov, has worked to increase the Ministry's commercial competitiveness by consolidating redundant facilities and tightening control over subsidiary organizations. Economic difficulties and budget constraints, however, have hindered Minatom's ability to achieve many of its programs and goals. As a result, the Ministry has continued, renewed or initiated contracts with several countries possessing questionable commitments to nonproliferation and has sought to expand its role in international nuclear waste management and spent fuel reprocessing in order to raise new sources of revenue. While many of these programs are not likely to come to fruition, others raise significant nonproliferation and environmental concerns. This paper reviews select programs driving Minatom's efforts to raise funds, comments on their potential viability, and highlights areas likely to be of particular concern for the United States over the next three to five years.

  6. Cross sections for medium energy He ions scattered from Hf and Au atoms

    Energy Technology Data Exchange (ETDEWEB)

    Nishimura, Tomoaki, E-mail: t-nishi@hosei.ac.jp [Research Center of Ion Beam Technology and College of Engineering, Hosei University, Koganei, Tokyo 184-8584 (Japan); Mitsuhara, Kei; Visikovskiy, Anton; Kido, Yoshiaki [Department of Physics, Ritsumeikan University, Kusatsu, Shiga-ken 525-8577 (Japan)

    2012-06-01

    The elastic scattering cross sections for medium energy He ions incident on Ni, Hf and Au atoms were measured precisely using a toroidal electrostatic analyzer. We prepared the targets of Ni({approx}1 nm)/HfO{sub 2}(1.5 nm)/Si(0 0 1) and Ni({approx}1 nm)/Au({approx}0.5 nm)/Si(1 1 1) and performed in situ ion scattering measurement under ultrahigh vacuum condition. The absolute amounts of Ni, Hf and Au were determined by Rutherford backscattering using 1.5 MeV He ions at a scattering angle of 150 Degree-Sign . The scattering cross sections for Hf and Au were normalized by those for Ni to avoid the ambiguities of the number of incident particles, solid angle subtended by a detector, detection efficiency and the He{sup +} fractions for the emerging He ions from the surfaces. The results obtained are compared with the simple Lee-Hart formula and the calculated values using the Moliere and ZBL potentials and the potentials derived from the Hartree-Fock-Slater wave functions.

  7. Negotiating supranational rules. The genesis of the International Atomic Energy Agency safeguards system

    Energy Technology Data Exchange (ETDEWEB)

    Forland, A.

    1997-12-31

    The object of this study is the evolution from 1954-56 up until the mid-1970s of the nuclear safeguards system administered by the International Atomic Energy Agency (IAEA) in Vienna. The main aim of the study is not to describe the IAEA safeguards system as such. The focus will be on analysing the arguments advanced in the various negotiations, and the main objective will be to single out the factors determining the result. In the course of the time span under study two international treaties were negotiated which were decisive for the development of international nuclear safeguards. These were the IAEA Stature (1956) and the Non-Proliferation Treaty (1968). The Statue as well as the NPT contain articles on international nuclear safeguards. These articles limit themselves to spelling out the safeguards principles. It was thus left to the IAEA Board of Governors to develop the safeguards procedures in detail. Two IAEA safeguards documents were negotiated between 1959 and 1965 in order to implement the safeguards article of the Statue. The safeguards requirements of the NPT were spelled out in a new model agreement in 1972. 58 refs.

  8. Towards Establishing Capacity for Biological Dosimetry at Ghana Atomic Energy Commission

    Science.gov (United States)

    Achel, Daniel Gyingiri; Achoribo, Elom; Agbenyegah, Sandra; Adaboro, Rudolph M.; Donkor, Shadrack; Adu-Bobi, Nana A. K.; Agyekum, Akwasi A.; Akuamoa, Felicia; Tagoe, Samuel N.; Kyei, Kofi A.; Yarney, Joel; Serafin, Antonio; Akudugu, John M.

    2016-01-01

    The aim of this study was not only to obtain basic technical prerequisites for the establishment of capacity of biological dosimetry at the Ghana Atomic Energy Commission (GAEC) but also to stimulate interest in biological dosimetry research in Ghana and Sub-Saharan Africa. Peripheral blood from four healthy donors was exposed to different doses (0–6 Gy) of gamma rays from a radiotherapy machine and lymphocytes were subsequently stimulated, cultured, and processed according to standard protocols for 48–50 h. Processed cells were analyzed for the frequencies of dicentric and centric ring chromosomes. Radiation dose delivered to the experimental model was verified using GafChromic® EBT films in parallel experiments. Basic technical prerequisites for the establishment of capacity of biological dosimetry in the GAEC have been realized and expertise in the dicentric chromosome assay consolidated. We successfully obtained preliminary cytogenetic data for a dose-response relationship of the irradiated blood lymphocytes. The data strongly indicate the existence of significant linear (α) and quadratic (β) components and are consistent with those published for the production of chromosome aberrations in comparable absorbed dose ranges. PMID:28217279

  9. Fermi and Coulomb correlation effects upon the interacting quantum atoms energy partition

    CERN Document Server

    Ruiz, Isela; Holguín-Gallego, Fernando José; Francisco, Evelio; Pendás, Ángel Martín; Rocha-Rinza, Tomás

    2016-01-01

    The Interacting Quantum Atoms (IQA) electronic energy partition is an important method in the field of quantum chemical topology which has given important insights of different systems and processes in physical chemistry. There have been several attempts to include Electron Correlation (EC) in the IQA approach, for example, through DFT and Hartree-Fock/Coupled-Cluster (HF/CC) transition densities. This work addresses the separation of EC in Fermi and Coulomb correlation and its effect upon the IQA analysis by taking into account spin-dependent one- and two-electron matrices $D^{\\mathrm{HF/CC}}_{p\\sigma q \\sigma}$ and $d^{\\mathrm{HF/CC}}_{p\\sigma q\\sigma r\\tau s\\tau}$ wherein $\\sigma$ and $\\tau$ represent either of the $\\alpha$ and $\\beta$ spin projections. We illustrate this approach by considering BeH$_2$,BH, CN$^-$, HF, LiF, NO$^+$, LiH, H$_2$O$\\cdots$H$_2$O and C$_2$H$_2$, which comprise non-polar covalent, polar covalent, ionic and hydrogen bonded systems. The same and different spin contributions to ($i$...

  10. Watching the dynamics of electrons and atoms at work in solar energy conversion.

    Science.gov (United States)

    Canton, S E; Zhang, X; Liu, Y; Zhang, J; Pápai, M; Corani, A; Smeigh, A L; Smolentsev, G; Attenkofer, K; Jennings, G; Kurtz, C A; Li, F; Harlang, T; Vithanage, D; Chabera, P; Bordage, A; Sun, L; Ott, S; Wärnmark, K; Sundström, V

    2015-01-01

    The photochemical reactions performed by transition metal complexes have been proposed as viable routes towards solar energy conversion and storage into other forms that can be conveniently used in our everyday applications. In order to develop efficient materials, it is necessary to identify, characterize and optimize the elementary steps of the entire process on the atomic scale. To this end, we have studied the photoinduced electronic and structural dynamics in two heterobimetallic ruthenium-cobalt dyads, which belong to the large family of donor-bridge-acceptor systems. Using a combination of ultrafast optical and X-ray absorption spectroscopies, we can clock the light-driven electron transfer processes with element and spin sensitivity. In addition, the changes in local structure around the two metal centers are monitored. These experiments show that the nature of the connecting bridge is decisive for controlling the forward and the backward electron transfer rates, a result supported by quantum chemistry calculations. More generally, this work illustrates how ultrafast optical and X-ray techniques can disentangle the influence of spin, electronic and nuclear factors on the intramolecular electron transfer process. Finally, some implications for further improving the design of bridged sensitizer-catalysts utilizing the presented methodology are outlined.

  11. Two-atom energy spectrum in a harmonic trap near a Feshbach resonance at higher partial waves

    Science.gov (United States)

    Suzuki, Akira; Liang, Yi; Bhaduri, Rajat K.

    2009-09-01

    Two atoms in an optical lattice may be made to interact strongly at higher partial waves near a Feshbach resonance. These atoms, under appropriate constraints, could be bosonic or fermionic. The universal l=2 energy spectrum for such a system, with a caveat, is presented in this paper and checked with the spectrum obtained by direct numerical integration of the Schrödinger equation. The results reported here extend those of Yip for p -wave resonance [S.-K. Yip, Phys. Rev. A 78, 013612 (2008)], while exploring the limitations of a universal expression for the spectrum for the higher partial waves.

  12. Survival probability and energy modification of hydrogen Energetic Neutral Atoms on their way from the termination shock to Earth orbit

    OpenAIRE

    Bzowski, M.

    2008-01-01

    Context: With the forthcoming launch of a NASA SMEX mission IBEX devoted to imaging of heliospheric interface by in-situ detection of Energetic Neutral Atoms (ENA) an important issue becomes recognizing of transport of these atoms from the termination shock of the solar wind to Earth orbit. Aims: Investigate modifications of energy and of survival probability of the H ENA detectable by IBEX (0.01 -- 6 keV) between the termination shock and Earth orbit taking into account the influence of the ...

  13. 氢原子能级与碱金属原子能级的比较研究%Comparative Studying of Hydrogen Atomic Energy Level and Alkali Metal Atomic Energy Level

    Institute of Scientific and Technical Information of China (English)

    王建伟; 蒲小芹

    2014-01-01

    The article by Bohr theory and The analysis of forces method, considered the interaction of different sit-uation, hydrogen atoms with alkali metal atomic energy level structure have been analyzed, and the numerical cal-culation, energy level diagram have been drawn out., Hydrogen energy and alkali metal atomic energy level were compared, by using the method of comparative study on the similarities and differences are found out.%运用玻尔理论及受力分析的方法,考虑相互作用的不同情况,分析了氢原子与碱金属原子能级结构,并进行了数值计算,画出了能级结构图。再运用比较研究的方法对氢原子能级与碱金属原子能级进行比较,找出其相同点及不同点。

  14. Multiple Electron Capture Processes in Slow Collisions of Ar9+ Ions with Na Atoms

    Institute of Scientific and Technical Information of China (English)

    ZhuXiaolong; ShaShan; LiuHuiping; WeiBaoren; MaXinwen; WangZhengling; CaoShiping; QianDongbing; YangZhihu

    2003-01-01

    Slow collisions of highly charged ions with neutral atoms and molecules are of great importance in basic atomic collision physics, Recently, we built a new research facility for atomic physics at the Institute of Modern Physics. We report here the multiple electron transfer processes in collisions of Ar9+ with Na gas target at energy of 180 keV.

  15. Atomic Spectral Methods for Ab Initio Molecular Electronic Energy Surfaces: Transitioning From Small-Molecule to Biomolecular-Suitable Approaches.

    Science.gov (United States)

    Mills, Jeffrey D; Ben-Nun, Michal; Rollin, Kyle; Bromley, Michael W J; Li, Jiabo; Hinde, Robert J; Winstead, Carl L; Sheehy, Jeffrey A; Boatz, Jerry A; Langhoff, Peter W

    2016-08-25

    Continuing attention has addressed incorportation of the electronically dynamical attributes of biomolecules in the largely static first-generation molecular-mechanical force fields commonly employed in molecular-dynamics simulations. We describe here a universal quantum-mechanical approach to calculations of the electronic energy surfaces of both small molecules and large aggregates on a common basis which can include such electronic attributes, and which also seems well-suited to adaptation in ab initio molecular-dynamics applications. In contrast to the more familiar orbital-product-based methodologies employed in traditional small-molecule computational quantum chemistry, the present approach is based on an "ex-post-facto" method in which Hamiltonian matrices are evaluated prior to wave function antisymmetrization, implemented here in the support of a Hilbert space of orthonormal products of many-electron atomic spectral eigenstates familiar from the van der Waals theory of long-range interactions. The general theory in its various forms incorporates the early semiempirical atoms- and diatomics-in-molecules approaches of Moffitt, Ellison, Tully, Kuntz, and others in a comprehensive mathematical setting, and generalizes the developments of Eisenschitz, London, Claverie, and others addressing electron permutation symmetry adaptation issues, completing these early attempts to treat van der Waals and chemical forces on a common basis. Exact expressions are obtained for molecular Hamiltonian matrices and for associated energy eigenvalues as sums of separate atomic and interaction-energy terms, similar in this respect to the forms of classical force fields. The latter representation is seen to also provide a long-missing general definition of the energies of individual atoms and of their interactions within molecules and matter free from subjective additional constraints. A computer code suite is described for calculations of the many-electron atomic eigenspectra and

  16. The study of multi-institutional collaborations in high-energy physics. Progress report, January 1989--March 1991

    Energy Technology Data Exchange (ETDEWEB)

    1991-12-31

    Since World War II, the organizational framework for scientific research is increasingly the multi-institutional collaboration, especially in high-energy physics. A broad preliminary survey, into the functioning of research collaborations involving three or more institutions is described. The study is designed to identify patterns of collaborations, define the scope of the documentation problems, field-test possible solutions, recommend future actions, and build an archives of oral history interviews and other resources for scholarly use. Once the study is completed, its findings will be used to promote systems to document significant collaborative research.

  17. Design of a WWW database server for Atomic Spectroscopy Data

    Energy Technology Data Exchange (ETDEWEB)

    Contis, A.

    1995-12-01

    The department of Atomic Spectroscopy at Lund Univ produces large amounts of experimental data on energy levels and emissions for atomic systems. In order to make this data easily available to users outside the institution, a database has been produced and made available on the Internet. This report describes the organization of the data and the Internet interface of the data base. 4 refs.

  18. Impact of Atomic Structure on Absolute Energy Levels of Methylammonium Lead Iodide Perovskite

    Science.gov (United States)

    Choi, Joshua

    2015-03-01

    There has been a staggeringly rapid increase in the photovoltaic performance of methylammonium lead iodide (MAPbI3) perovskite - greater than 19 percent solar cell power conversion efficiency has been reported in less than five years since the first report in 2009. Despite the progress in device performance, structure-property relationships in MAPbI3 are still poorly understood. I will present our recent findings on the impact of changing the Pb-I bond length and Pb-I-Pb bond angle on the electronic structure of MAPbI3. By using the combination of temperature dependent X-ray scattering, ultraviolet photoelectron spectroscopy, absorbance and PL spectroscopy, we show that the energy levels of highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO) shift in the same direction as MAPbI3 goes through tetragonal-to-cubic structural phase transition wherein the rotational angle of PbI6 octahedra is the order parameter of the transition. Our experimental results are corroborated by density functional theory calculations which show that the lattice expansion and bond angle distortion cause different degree of orbital overlap between the Pb and I atoms and the anti-bonding orbital nature of both HOMO and LUMO results in the same direction of their shift. Moreover, through pair distribution function analysis of X-ray scattering, we discovered that the majority of MAPbI3 in thin film solar cell layer has highly disordered structure with a coherence range of only 1.4 nm. The nanostructuring correlates with a blueshift of the absorption onset and increases the photoluminescence. Our results underscore the importance of understanding the structure-property relationships in order to improve the device performance of metal-organic perovskites.

  19. Advances in the production of isotopes and radiopharmaceuticals at the Atomic Energy Corporation of South Africa

    Energy Technology Data Exchange (ETDEWEB)

    Louw, P.A.; De Villiers, W.Y.Z.; Jarvis, N.V. [Atomic Energy Corporation of South Africa Ltd, Pretoria (South Africa)

    1997-10-01

    The Atomic Energy Corporation of South Africa Ltd (AEC) owns and operates the 20 MW research reactor, SAFARI-1. Utilisation of the reactor has in recent years changed from research and materials testing to the production of isotopes. The most important breakthrough achieved in recent years is the production of high quality fission 99Mo. This has been produced routinely since April 1993 and supplied to clients across the world. A capability for the reliable production of 1000 Ci of 99Mo per week (calibrated for six days after production) has been proven. The AEC has also established facilities to produce its own 99mTc generators together with a most of radiopharmaceutical kits for diagnostic nuclear medicine purposes. The production of {sup 153}Sm and {sup 131}I (tellurium oxide route) has been operational for many years. Applications include therapeutic radiopharmaceuticals such as {sup 153}Sm-EDTMP for bone cancer pain palliation, {sup 13`}I-Lipiodol for liver cancer and {sup 131}I capsules for thyroid treatment. Facilities for the production of other isotopes such as {sup 131}I (from fission), {sup 32}P and {sup 35}S are in various stages of completion. Extensive analytical methods and equipment have been developed and are routinely used to certify the quality of exported isotopes. Irradiation and encapsulation of {sup 192}Ir is also performed routinely at the AEC. Modern facilities allow for the production of isotopes such as {sup 131}Ba and {sup 140}La on an ad hoc basis. Quality assurance procedures based on ISO9000 were developed for all aspects of the production of the various isotopes. Documentation, such as Drug Master Files, required by authorities in various countries has also been submitted and accepted 15 refs., 1 tab., 2 figs.

  20. Nuclear nonproliferation and safety: Challenges facing the International Atomic Energy Agency

    Energy Technology Data Exchange (ETDEWEB)

    1993-09-01

    The Chairman of the Senate Committee on Govermental Affairs asked the United States General Accounting Office (GAO) to review the safeguards and nuclear power plant safety programs of the International Atomic Energy Agency (IAEA). This report examines (1) the effectiveness of IAEA`s safeguards program and the adequacy of program funding, (2) the management of U.S. technical assistance to the IAEA`s safeguards program, and (3) the effectiveness of IAEA`s program for advising United Nations (UN) member states about nuclear power plant safety and the adequacy of program funding. Under its statute and the Treaty on the Non-Proliferation of Nuclear Weapons, IAEA is mandated to administer safeguards to detect diversions of significant quantities of nuclear material from peaceful uses. Because of limits on budget growth and unpaid contributions, IAEA has had difficulty funding the safeguards program. IAEA also conducts inspections of facilities or locations containing declared nuclear material, and manages a program for reviewing the operational safety of designated nuclear power plants. The U.S. technical assistance program for IAEA safeguards, overseen by an interagency coordinating committee, has enhanced the agency`s inspection capabilities, however, some weaknesses still exist. Despite financial limitations, IAEA is meeting its basic safety advisory responsibilities for advising UN member states on nuclear safety and providing requested safety services. However, IAEA`s program for reviewing the operational safety of nuclear power plants has not been fully effective because the program is voluntary and UN member states have not requested IAEA`s review of all nuclear reactors with serious problems. GAO believes that IAEA should have more discretion in selecting reactors for review.

  1. An evaluation of exchange-correlation functionals for the calculations of the ionization energies for atoms and molecules

    Energy Technology Data Exchange (ETDEWEB)

    Segala, Maximiliano [Universidade Estadual do Rio Grande do Sul, Rua Oscar Matzembacher 475, 96760-000, Tapes, RS (Brazil); Chong, Delano P. [Department of Chemistry, 2036 Main Mall, University of British Columbia, Vancouver, B.C., V6T 1Z1 (Canada)], E-mail: chong@chem.ubc.ca

    2009-04-15

    In this paper, ionization energies of gas-phase atoms and molecules are calculated by energy-difference method and by approximate transition-state models with density functional theory (DFT). To determine the best functionals for ionization energies, we first study the H to Ar atoms. An approximation is used in which the electron density is first obtained from Kohn-Sham computations with an exchange-correlation potential V{sub xc} known as statistical average of orbital potentials (SAOP), after which the energy is computed from that density with 59 different exchange-correlation energy functionals E{sub xc}. For the 18 atoms, the best E{sub xc} functional providing an average absolute deviation (AAD) of only 0.110 eV is one known as the Krieger-Chen-Iafrate-Savin functional modified by Krieger, Chen, Iafrate, and Kurth, if one uses the spin-polarized spherical atom description. On the other hand, if one imposes the condition of integer-electrons, the best functional is the Becke 1997 functional modified by Wilson, Bradley, and Tozer, with an AAD of 0.107 eV, while several other functionals perform almost as well. For molecules, we can achieve an accuracy of AAD = 0.21 eV for valence VIPs of nonperhalo molecules with {delta}E(V{sub xc} = SAOP;PBE0) using integer-electron description. For perhalo molecules our best approach is {delta}E(V{sub xc} from either E{sub xc} or SAOP;mPW1PW) with full symmetry to obtain an AAD = 0.24 eV.

  2. Refined Dummy Atom Model of Mg(2+) by Simple Parameter Screening Strategy with Revised Experimental Solvation Free Energy.

    Science.gov (United States)

    Jiang, Yang; Zhang, Haiyang; Feng, Wei; Tan, Tianwei

    2015-12-28

    Metal ions play an important role in the catalysis of metalloenzymes. To investigate metalloenzymes via molecular modeling, a set of accurate force field parameters for metal ions is highly imperative. To extend its application range and improve the performance, the dummy atom model of metal ions was refined through a simple parameter screening strategy using the Mg(2+) ion as an example. Using the AMBER ff03 force field with the TIP3P model, the refined model accurately reproduced the experimental geometric and thermodynamic properties of Mg(2+). Compared with point charge models and previous dummy atom models, the refined dummy atom model yields an enhanced performance for producing reliable ATP/GTP-Mg(2+)-protein conformations in three metalloenzyme systems with single or double metal centers. Similar to other unbounded models, the refined model failed to reproduce the Mg-Mg distance and favored a monodentate binding of carboxylate groups, and these drawbacks needed to be considered with care. The outperformance of the refined model is mainly attributed to the use of a revised (more accurate) experimental solvation free energy and a suitable free energy correction protocol. This work provides a parameter screening strategy that can be readily applied to refine the dummy atom models for metal ions.

  3. Hubbard model for ultracold bosonic atoms interacting via zero-point-energy-induced three-body interactions

    Science.gov (United States)

    Paul, Saurabh; Johnson, P. R.; Tiesinga, Eite

    2016-04-01

    We show that, for ultracold neutral bosonic atoms held in a three-dimensional periodic potential or optical lattice, a Hubbard model with dominant, attractive three-body interactions can be generated. In fact, we derive that the effect of pairwise interactions can be made small or zero starting from the realization that collisions occur at the zero-point energy of an optical lattice site and the strength of the interactions is energy dependent from effective-range contributions. We determine the strength of the two- and three-body interactions for scattering from van der Waals potentials and near Fano-Feshbach resonances. For van der Waals potentials, which for example describe scattering of alkaline-earth atoms, we find that the pairwise interaction can only be turned off for species with a small negative scattering length, leaving the 88Sr isotope a possible candidate. Interestingly, for collisional magnetic Feshbach resonances this restriction does not apply and there often exist magnetic fields where the two-body interaction is small. We illustrate this result for several known narrow resonances between alkali-metal atoms as well as chromium atoms. Finally, we compare the size of the three-body interaction with hopping rates and describe limits due to three-body recombination.

  4. A new method to measure electron density and effective atomic number using dual-energy CT images

    Science.gov (United States)

    Ramos Garcia, Luis Isaac; Pérez Azorin, José Fernando; Almansa, Julio F.

    2016-01-01

    The purpose of this work is to present a new method to extract the electron density ({ρ\\text{e}} ) and the effective atomic number (Z eff) from dual-energy CT images, based on a Karhunen-Loeve expansion (KLE) of the atomic cross section per electron. This method was used to calibrate a Siemens Definition CT using the CIRS phantom. The predicted electron density and effective atomic number using 80 kVp and 140 kVp were compared with a calibration phantom and an independent set of samples. The mean absolute deviations between the theoretical and calculated values for all the samples were 1.7 %  ±  0.1 % for {ρ\\text{e}} and 4.1 %  ±  0.3 % for Z eff. Finally, these results were compared with other stoichiometric method. The application of the KLE to represent the atomic cross section per electron is a promising method for calculating {ρ\\text{e}} and Z eff using dual-energy CT images.

  5. Paul Scherrer Institut Scientific Report 2002. Volume IV: Nuclear Energy and Safety

    Energy Technology Data Exchange (ETDEWEB)

    Smith, B.; Gschwend, B. (eds.)

    2003-03-01

    Highlights in research and operation Projects established in previous years have yielded relevant and first-of-a-kind results, which have gained broad attention, both nationally and internationally, and which are presented in detail in this report. A few outstanding examples are cited below:Successful first measurements with highly active samples in LWR-PROTEUS Phase II (high burn-up fuel) have shown significant dependency of reactivity on burn-up, and increasing discrepancies between calculated and measured reactivity values with burn-up. As a consequence of these findings, the Swiss utilities wish to extend this phase. On-call calculations in the framework of the STARS project have been used to modify the feedwater system of the Leibstadt NPP. The modification has been subsequently confirmed during a turbine trip. An international consortium has been established for the ARTIST project (aerosol behaviour in the case of steam generator tube rupture). First tests showed higher aerosol retention than expected. The MEGAPIE project remains ongoing, and plans for post-irradiation examination (PIE) have now been established. Investigation of the leak which occurred in the LISOR loop in the Hot Lab has positively identified the cause of failure. PSI's contribution to the China Energy Technology Programme has been completed and documented. Among other results, the programme provided evidence for lower total costs (including externalities) by using 'clean coal' technologies. In parallel, and to assure continuation of the successful collaboration with the European research programmes, NES has participated in 27 'Expressions of Interest' for Integrated Projects and Networks of Excellence within the 6th EU Framework Programme. On the operational level, the year 2002 was marked by a series of significant events: The Federal Institutes of Technology, to which PSI belongs, have drawn up strategic plans for the years 2004-2007. The proposed PSI

  6. First-Principles Molecular Dynamics Investigation of the Atomic-Scale Energy Transport: From Heat Conduction to Thermal Radiation

    CERN Document Server

    Ji, Pengfei

    2016-01-01

    First-principles molecular dynamics simulation based on a plane wave/pseudopotential implementation of density functional theory is adopted to investigate atomic scale energy transport for semiconductors (silicon and germanium). By imposing thermostats to keep constant temperatures of the nanoscale thin layers, initial thermal non-equilibrium between the neighboring layers is established under the vacuum condition. Models with variable gap distances with an interval of lattice constant increment of the simulated materials are set up and statistical comparisons of temperature evolution curves are made. Moreover, the equilibration time from non-equilibrium state to thermal equilibrium state of different silicon or/and germanium layers combinations are calculated. The results show significant distinctions of heat transfer under different materials and temperatures combinations. Further discussions on the equilibrium time are made to explain the simulation results. As the first work of the atomic scale energy tra...

  7. Estimation of length scale of RS II-$p$ braneworld model through perturbations in Helium's atom ground state energy

    CERN Document Server

    Garrido, Nephtali

    2012-01-01

    We put to the test an effective three-dimensional electrostatic potential, obtained effectively by considering an electrostatic source inside a (5+$p$)-dimensional braneworld scenario with $p$ compact and one infinite spacial extra dimensions in the RS II-$p$ model, for $p=1$ and $p=2$. This potential is regular at the source and matches the standard Coulomb potential outside a neighborhood. We use variational and perturbative approximation methods to calculate corrections to the ground energy of the Helium atom modified by this potential, by making use of a 6 and 39-parameter trial wave function of Hylleraas type for the ground state. These corrections to the ground-state energy are compared with experimental data for Helium atom in order to set bounds for the extra dimensions length scale. We find that these bounds are less restrictive than the ones obtained by Morales et. al. through a calculation using the Lamb shift in Hydrogen.

  8. Stereodynamical Origin of Anti-Arrhenius Kinetics: Negative Activation Energy and Roaming for a Four-Atom Reaction.

    Science.gov (United States)

    Coutinho, Nayara D; Silva, Valter H C; de Oliveira, Heibbe C B; Camargo, Ademir J; Mundim, Kleber C; Aquilanti, Vincenzo

    2015-05-07

    The OH + HBr → H2O + Br reaction, prototypical of halogen-atom liberating processes relevant to mechanisms for atmospheric ozone destruction, attracted frequent attention of experimental chemical kinetics: the nature of the unusual reactivity drop from low to high temperatures eluded a variety of theoretical efforts, ranking this one among the most studied four-atom reactions. Here, inspired by oriented molecular-beams experiments, we develop a first-principles stereodynamical approach. Thermalized sets of trajectories, evolving on a multidimensional potential energy surface quantum mechanically generated on-the-fly, provide a map of most visited regions at each temperature. Visualizations of rearrangements of bonds along trajectories and of the role of specific angles of reactants' mutual approach elucidate the mechanistic change from the low kinetic energy regime (where incident reactants reorient to find the propitious alignment leading to reaction) to high temperature (where speed hinders adjustment of directionality and roaming delays reactivity).

  9. Current mapping of low-energy (120 eV) helium and hydrogen irradiated tungsten by conductive atomic force microscopy

    Science.gov (United States)

    Fan, Hongyu; Endo, Takashi; Bi, Zhenghua; Yan, Weibin; Ohnuki, Somei; Yang, Qi; Ni, Weiyuan; Liu, Dongping

    2017-04-01

    Both conductive atomic force microscopy (CAFM) and transmission electron microscopy have been used to characterize the defects or He bubbles in low-energy (120 eV) H and He irradiated tungsten (W). By a comparative study, we find that the current mapping from CAFM is very sensitive in the detection of nanometer-sized defects in low-energy H and He irradiated W. Our calculation confirms that the resistance change in H and He irradiated W is strongly affected by the distance between atomic force microscopy tip and defects/He bubbles. CAFM can accurately detect defects/He bubbles in the W surface layer, however, it is infeasible to measure them in the deep layer (>20 nm), especially due to the existence of defects in the surface layer.

  10. Tumor radiosensitizers - current status of development of various approaches: Report of an International Atomic Energy Agency meeting

    DEFF Research Database (Denmark)

    Horsman, Michael Robert; Bohm, Lothar; Margison, Geoffrey P.

    2006-01-01

    PURPOSE: The International Atomic Energy Agency (IAEA) held a Technical Meeting of Consultants to (1) discuss a selection of relatively new agents, not those well-established in clinical practice, that operated through a variety of mechanisms to sensitize tumors to radiation and (2) to compare...... and contrast their tumor efficacy, normal tissue toxicity, and status of development regarding clinical application. The aim was to advise the IAEA as to which developing agent or class of agents would be worth promoting further, by supporting additional laboratory research or clinical trials...... and for clinical trials that would be suitable for industrialized countries, as well as trials that were considered more appropriate for developing countries.PURPOSE: The International Atomic Energy Agency (IAEA) held a Technical Meeting of Consultants to (1) discuss a selection of relatively new agents, not those...

  11. Back-Influence of Molecular Motion on Energy Transfer in the Landau-Teller Model of Atom Molecule Scattering.

    Science.gov (United States)

    Pollak, Eli

    2016-07-21

    This year we celebrate the 80th anniversary of the Landau-Teller model for energy exchange in a collinear collision of an atom with a harmonic diatomic molecule. Even after 80 years though, the analytic theory to date has not included in it the back-influence of the oscillator's motion on the energy transfer between the approaching particle and the molecule. This is the topic of the present paper. The back-influence can be obtained by employing classical second-order perturbation theory. The second-order theory is used in both a classical and semiclassical context. Classically, analytic expressions are derived for the final phase and action of the diatom, after the collision. The energy loss of the atom is shown to decrease linearly with the increasing energy of the oscillator. The magnitude of this decrease is a direct consequence of the back-reaction of the oscillator on the translational motion. The qualitative result is universal, in the sense that it is not dependent on the details of the interaction of the atom with the oscillator. A numerical application to a model collision of an Ar atom with a Br2 diatom demonstrates the importance and accuracy of the second-order perturbation theory. The same results are then used to derive a second-order perturbation theory semiclassical expression for the quantum transition probability from initial vibrational state ni to final vibrational state nf of the oscillator. A comparison of the theory with exact quantum data is presented for a model collision of Br2 with a hydrogen molecule, where the hydrogen molecule is considered as a single approaching particle.

  12. Collisions of electrons with hydrogen atoms I. Package outline and high energy code

    Science.gov (United States)

    Benda, Jakub; Houfek, Karel

    2014-11-01

    Being motivated by the applied researchers’ persisting need for accurate scattering data for the collisions of electrons with hydrogen atoms, we developed a computer package-Hex-that is designed to provide trustworthy results for all basic discrete and continuous processes within non-relativistic framework. The package consists of several computational modules that implement different methods, valid for specific energy regimes. Results of the modules are kept in a common database in the unified form of low-level scattering data (partial-wave T-matrices) and accessed by an interface program which is able to produce various derived quantities like e.g. differential and integral cross sections. This article is the first one of a series of articles that are concerned with the implementation and testing of the modules. Here we give an overview of their structure and present (a) the command-line interface program hex-db that can be also easily compiled into a derived code or used as a backend for a web-page form and (b) simple illustrative module specialized for high energies, hex-dwba, that implements distorted and plane wave Born approximation. Catalogue identifier: AETH_v1_0 Program summary URL:http://cpc.cs.qub.ac.uk/summaries/AETH_v1_0.html Program obtainable from: CPC Program library, Queen’s University, Belfast, N. Ireland Licensing provisions: Standard CPC licence, http://cpc.cs.qub.ac.uk/licence/licence.html No. of lines in distributed program, including test data etc.: 30367 No. of bytes in distributed program, including test data etc.: 232032 Distribution format: tar.gz Programming language: C++11 Operating system: Any system with a C++11 compiler (e.g. GCC 4.8.1; tested on OpenSUSE 13.1 and Windows 8). RAM: Test run 3 MiB. CPC Library Classification: 2.4 Electron scattering External libraries:GSL [49], FFTW3[52], SQLite3 [46]. All of the libraries are open-source and maintained. Nature of problem: Extraction of derived (observable) quantities from partial

  13. Scattering of NH{sub 3} and ND{sub 3} with rare gas atoms at low collision energy

    Energy Technology Data Exchange (ETDEWEB)

    Loreau, J., E-mail: jloreau@ulb.ac.be [Service de Chimie Quantique et Photophysique, Université Libre de Bruxelles (ULB) CP 160/09, 50 av. F.D. Roosevelt, 1050 Brussels (Belgium); Avoird, A. van der, E-mail: A.vanderAvoird@theochem.ru.nl [Theoretical Chemistry, Institute for Molecules and Materials, Radboud University, Heyendaalseweg 135, 6525 AJ Nijmegen (Netherlands)

    2015-11-14

    We present a theoretical study of elastic and rotationally inelastic collisions of NH{sub 3} and ND{sub 3} with rare gas atoms (He, Ne, Ar, Kr, Xe) at low energy. Quantum close-coupling calculations have been performed for energies between 0.001 and 300 cm{sup −1}. We focus on collisions in which NH{sub 3} is initially in the upper state of the inversion doublet with j = 1, k = 1, which is the most relevant in an experimental context as it can be trapped electrostatically and Stark-decelerated. We discuss the presence of resonances in the elastic and inelastic cross sections, as well as the trends in the inelastic cross sections along the rare gas series and the differences between NH{sub 3} and ND{sub 3} as a colliding partner. We also demonstrate the importance of explicitly taking into account the umbrella (inversion) motion of NH{sub 3} in order to obtain accurate scattering cross sections at low collision energy. Finally, we investigate the possibility of sympathetic cooling of ammonia using cold or ultracold rare gas atoms. We show that some systems exhibit a large ratio of elastic to inelastic cross sections in the cold regime, which is promising for sympathetic cooling experiments. The close-coupling calculations are based on previously reported ab initio potential energy surfaces for NH{sub 3}–He and NH{sub 3}–Ar, as well as on new, four-dimensional, potential energy surfaces for the interaction of ammonia with Ne, Kr, and Xe, which were computed using the coupled-cluster method and large basis sets. We compare the properties of the potential energy surfaces corresponding to the interaction of ammonia with the various rare gas atoms.

  14. Hydration free energies using semiempirical quantum mechanical Hamiltonians and a continuum solvent model with multiple atomic-type parameters.

    Science.gov (United States)

    Anisimov, Victor M; Cavasotto, Claudio N

    2011-06-23

    To build the foundation for accurate quantum mechanical (QM) simulation of biomacromolecules in an aqueous environment, we undertook the optimization of the COnductor-like Screening MOdel (COSMO) atomic radii and atomic surface tension coefficients for different semiempirical Hamiltonians adhering to the same computational conditions recently followed in the simulation of biomolecular systems. This optimization was achieved by reproducing experimental hydration free energies of a set consisting of 507 neutral and 99 ionic molecules. The calculated hydration free energies were significantly improved by introducing a multiple atomic-type scheme that reflects different chemical environments. The nonpolar contribution was treated according to the scaled particle Claverie-Pierotti formalism. Separate radii and surface tension coefficient sets have been developed for AM1, PM3, PM5, and RM1 semiempirical Hamiltonians, with an average unsigned error for neutral molecules of 0.64, 0.66, 0.73, and 0.71 kcal/mol, respectively. Free energy calculation of each molecule took on average 0.5 s on a single processor. The new sets of parameters will enhance the quality of semiempirical QM calculations using COSMO in biomolecular systems. Overall, these results further extend the utility of QM methods to chemical and biological systems in the condensed phase.

  15. Third-party protection and residual risk in Atomic Energy Act. On legally dogmatic classification of paragraph 7 Atomic Energy Act in the jurisprudence of the Federal Constitutional Law and Federal Administrative Court; Drittschutz und Restrisiko im Atomrecht. Zur rechtsdogmatischen Einordnung des paragraph 7d AtG in die Rechtsprechung des Bundesverfassungs- und des Bundesverwaltungsgerichts

    Energy Technology Data Exchange (ETDEWEB)

    Arndt, Hans-Wolfgang

    2012-03-15

    On 25th June 2009, the Council of the European Union has passed the directive 2009/71/EURATOM on a common framework for nuclear safety of nuclear installations. At first, the 12th Law amending the Atomic Energy Act supplements the Atomic Energy Act by regulations which implement the directive 2009/71/EURATIM into national law. In addition, paragraph 7 Atomic Energy Act introduces a new substantive obligation of the operators of nuclear power plants. The author of the contribution reports on whether paragraph 7 Atomic Energy Act provides additional nuclear protection or reduces the potential protection by law and jurisprudence.

  16. Energy spectrum of the hydrogen atom in a space with one compactified extra dimension, R3 ×S1

    Science.gov (United States)

    Bureš, Martin

    2015-12-01

    We investigate the consequences of one extra compactified dimension for the energy spectrum of the non-relativistic hydrogen atom with a potential defined by Gauss' law, i.e. proportional to 1 /| x | 2 in non-compactified 4d space. The calculations were performed numerically by diagonalizing the Hamiltonian in two different sets of basis vectors. The energy levels and electron probability density are plotted as a function of the compactification radius. The occurrence of several physical effects is discussed and interpreted.

  17. Potential energy curves for the interaction of Ag(5s) and Ag(5p) with noble gas atoms

    CERN Document Server

    Loreau, J; Dalgarno, A

    2013-01-01

    We investigate the interaction of ground and excited states of a silver atom with noble gases (NG), including helium. Born-Oppenheimer potential energy curves are calculated with quantum chemistry methods and spin-orbit effects in the excited states are included by assuming a spin-orbit splitting independent of the internuclear distance. We compare our results with experimentally available spectroscopic data, as well as with previous calculations. Because of strong spin-orbit interactions, excited Ag-NG potential energy curves cannot be fitted to Morse-like potentials. We find that the labeling of the observed vibrational levels has to be shifted by one unit.

  18. The Russian Federation's Ministry of Atomic Energy: Programs and Developments

    Energy Technology Data Exchange (ETDEWEB)

    CM Johnson

    2000-07-24

    This paper reviews select programs driving the Ministry of Atomic Energy of the Russian Federation's (Minatom) efforts to raise funds, comments on their potential viability, and highlights areas likely to be of particular concern for the US over the next three to five years. The paper's findings are: (1) Despite numerous cabinet displacements throughout the Yeltsin administration, Yevgeny Adamov was reappointed Minister on four occasions. With Boris Yeltsin's January 1, 2000 resignation, Adamov's long-term position as the head of the Ministry is more tenuous, but he will likely retain his position until at least the March 2000 elections. Acting President Vladimir Putin is unlikely to reorganize his cabinet prior to that date and there are no signs that Putin is dissatisfied with Adamov's leadership of Minatom. (2) Adamov's chief priorities are downsizing Minatom's defense sector, increasing the oversight of subsidiary bodies by the central bureaucracy and consolidating commercial elements of the Ministry within an umbrella organization called Atomprom. (3) Viktor Mikhaylov, Adamov's predecessor and critic of his reform efforts, has been relieved of his duties as First Deputy Minister. While he retains his positions as Chief of the Science Councils and Chief Scientist at Arzamas-16, his influence on Minatom's direction is greatly diminished. Adamov will likely continue his efforts to further marginalize Mikhaylov in the coming year. (4) Securing extra-budgetary sources of income continues to be the major factor guiding Minatom's international business dealings. The Ministry will continue to aggressively promote the sale of nuclear technology abroad, often to countries with questionable nonproliferation commitments. (5) Given the financial difficulties in Russia and Minatom's client states, however, few nuclear development programs will come to fruition for a number of years, if ever. Nevertheless, certain

  19. Triple differential cross section for the near threshold single ionization of helium atoms for equal energy sharing

    Energy Technology Data Exchange (ETDEWEB)

    Purohit, G., E-mail: ghanshyam.purohit@spsu.ac.in [Department of Physics, School of Engineering, Sir Padampat Singhania University, Bhatewar, Udaipur 313 601 (India); Singh, P. [Department of Physics, School of Engineering, Sir Padampat Singhania University, Bhatewar, Udaipur 313 601 (India); Dorn, A.; Ren, X. [Max Planck Institute for Nuclear Physics, 69117 Heidelberg (Germany); Patidar, V. [Department of Physics, School of Engineering, Sir Padampat Singhania University, Bhatewar, Udaipur 313 601 (India)

    2016-05-15

    Highlights: • Present paper describes electron impact single ionization of helium atoms near threshold. • This energy range provided challenges to theoretical models due to presence of several physical effects at low energies such as second order processes, PCI, polarization, etc. • Inclusion of second Born term and target polarization is helpful to analyze the measurements. • Present paper also describes usefulness of post collisional interaction in the collision dynamics at low energies. - Abstract: Low energy electron impact single ionization triple differential cross section (TDCS) results are reported for the helium atoms in the threshold regime at 1 eV, 3 eV and 5 eV excess energy. TDCSs are calculated in the doubly symmetric kinematics for the coplanar to perpendicular emission of electrons. Present attempt to calculate TDCS in the second Born approximation and treating target polarization and post collision interaction is helpful to analyze the available measurements. The second order processes, target polarization and post collision interaction (PCI) have been found to be significant in describing the trends of TDCS and helpful to produce reasonably good agreement with measurements.

  20. Total energy management for nursing homes and other long-term care institutions

    Energy Technology Data Exchange (ETDEWEB)

    1977-01-01

    The purpose of this publication is to provide the basic instruction needed to implement the most effective form of energy conservation--Total Energy Management, or TEM--in your long-term care facility. The effort required is worthwhile for many different reasons: TEM is self-paying; TEM promotes energy conservation without negative impact on health care services; and energy costs will continue to escalate. Following the introductory chapter, chapters are titled: Understanding Energy Consumption; Initiating a Total Energy Management Program; Developing Energy Consumption Data; Conducting the Facility Survey; Developing and Implementing the Basic Plan; Communication and Motivation; Monitoring Your Program and Keeping It Effective; and Guidelines for Energy Conservation. Two appendices furnish information on building information for TEM and sources of information for energy management. (MCW)

  1. Energy, institutions and development: rightfulness and institutional conditions of a spreading of renewable energies in developing countries. The example of power generation for networks; Rapport de stage et memoire de DESS. Energie, institutions et developpement: legitimite et conditions institutionnelles d'une diffusion des energies renouvelables dans les pays en voie de developpement. L'exemple de l'electricite en reseau

    Energy Technology Data Exchange (ETDEWEB)

    Richard, M

    2004-07-01

    This study treats of the rightfulness of the promotion of renewable energy sources in a developing country like Brazil. It examines the economical and financial barriers to get over and the mechanisms necessary to be implemented to sustain the investment in renewable energy sources: institutional security, regulatory and administrative stability, long-term warranty, consistency between actions, transparency, credibility etc. (J.S.)

  2. Third-order Douglas-Kroll self-consistent field energies for the neutral atoms H to Uuo.

    Science.gov (United States)

    Saito, Shiro L

    2009-02-21

    Third-order Douglas-Kroll self-consistent field (DK3-SCF) calculations with a finite-nucleus model were carried out for the neutral atoms H to Uuo, and DK3-SCF energies were obtained for them. The basis set used was the B-spline set. The parameters of the B-spline set were determined so as to reproduce the SQR-SCF limit energies given by Gaussian-type functions (GTFs). The SQR-SCF is a self-consistent field calculation with a simplified first-order Douglas-Kroll Hamiltonian (the "SQR" Hamiltonian) and can be carried out exactly with GTFs. The DK3-SCF energies given by this B-spline set should be highly accurate. A comparison is made with the DK3-SCF energies of Nakajima and Hirao [J. Chem. Phys. 116, 8270 (2002).

  3. Tomography of atomic number and density of materials using dual-energy imaging and the Alvarez and Macovski attenuation model

    Science.gov (United States)

    Paziresh, M.; Kingston, A. M.; Latham, S. J.; Fullagar, W. K.; Myers, G. M.

    2016-06-01

    Dual-energy computed tomography and the Alvarez and Macovski [Phys. Med. Biol. 21, 733 (1976)] transmitted intensity (AMTI) model were used in this study to estimate the maps of density (ρ) and atomic number (Z) of mineralogical samples. In this method, the attenuation coefficients are represented [Alvarez and Macovski, Phys. Med. Biol. 21, 733 (1976)] in the form of the two most important interactions of X-rays with atoms that is, photoelectric absorption (PE) and Compton scattering (CS). This enables material discrimination as PE and CS are, respectively, dependent on the atomic number (Z) and density (ρ) of materials [Alvarez and Macovski, Phys. Med. Biol. 21, 733 (1976)]. Dual-energy imaging is able to identify sample materials even if the materials have similar attenuation coefficients at single-energy spectrum. We use the full model rather than applying one of several applied simplified forms [Alvarez and Macovski, Phys. Med. Biol. 21, 733 (1976); Siddiqui et al., SPE Annual Technical Conference and Exhibition (Society of Petroleum Engineers, 2004); Derzhi, U.S. patent application 13/527,660 (2012); Heismann et al., J. Appl. Phys. 94, 2073-2079 (2003); Park and Kim, J. Korean Phys. Soc. 59, 2709 (2011); Abudurexiti et al., Radiol. Phys. Technol. 3, 127-135 (2010); and Kaewkhao et al., J. Quant. Spectrosc. Radiat. Transfer 109, 1260-1265 (2008)]. This paper describes the tomographic reconstruction of ρ and Z maps of mineralogical samples using the AMTI model. The full model requires precise knowledge of the X-ray energy spectra and calibration of PE and CS constants and exponents of atomic number and energy that were estimated based on fits to simulations and calibration measurements. The estimated ρ and Z images of the samples used in this paper yield average relative errors of 2.62% and 1.19% and maximum relative errors of 2.64% and 7.85%, respectively. Furthermore, we demonstrate that the method accounts for the beam hardening effect in density (ρ) and

  4. Report of the US Department of Energy's team analyses of the Chernobyl-4 Atomic Energy Station accident sequence

    Energy Technology Data Exchange (ETDEWEB)

    1986-11-01

    In an effort to better understand the Chernobyl-4 accident of April 26, 1986, the US Department of Energy (DOE) formed a team of experts from the National Laboratories including Argonne National Laboratory, Brookhaven National Laboratory, Oak Ridge National Laboratory, and Pacific Northwest Laboratory. The DOE Team provided the analytical support to the US delegation for the August meeting of the International Atomic Energy Agency (IAEA), and to subsequent international meetings. The DOE Team has analyzed the accident in detail, assessed the plausibility and completeness of the information provided by the Soviets, and performed studies relevant to understanding the accident. The results of these studies are presented in this report.

  5. Nuclear energy and non proliferation. The role of the International Atomic Energy Agency; Energia nuclear y no proliferacion. El papel de la Organizacion Internacional de la Energia Atomica

    Energy Technology Data Exchange (ETDEWEB)

    Cooley, J.; Rauf, T.

    2008-07-01

    This article discusses the role of the International Atomic Energy Agency (IAEA) in the prevention of the spread of nuclear weapons. The IAEA verifies States compliance with their non-proliferation commitments through the application of safeguards on their civilian nuclear programmes to ensure that they are being used solely for peaceful purposes. The IAEA safeguards have evolved in the course of five decades and have become an integral part of the international non-proliferation regime and the global security system. To continue to serve the international community, they need to continue to move with the times, especially in light of the renewed interest in nuclear energy. (Author)

  6. Aerial Measuring System (AMS)/Israel Atomic Energy Commission (IAEC) Joint Comparison Study Report

    Energy Technology Data Exchange (ETDEWEB)

    Wasiolek, P. [National Security Technologies, LLC. (NSTec), Mercury, NV (United States); Halevy, I. [Israel Atomic Energy Commission (IAEC), Yavne (Israel)

    2013-12-23

    Under the 13th Bilateral Meeting to Combat Nuclear Terrorism conducted on January 8–9, 2013, the committee approved the development of a cost-effective proposal to conduct a Comparison Study of the Aerial Measuring System (AMS) of the U.S. Department of Energy (DOE), National Nuclear Security Administration (NNSA) and Israel Atomic Energy Commission (IAEC). The study was to be held at the Remote Sensing Laboratory (RSL), Nellis Air Force Base, Las Vegas, Nevada, with measurements at the Nevada National Security Site (NNSS). The goal of the AMS and the IAEC joint survey was to compare the responses of the two agencies’ aerial radiation detection systems to varied radioactive surface contamination levels and isotopic composition experienced at the NNSS, and the differing data processing techniques utilized by the respective teams. Considering that for the comparison both teams were using custom designed and built systems, the main focus of the short campaign was to investigate the impact of the detector size and data analysis techniques used by both teams. The AMS system, SPectral Advanced Radiological Computer System, Model A (SPARCS-A), designed and built by RSL, incorporates four different size sodium iodide (NaI) crystals: 1" × 1", 2" × 4" × 4", 2" × 4" ×16", and an “up-looking” 2" × 4" × 4". The Israel AMS System, Air RAM 2000, was designed by the IAEC Nuclear Research Center – Negev (NRCN) and built commercially by ROTEM Industries (Israel) and incorporates two 2" diameter × 2" long NaI crystals. The operational comparison was conducted at RSL-Nellis in Las Vegas, Nevada, during week of June 24–27, 2013. The Israeli system, Air RAM 2000, was shipped to RSL-Nellis and mounted together with the DOE SPARCS on a DOE Bell-412 helicopter for a series of aerial comparison measurements at local test ranges, including the Desert Rock Airport and Area 3 at the NNSS. A 4-person Israeli team from the IAEC NRCN supported the activity together with 11

  7. Calculations of Energy Losses due to Atomic Processes in Tokamaks with Applications to the ITER Divertor

    CERN Document Server

    Post, D; Clark, R E H; Putvinskaya, N

    1995-01-01

    Reduction of the peak heat loads on the plasma facing components is essential for the success of the next generation of high fusion power tokamaks such as the International Thermonuclear Experimental Reactor (ITER) 1 . Many present concepts for accomplishing this involve the use of atomic processes to transfer the heat from the plasma to the main chamber and divertor chamber walls and much of the experimental and theoretical physics research in the fusion program is directed toward this issue. The results of these experiments and calculations are the result of a complex interplay of many processes. In order to identify the key features of these experiments and calculations and the relative role of the primary atomic processes, simple quasi-analytic models and the latest atomic physics rate coefficients and cross sections have been used to assess the relative roles of central radiation losses through bremsstrahlung, impurity radiation losses from the plasma edge, charge exchange and hydrogen radiation losses f...

  8. Potential social, institutional, and environmental impacts of selected energy-conservation measures in two Washington communities. [Seattle and Yakima

    Energy Technology Data Exchange (ETDEWEB)

    Edelson, E.; Olsen, M.

    1980-03-01

    The likely environmental, social, and institutional impacts of selected energy-conservation measures in two communities in Washington state are reported. The five conservation measures investigated in this study were: (1) retrofitting existing buildings; (2) district heating and Integrated Community Energy Systems (ICES); (3) small automobiles and vehicle redesign; (4) land-use and housing modifications; and (5) electric-utility rate reform. Twenty potential impact areas were selected for analysis. These areas were divided into five categories of environmental impacts, economic impacts, community impacts, personal impacts, and overall quality of life in the community. The research was conducted in Seattle and Yakima, Washington. In each location, about two dozen public officials and business, labor, and community leaders were interviewed. Their diverse views are summarized. The Seattle respondents saw energy conservation as a highly desirable policy with a number of temporary, transitional problems arising as energy-conservation measures were implemented. Yakima respondents, in contrast, did not expect to encounter many serious energy problems in the foreseeable future and consequently viewed energy conservation as a relatively minor community concern. Moreover, they anticipated that many conservation measures, if implemented by the government, would encounter either apathy or resistance in their community. Two broad generalizations can bedrawn from these interviews: (1) energy conservation will basically be beneficial for the natural environment and our society; and (2) if energy conservation does become a dominant thrust in our society, it could stimulate and reinforce a much broader process of fundamental social change. (LCL)

  9. On the Coulomb corrections to the total cross section of the interaction of the $\\pi^{+}\\pi^{-}$ atom with ordinary atoms at high energy

    CERN Document Server

    Ivanov, D Yu

    1999-01-01

    The size of $\\pi^+\\pi^-$ atom in the low lying states is considerably smaller than the radius of atomic screening. Due to that we can neglect this screening calculating the contribution of multi-photon exchanges. We obtain the analytic formula for Coulomb corrections which works with a very good accuracy for the ground state of $\\pi^+\\pi^-$ atom.

  10. Estimating the activation energy of the displacement of Mg atoms in the channels of B25C4Mg1.42 crystals

    Science.gov (United States)

    Konovalikhin, S. V.; Ponomarev, V. I.

    2016-10-01

    The activation energy of displacement of Mg atoms through channels of B25C4Mg1.42 crystals is estimated using quantum chemical calculations (DFT (B3LYP potential), RHF, and UHF methods, 3-21G basis set) of the element of the structure modeling the channel and location of Mg atoms in it. The changes in the activation energy at the replacement of Mg atoms by Na and Li atoms were estimated. The greatest decreasing in the activation energy was detected for Li atoms. The obtained results can be regarded as a theoretical background for development of conducting systems based on B25C4Mg1.42 crystals.

  11. Analysis of H atoms in a negative ion source plasma with the non-equilibrium electron energy distribution function

    Energy Technology Data Exchange (ETDEWEB)

    Koga, S.; Shibata, T.; Terasaki, R.; Kameyama, N.; Hatayama, A. [Graduate School of Science and Technology, Keio University, 3-14-1 Hiyoshi, Kohoku-ku, Yokohama 223-8522 (Japan); Bacal, M. [LPP, Ecole Polytechnique, Palaiseau, UPMC, Universite PARIS-SUD 11, UMR CNRS 7648 (France); Tsumori, K. [National Institute for Fusion Science, 322-6 Oroshi-cho, Toki 509-5292 (Japan)

    2012-02-15

    In negative ion sources for the neutral beam injection, it is important to calculate H atom flux onto the plasma grid (PG) surface for the evaluation of H{sup -} production on the PG surface. We have developed a neutral (H{sub 2} molecules and H atoms) transport code. In the present study, the neutral transport code is applied to the analysis of the H{sub 2} and H transport in a NIFS-R and D ion source in order to calculate the flux onto the PG surface. Taking into account non-equilibrium feature of the electron energy distribution function (EEDF), i.e., the fast electron component, we have done the neutral transport simulation. The results suggest that the precise evaluation of the EEDF, especially in the energy range 15 eV < E < 30 eV is important for the dissociation rate of H{sub 2} molecules by the electron impact collision and the resultant H atom flux on the PG.

  12. Signatures of distinct impurity configurations in atomic-resolution valence electron-energy-loss spectroscopy: Application to graphene

    Science.gov (United States)

    Kapetanakis, Myron D.; Oxley, Mark P.; Zhou, Wu; Pennycook, Stephen J.; Idrobo, Juan-Carlos; Pantelides, Sokrates T.

    2016-10-01

    The detection and identification of impurities and other point defects in materials is a challenging task. Signatures for point defects are typically obtained using spectroscopies without spatial resolution. Here we demonstrate the power of valence electron-energy-loss spectroscopy (VEELS) in an aberration-corrected scanning transmission-electron microscope (STEM) to provide energy-resolved and atomically resolved maps of electronic excitations of individual impurities which, combined with theoretical simulations, yield unique signatures of distinct bonding configurations of impurities. We report VEELS maps for isolated Si impurities in graphene, which are known to exist in two distinct configurations. We also report simulations of the maps, based on density functional theory and dynamical scattering theory, which agree with and provide direct interpretation of observed features. We show that theoretical VEELS maps exhibit distinct and unambiguous signatures for the threefold- and fourfold-coordinated configurations of Si impurities in different energy-loss windows, corresponding to impurity-induced bound states, resonances, and antiresonances. With the advent of new monochromators and detectors with high energy resolution and low signal-to-noise ratio, the present work ushers an atomically resolved STEM-based spectroscopy of individual impurities as an alternative to conventional spectroscopies for probing impurities and defects.

  13. Laboratory Measurements of Charge Transfer on Atomic Hydrogen at Thermal Energies

    Science.gov (United States)

    Havener, C. C.; Vane, C. R.; Krause, H. F.; Stancil, P. C.; Mroczkowski, T.; Savin, D. W.

    2002-01-01

    We describe our ongoing program to measure velocity dependent charge transfer (CT) cross sections for selected ions on atomic hydrogen using the ion-aloin merged-beams apparatus at Oak Ridge Natioiial Laboralory. Our focus is on those ions for which CT plays an important role in determining the ionization structure, line emis sion, and thermal structure of observed cosmic photoionized plasmas.

  14. Continuum effects on positron scattering of atomic hydrogen at intermediate energies

    Energy Technology Data Exchange (ETDEWEB)

    Ratnavelu, Kuru [Quantum Scattering Theory Group, Institute of Mathematical Sciences, University of Malaya, 50603 Kuala Lumpur (Malaysia). E-mail: j2kurun at umcsd.um.edu.my; Rajagopal, Kalai Kumar [Quantum Scattering Theory Group, Institute of Mathematical Sciences, University of Malaya, 50603 Kuala Lumpur (Malaysia)

    1999-07-28

    An optical potential method to study the positron-hydrogen atom scattering system within the close-coupling framework that includes both the positron-hydrogen and positronium-proton channels has been implemented. Ionization, positronium formation and total cross sections are reported and are compared to other available theoretical and experimental data. (author00.

  15. Interactions of satellite-speed helium atoms with satellite surfaces. III. Drag coefficients from spatial and energy distributions of reflected helium atoms. [1235-O and 6061 T-6 aluminum

    Energy Technology Data Exchange (ETDEWEB)

    Sharma, P.K.; Knuth, E.L.

    1977-12-01

    Spatial and energy distributions of helium atoms scattered from an anodized 1235-0 aluminum surface as well as the tangential and normal momentum accommodation coefficients calculated from these distributions are reported. A procedure for calculating drag coefficients from measured values of spatial and energy distributions is given. The drag coefficient calculated for a 6061 T-6 aluminum sphere is included.

  16. Composition measurement in substitutionally disordered materials by atomic resolution energy dispersive X-ray spectroscopy in scanning transmission electron microscopy.

    Science.gov (United States)

    Chen, Z; Taplin, D J; Weyland, M; Allen, L J; Findlay, S D

    2016-10-21

    The increasing use of energy dispersive X-ray spectroscopy in atomic resolution scanning transmission electron microscopy invites the question of whether its success in precision composition determination at lower magnifications can be replicated in the atomic resolution regime. In this paper, we explore, through simulation, the prospects for composition measurement via the model system of AlxGa1-xAs, discussing the approximations used in the modelling, the variability in the signal due to changes in configuration at constant composition, and the ability to distinguish between different compositions. Results are presented in such a way that the number of X-ray counts, and thus the expected variation due to counting statistics, can be gauged for a range of operating conditions.

  17. On the effective atomic number and electron density: A comprehensive set of formulas for all types of materials and energies above 1 keV

    DEFF Research Database (Denmark)

    Manohara, S.R.; Hanagodimath, S.M.; Thind, K.S.;

    2008-01-01

    A comprehensive and consistent set of formulas is given for calculating the effective atomic number and electron density for all types of materials and for all photon energies greater than 1 keV. The are derived from first principles using photon interaction cross sections of the constituent atoms...

  18. Using Renewable Energy Purchases to Achieve Institutional Carbon Goals: A Review of Current Practices and Considerations

    Energy Technology Data Exchange (ETDEWEB)

    Bird, L.; Sumner, J.

    2011-01-01

    With organizations and individuals increasingly interested in accounting for their carbon emissions, greater attention is being placed on how to account for the benefits of various carbon mitigation actions available to consumers and businesses. Generally, organizations can address their own carbon emissions through energy efficiency, fuel switching, on-site renewable energy systems, renewable energy purchased from utilities or in the form of renewable energy certificates (RECs), and carbon offsets. This paper explores the role of green power and carbon offsets in carbon footprinting and the distinctions between the two products. It reviews how leading greenhouse gas (GHG) reporting programs treat green power purchases and discusses key issues regarding how to account for the carbon benefits of renewable energy. It also discusses potential double counting if renewable energy generation is used in multiple markets.

  19. Using Renewable Energy Purchases to Achieve Institutional Carbon Goals. A Review of Current Practices and Considerations.

    Energy Technology Data Exchange (ETDEWEB)

    Bird, Lori [National Renewable Energy Lab. (NREL), Golden, CO (United States); Sumner, Jenny [National Renewable Energy Lab. (NREL), Golden, CO (United States)

    2011-01-01

    With organizations and individuals increasingly interested in accounting for their carbon emissions, greater attention is being placed on how to account for the benefits of various carbon mitigation actions available to consumers and businesses. Generally, organizations can address their own carbon emissions through energy efficiency, fuel switching, on-site renewable energy systems, renewable energy purchased from utilities or in the form of renewable energy certificates (RECs), and carbon offsets. This paper explores the role of green power and carbon offsets in carbon "footprinting" and the distinctions between the two products. It reviews how leading greenhouse gas (GHG) reporting programs treat green power purchases and discusses key issues regarding how to account for the carbon benefits of renewable energy. It also discusses potential double counting if renewable energy generation is used in multiple markets.

  20. Using Renewable Energy Purchases to Achieve Institutional Carbon Goals. A Review of Current Practices and Considerations

    Energy Technology Data Exchange (ETDEWEB)

    Bird, Lori [National Renewable Energy Lab. (NREL), Golden, CO (United States); Sumner, Jenny [National Renewable Energy Lab. (NREL), Golden, CO (United States)

    2011-01-01

    With organizations and individuals increasingly interested in accounting for their carbon emissions, greater attention is being placed on how to account for the benefits of various carbon mitigation actions available to consumers and businesses. Generally, organizations can address their own carbon emissions through energy efficiency, fuel switching, on-site renewable energy systems, renewable energy purchased from utilities or in the form of renewable energy certificates (RECs), and carbon offsets. This paper explores the role of green power and carbon offsets in carbon footprinting and the distinctions between the two products. It reviews how leading greenhouse gas (GHG) reporting programs treat green power purchases and discusses key issues regarding how to account for the carbon benefits of renewable energy. It also discusses potential double counting if renewable energy generation is used in multiple markets.

  1. Analytic Elastic Cross Sections for Electron-Atom Scattering from Generalized Fano Profiles of Overlapping Low-Energy Shape Resonances

    CERN Document Server

    Nicoletopoulos, P

    2003-01-01

    The variation with energy of the total cross section for elastic electron scattering from atoms of several elements is caused primarily by shape resonances corresponding to the formation of temporary negative ions. It is shown that such cross sections are expressible analytically in terms of a constant background added to a "generalized Fano profile" [Durand Ph, et al (2001) J. Phys. B: At. Mol. Opt. Phys. 34, 1953, ibid (2002) 35, 469]. In three cases (sodium, magnesium and mercury), a detailed consideration proves that this representation is accurate in a fairly wide energy range. Moreover, the related momentum transfer cross sections are tailor-made for studying "elastic" electron transport in terms of the two-term solution of the Boltzmann equation: Not only are the resulting swarm transport coefficients adjustable to the experimental values, but above all they are calculable very easily because the unnormalized energy distribution is obtainable analytically. The ample saving in computational effort is ex...

  2. Institutional applications of solar total energy systems. First quarterly progress report

    Energy Technology Data Exchange (ETDEWEB)

    1977-07-01

    The meteorology followed to develop a data base for assessing market potential in the eight institutional subsectors is described. The subsectors are: elementary and high schools, colleges and universities, hospitals, military installations, public administration buildings, post offices, airports, and prisons. The market characteristics to be studied in detail are defined, and the methodology to be followed in assessing the relative economic performance of representative STE systems is given. The generic STE conceptual system design is introduced. (MHR)

  3. Legal and institutional impediments to geothermal energy resource development: a bibliography

    Energy Technology Data Exchange (ETDEWEB)

    1978-01-01

    This bibliography contains 485 references to literature on the subject of legal and institutional constraints to the development and use of geothermal resources. In addition to government-sponsored reports, journal articles, and books, the bibliography includes specific state and Federal laws and regulations, court cases of interest, and conference proceedings. For each reference, abstract or a listing of subject descriptors is given along with the complete bibliographic citation. Corporate, author, subject, and report number indexes are included. (LS)

  4. Paul Scherrer Institute Scientific Report 2000. Volume IV: Nuclear Energy and Safety

    Energy Technology Data Exchange (ETDEWEB)

    Smith, Brian; Gschwend, Beatrice [eds.

    2001-03-01

    Nuclear energy related research in Switzerland is concentrated at PSI's Nuclear Energy and Safety Research Department (NES). The activities of the department are concentrated on three main domains of: Safety and related problems of operating plants; safety features of future reactor and fuel cycles; waste management. Comprehensive assessments of energy systems are carried out in cooperation with PSI's General Energy Research Department. Many of the programs are part of collaborations with universities, industry, or international organisations. Progress in 2000 in these topical areas is described in this report. A list of scientific publications in 2000 is also provided.

  5. The Decline of the Atom and the Rise of the Sun as Future Energy Sources

    Science.gov (United States)

    Bockris, J. O'M.

    1973-01-01

    Examines the various energy sources likely to be developed in the near future, and suggests that the only satisfactory solution lies in the development of solar energy and an associated non-polluting "hydrogen economy." Concludes that Australia has ideal conditions and the technical expertise to lead in solar energy research. (JR)

  6. Memorandum of understanding between the Bureau of Sport Fisheries and Wildlife and the United States Atomic Energy Commission [Hawaiian Islands National Wildlife Refuge

    Data.gov (United States)

    US Fish and Wildlife Service, Department of the Interior — This document is a memorandum of an agreement between the U.S. Bureau of Sport Fisheries and Wildlife and the US Atomic Energy Commission. It states that the BSFW...

  7. Extrapolation of the Bethe equation for electron stopping powers to intermediate and low electron energies by empirical simulation of target effective mean excitation energy and atomic number

    Energy Technology Data Exchange (ETDEWEB)

    Maglevanny, I.I., E-mail: sianko@list.ru [Volgograd State Social Pedagogical University, 27 Lenin Avenue, Volgograd 400131 (Russian Federation); Smolar, V.A.; Nguyen, H.T.T. [Volgograd State Technical University, 28 Lenin Avenue, Volgograd 400131 (Russian Federation)

    2013-12-01

    A series of simple stopping power (SP) formulas, modified from the relativistic Bethe equation, is presented that is based on the concepts of target effective atomic number and mean excitation energy (MEE). The analytical model function is constructed to approximate experimental or calculated SPs at low electron energies and tend asymptotically to the relativistic Bethe function at high energies. The energy dependencies of our effective values, in contrast with theoretical approaches, are defined empirically by parametrization with tuning parameters. A least-squares fitting routine based on the Levenberg–Marquardt algorithm was developed. We utilize the material parameters and numerical calculations of SPs from optical data using the full Penn-algorithm. Our formula is thought to be applicable for energies above 60 eV. Our simulations of SPs for 41 elemental solids are found to be in good agreement with published numerical results. The flexibility of a general empirical formula is shown. Shortened formulas were developed that are applicable for particular energy ranges, and effective MEEs are proposed that differ from previously recommended values. The presented formulas may be used for analytical calculation of SPs over a broad projectile energy region.

  8. Research and development conference: California Institute for Energy Efficiency (CIEE) program

    Energy Technology Data Exchange (ETDEWEB)

    1991-01-01

    CIEE's first Research and Development Conference will introduce you to some of the results achieved to date through CIEE-sponsored multiyear research performed in three programs: building energy efficiency, air quality impacts of energy efficiency, and end-use resource planning. Results from scoping studies, Director's discretionary research, and exploratory research will also be featured.

  9. [National Institute for Petroleum and Energy Research] monthly progress report, February 1992

    Energy Technology Data Exchange (ETDEWEB)

    1992-03-01

    For this period, research is divided into Energy Production Research and Fuels Research. Energy Production Research includes reservoir characterization, microbial enhanced oil recovery, thermal EOR, alkaline flooding, gas flooding, flood process modelling, permeability and porosity research. Fuels Research included analysis of heavy crudes, and thermochemistry of organic nitrogen- and diheteroatom-containing compounds. The research of the Supplemental Government Program is also discussed.

  10. (National Institute for Petroleum and Energy Research) monthly progress report, February 1992

    Energy Technology Data Exchange (ETDEWEB)

    1992-03-01

    For this period, research is divided into Energy Production Research and Fuels Research. Energy Production Research includes reservoir characterization, microbial enhanced oil recovery, thermal EOR, alkaline flooding, gas flooding, flood process modelling, permeability and porosity research. Fuels Research included analysis of heavy crudes, and thermochemistry of organic nitrogen- and diheteroatom-containing compounds. The research of the Supplemental Government Program is also discussed.

  11. U.S. Atomic Energy Commission's Environmental Research Programs Established in the 1950s

    Energy Technology Data Exchange (ETDEWEB)

    Reichle, D.E.

    1999-09-22

    In 1946 the United States (U.S.) Congress passed the Atomic Energy Act and with it created the Atomic Energy Commission. For the ensuing half-century the AEC and its successors have pursued biological and environmental research with an unwavering mandate to exploit the use of fissionable and radioactive material for medical purposes and, at the same time, to ensure the health of it's workers, the public, and the environment during energy technology development and use (AEC. 1961; DOE 1983; DOE, 1997). The following pages are testimony to the success of this undeviating vision (Figure 1). From the early days of the AEC, cooperation has also linked researchers from the national laboratories, the academic community, and the private sector. The AEC-sponsored research both at national laboratories and universities, and also supported graduate students to develop a cadre of health physicists, radiation biologists, and nuclear engineers. Coordinating these diverse performers has been crucial to the unique teaming that has made many of the successes possible. The success of the biological and environmental research program has often been shared with other federal agencies. The future will demand even stronger and more substantive intraagency, interagency, and international collaborations.

  12. Spin-unrestricted random-phase approximation with range separation: Benchmark on atomization energies and reaction barrier heights

    Energy Technology Data Exchange (ETDEWEB)

    Mussard, Bastien, E-mail: bastien.mussard@upmc.fr [Sorbonne Universités, UPMC Univ Paris 06, Institut du Calcul et de la Simulation, F-75005 Paris (France); Sorbonne Universités, UPMC Univ Paris 06, UMR 7616, Laboratoire de Chimie Théorique, F-75005 Paris (France); CNRS, UMR 7616, Laboratoire de Chimie Théorique, F-75005 Paris (France); Reinhardt, Peter; Toulouse, Julien, E-mail: julien.toulouse@upmc.fr [Sorbonne Universités, UPMC Univ Paris 06, UMR 7616, Laboratoire de Chimie Théorique, F-75005 Paris (France); CNRS, UMR 7616, Laboratoire de Chimie Théorique, F-75005 Paris (France); Ángyán, János G. [CRM2, Institut Jean Barriol, Université de Lorraine, F-54506 Vandoeuvre-lés-Nancy (France); CRM2, Institut Jean Barriol, CNRS, F-54506 Vandoevre-lés-Nancy (France)

    2015-04-21

    We consider several spin-unrestricted random-phase approximation (RPA) variants for calculating correlation energies, with and without range separation, and test them on datasets of atomization energies and reaction barrier heights. We show that range separation greatly improves the accuracy of all RPA variants for these properties. Moreover, we show that a RPA variant with exchange, hereafter referred to as RPAx-SO2, first proposed by Szabo and Ostlund [J. Chem. Phys. 67, 4351 (1977)] in a spin-restricted closed-shell formalism, and extended here to a spin-unrestricted formalism, provides on average the most accurate range-separated RPA variant for atomization energies and reaction barrier heights. Since this range-separated RPAx-SO2 method had already been shown to be among the most accurate range-separated RPA variants for weak intermolecular interactions [J. Toulouse et al., J. Chem. Phys. 135, 084119 (2011)], this works confirms range-separated RPAx-SO2 as a promising method for general chemical applications.

  13. A New Determination of the Binding Energy of Atomic Oxygen on Dust Grain Surfaces: Experimental Results and Simulations

    CERN Document Server

    He, Jiao; Hopkins, Tyler; Vidali, Gianfranco; Kaufman, Michael J

    2015-01-01

    The energy to desorb atomic oxygen from an interstellar dust grain surface, $E_{\\rm des}$, is an important controlling parameter in gas-grain models; its value impacts the temperature range over which oxygen resides on a dust grain. However, no prior measurement has been done of the desorption energy. We report the first direct measurement of $E_{\\rm des}$ for atomic oxygen from dust grain analogs. The values of $E_{\\rm des}$ are $1660\\pm 60$~K and $1850\\pm 90$~K for porous amorphous water ice and for a bare amorphous silicate film, respectively, or about twice the value previously adopted in simulations of the chemical evolution of a cloud. We use the new values to study oxygen chemistry as a function of depth in a molecular cloud. For $n=10^4$ cm$^{-3}$ and $G_0$=10$^2$ ($G_0$=1 is the average local interstellar radiation field), the main result of the adoption of the higher oxygen binding energy is that H$_2$O can form on grains at lower visual extinction $A_{\\rm V}$, closer to the cloud surface. A higher ...

  14. Spin-unrestricted random-phase approximation with range separation: Benchmark on atomization energies and reaction barrier heights

    CERN Document Server

    Mussard, Bastien; Angyan, Janos; Toulouse, Julien

    2015-01-01

    We consider several spin-unrestricted random-phase approximation (RPA) variants for calculating correlation energies, with and without range separation, and test them on datasets of atomization energies and reaction barrier heights. We show that range separation greatly improves the accuracy of all RPA variants for these properties. Moreover, we show that a RPA variant with exchange, hereafter referred to as RPAx-SO2, first proposed by Sz-abo and Ostlund [A. Szabo and N. S. Ostlund, J. Chem. Phys. 67, 4351 (1977)] in a spin-restricted closed-shell formalism, and extended here to a spin-unrestricted formalism, provides on average the most accurate range-separated RPA variant for atomization energies and reaction barrier heights. Since this range-separated RPAx-SO2 method had already been shown to be among the most accurate range-separated RPA variants for weak intermolecular interactions [J. Toulouse, W. Zhu, A. Savin, G. Jansen, and J. G. {\\'A}ngy{\\'a}n, J. Chem. Phys. 135, 084119 (2011)], this works confirms...

  15. Solar-energy conversion and light emission in an atomic monolayer p-n diode.

    Science.gov (United States)

    Pospischil, Andreas; Furchi, Marco M; Mueller, Thomas

    2014-04-01

    The limitations of the bulk semiconductors currently used in electronic devices-rigidity, heavy weight and high costs--have recently shifted the research efforts to two-dimensional atomic crystals such as graphene and atomically thin transition-metal dichalcogenides. These materials have the potential to be produced at low cost and in large areas, while maintaining high material quality. These properties, as well as their flexibility, make two-dimensional atomic crystals attractive for applications such as solar cells or display panels. The basic building blocks of optoelectronic devices are p-n junction diodes, but they have not yet been demonstrated in a two-dimensional material. Here, we report a p-n junction diode based on an electrostatically doped tungsten diselenide (WSe2) monolayer. We present applications as a photovoltaic solar cell, a photodiode and a light-emitting diode, and obtain light-power conversion and electroluminescence efficiencies of ∼ 0.5% and ∼ 0.1%, respectively. Given recent advances in the large-scale production of two-dimensional crystals, we expect them to profoundly impact future developments in solar, lighting and display technologies.

  16. Firms’ strategic preferences, national institutions and the European Union’s Internal Energy Market: A challenge to European integration

    Directory of Open Access Journals (Sweden)

    Paul A. Williams

    2010-11-01

    Full Text Available "Although liberal intergovernmentalism claims that economic interest groups shape national preferences towards integration, while neofunctionalism assumes that these groups support integration for its expected economic benefits, these approaches cannot account for variation in EU integration across policy areas. We employ an analytical framework to explain divergent firm preferences towards integration in the EU-wide internal energy market. Building on Weber and Hallerberg’s (2001 specification of transaction costs and external (competitive threat as independent variables in their model of divergence in firm preferences towards ‘binding’ EU rules, our analysis incorporates domestic market structure and firms’ international relationships as intervening (contextual variables. Testing our argument in four cases - Germany, Italy, France and the UK - confirms that distinct national institutions promote divergent attitudes towards the internal energy market because domestic market structures and firms’ international settings respond to transaction costs and external threat in this market within the context of member states’ traditional local models of capitalism. In relation to theories of European integration, this study underscores the importance of varieties of capitalism in preference formation vis-à-vis integration, offering additional insights into the conditions under which national institutions have been influential in response to common external pressures in the energy market.

  17. Current status of the AMS facility at the Tono Geoscience Center of the Japan Atomic Energy Agency

    Energy Technology Data Exchange (ETDEWEB)

    Saito-Kokubu, Y., E-mail: kokubu.yoko@jaea.go.jp [Japan Atomic Energy Agency, Toki, Gifu 509-5102 (Japan); Nishizawa, A.; Suzuki, M.; Ohwaki, Y.; Nishio, T. [Pesco Corp., Ltd., Toki, Gifu 509-5123 (Japan); Matsubara, A.; Saito, T.; Ishimaru, T.; Umeda, K.; Hanaki, T. [Japan Atomic Energy Agency, Toki, Gifu 509-5102 (Japan)

    2013-01-15

    The JAEA-AMS-TONO system is routinely used for {sup 14}C measurements at Tono Geoscience Center, Japan Atomic Energy Agency (JAEA) and applied to neotectonics and hydrogeology, in support of research on geosphere stability applicable to the long-term isolation of high-level radioactive waste. {sup 10}Be AMS has been developed for geochronological studies to estimate sedimentation rates and exposure age of basement rocks, incorporating a gas ionization detector with a large-volume gas absorber cell. Test measurements on {sup 14}C and {sup 10}Be reference materials show the system's performance and suitability for application in the geosciences.

  18. Effects of the interaction between the magnetic moments of the proton and electron on the energy states of hydrogen atom

    CERN Document Server

    Dolocan, Voicu

    2014-01-01

    We make a comparison between the energy levels of the hydrogen atom, calculated by using standard methods, and that by using a modified Coulomb potential due to the interaction between the magnetic moments of the proton and electron. In this later method we use to ways. One is that in which we solve the Schroedinger equation with the modified Coulomb potential and some constraint conditions. The other is that in which we expand the modified Coulomb potential in Taylor series. The obtained results show that the first way gives a better agreement with experimental data.

  19. Human capacity and institutional development towards a sustainable energy future in Ethiopia

    Energy Technology Data Exchange (ETDEWEB)

    Mulugetta, Yacob [Centre for Environmental Strategy, University of Surrey, Guildford GU2 7XH (United Kingdom)

    2008-06-15

    The overwhelming majority of Ethiopians lack access to modern energy fuels such as electricity and liquid petroleum gas, still locked into a biomass-based energy system. As such, women and children in rural areas spend long hours of productive time and labour on woodfuel collection and the urban poor spend a sizeable proportion of their income to meet their daily energy needs. Electricity, which is at the disposal of every household in Western Europe is largely restricted to the urban centres in Ethiopia, hence indicating a strong correlation between lack of access to modern energy and poverty. The paper will analyse the reasons why Ethiopia is lagging behind the rest of the developing world in setting up a sustainable energy pathway. As such, the performance and 'mind-set' of various 'agencies', i.e. higher education system, government, energy authorities, donor agencies, etc. will be reviewed. The paper refers to a range of cases in to illustrate the challenge of building the mechanisms that allow energy technologies to be successfully disseminated, supported and integrated into rural livelihoods. The paper will provide a series of observations and recommendations to ameliorate the current state-of-affairs and ways through which the various actors (community-based organisations, government at various levels and to a lesser degree, donors) can contribute towards that end. (author)

  20. Observation of core-level binding energy shifts between (100) surface and bulk atoms of epitaxial CuInSe{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Nelson, A.J. [Colorado School of Mines, Golden, CO (United States); Berry, G.; Rockett, A. [Univ. of Illinois, Urbana-Champaign, IL (United States)] [and others

    1997-04-01

    Core-level and valence band photoemission from semiconductors has been shown to exhibit binding energy differences between surface atoms and bulk atoms, thus allowing one to unambiguously distinguish between the two atomic positions. Quite clearly, surface atoms experience a potential different from the bulk due to the lower coordination number - a characteristic feature of any surface is the incomplete atomic coordination. Theoretical accounts of this phenomena are well documented in the literature for III-V and II-VI semiconductors. However, surface state energies corresponding to the equilibrium geometry of (100) and (111) surfaces of Cu-based ternary chalcopyrite semiconductors have not been calculated or experimental determined. These compounds are generating great interest for optoelectronic and photovoltaic applications, and are an isoelectronic analog of the II-VI binary compound semiconductors. Surface core-level binding energy shifts depend on the surface cohesive energies, and surface cohesive energies are related to surface structure. For ternary compound semiconductor surfaces, such as CuInSe{sub 2}, one has the possibility of variations in surface stoichiometry. Applying standard thermodynamical calculations which consider the number of individual surface atoms and their respective chemical potentials should allow one to qualitatively determine the magnitude of surface core-level shifts and, consequently, surface state energies.

  1. [National Institute for Petroleum and Energy Research] quarterly technical report, July 1--September 30, 1991. Volume 2, Energy production research

    Energy Technology Data Exchange (ETDEWEB)

    1992-01-01

    The report is submitted in two volumes, Volume I representing the work accomplished under Fuels Research and Volume II the work for Energy Production Research during the period July 1--Sept. 30, 1991. Topics covered include: chemical flooding, gas displacement, thermal recovery, geoscience technology, resource assessment technology, microbial technology, environmental technology.

  2. Energy and the new class. [Assault of ''new breed'' of American on established institutions

    Energy Technology Data Exchange (ETDEWEB)

    King, L.

    1979-03-14

    The bounty of the US is taken for granted by its population. Nowhere is this misvaluation of a society and its benefits more evident than in the energy industries. But energy represents a tool by which society can be shaped; a device by which the standared of living and the very nature of the national lifestyle can be controlled, modified, amplified, or reduced. Two examples examined to show how energy shapes social order and human life are the women's movement and the desire to live in the Sunbelt. Five phenomena are then examined to point out the desire to restrain the nation's rampant pursuit of a higher standard of living, as opposed to the more subjective and seemingly more desirable goal of a better quality of life: the civil rights movement; the environmental movement; the Vietnam War; the Watergate scandal; and the assumption that prosperity at today's level is irreducible, concrete, and not subject to diminution. The ''new class'' is essentially made up of those educated in the liberal arts, divorced from an understanding of the mechanics of free-enterprise institutions and of the sicences. The antagonistic view of the new class of corporations and its assault on established institutions are noted. Energy companies are frustrated in telling their story, but the story that must be told is not the story of how excellently the energy sector has performed, but the story of how a new breed of Americans is seeking to remake America in its own image without the rest being aware of what is going on. (MCW)

  3. Institute a modest carbon tax to reduce carbon emissions, finance clean energy technology development, cut taxes, and reduce the deficit

    Energy Technology Data Exchange (ETDEWEB)

    Muro, Mark; Rothwell, Jonathan

    2012-11-15

    The nation should institute a modest carbon tax in order to help clean up the economy and stabilize the nation’s finances. Specifically, Congress and the president should implement a $20 per ton, steadily increasing carbon excise fee that would discourage carbon dioxide emissions while shifting taxation onto pollution, financing energy efficiency (EE) and clean technology development, and providing opportunities to cut taxes or reduce the deficit. The net effect of these policies would be to curb harmful carbon emissions, improve the nation’s balance sheet, and stimulate job-creation and economic renewal.

  4. Atomic-resolution chemical mapping of ordered precipitates in Al alloys using energy-dispersive X-ray spectroscopy.

    Science.gov (United States)

    Wenner, Sigurd; Jones, Lewys; Marioara, Calin D; Holmestad, Randi

    2017-05-01

    Scanning transmission electron microscopy (STEM) coupled with energy-dispersive X-ray spectroscopy (EDS) is a common technique for chemical mapping in thin samples. Obtaining high-resolution elemental maps in the STEM is jointly dependent on stepping the sharply focused electron probe in a precise raster, on collecting a significant number of characteristic X-rays over time, and on avoiding damage to the sample. In this work, 80kV aberration-corrected STEM-EDS mapping was performed on ordered precipitates in aluminium alloys. Probe and sample instability problems are handled by acquiring series of annular dark-field (ADF) images and simultaneous EDS volumes, which are aligned and non-rigidly registered after acquisition. The summed EDS volumes yield elemental maps of Al, Mg, Si, and Cu, with sufficient resolution and signal-to-noise ratio to determine the elemental species of each atomic column in a periodic structure, and in some cases the species of single atomic columns. Within the uncertainty of the technique, S and β" phases were found to have pure elemental atomic columns with compositions Al2CuMg and Al2Mg5Si4, respectively. The Q' phase showed some variation in chemistry across a single precipitate, although the majority of unit cells had a composition Al6Mg6Si7.2Cu2.

  5. Nuclear Polarization Correction of Atomic Energy Levels%核极化对K-原子能级的修正

    Institute of Scientific and Technical Information of China (English)

    王炳章; 游阳明; 张学龙

    2011-01-01

    基于SIC-Xα的较为严格的计算方法,对K-Pb原子体系中的Rydberg电子态的交换参数采用自洽场模型,并考虑Rydberg电子与原子实间相互作用的影响.借助此方法计算核极化用以修正C.J.Batty光学模型势下的K-Pb能级跃迁,整个计算过程不依赖任何经验参数,结果比经典方法更为精确,为奇异原子的深入分析提供了理论参考.%Based on the more stringent calculating method of SIC- Xα , the self-consistent field model is used to exchange parameters of Rydberg electron of K- Pb atoms, and the influence of the interaction between Rydberg electron and atomic kernel is considered. The nuclear polarization is calculated by using the method to correct K-Pb energy level transition under C. J. Battery optical model potential. The whole calculations is independent of empirical parameters. Its results are much more accurate than those calculated by the classical method, which provides a theoretical basis for the depth analysis of the exotic atoms.

  6. Calculation of activation energies for hydrogen-atom abstractions by radicals containing carbon triple bonds

    Science.gov (United States)

    Brown, R. L.; Laufer, A. H.

    1981-01-01

    Activation energies are calculated by the bond-energy-bond-order (BEBO) and the bond-strength-bond-length (BSBL) methods for the reactions of C2H radicals with H2, CH4, and C2H6 and for the reactions of CN radicals with H2 and CH4. The BSBL technique accurately predicts the activation energies for these reactions while the BEBO method yields energies averaging 9 kcal higher than those observed. A possible reason for the disagreement is considered.

  7. Coordination of the U.S. DOE-Argentine National Atomic Energy Commission (CNEA) science and technology implementing arrangement. Final report

    Energy Technology Data Exchange (ETDEWEB)

    Ebadian, M.A.

    1998-01-01

    In 1989, the US Department of Energy (DOE) established the Office of Environmental Management (EM) and delegated to the office the responsibility of cleaning up the US nuclear weapons complex. EM`s mission has three primary activities: (1) to assess, remediate, and monitor contaminated sites and facilities; (2) to store, treat, and dispose of wastes from past and current operations; and (3) to develop and implement innovative technologies for environmental remediation. To this end, EM has established domestic and international cooperative technology development programs, including one with the Republic of Argentina. Cooperating with Argentine scientific institutes and industry meets US cleanup objectives by: (1) identifying and accessing Argentine EM-related technologies, thereby leveraging investments and providing cost-savings; (2) improving access to technical information, scientific expertise, and technologies applicable to EM needs; and (3) fostering the development of innovative environmental technologies by increasing US private sector opportunities in Argentina in EM-related areas. Florida International University`s Hemispheric Center for Environmental Technology (FIU-HCET) serves as DOE-OST`s primary technology transfer agent. FIU-HCET acts as the coordinating and managing body for the Department of Energy (DOE)-Argentina National Atomic Energy Commission (CNEA) Arrangement. Activities include implementing standard operating procedures, tracking various technical projects, hosting visiting scientists, advising DOE of potential joint projects based on previous studies, and demonstrating/transferring desired technology. HCET hosts and directs the annual Joint Coordinating Committee for Radioactive and Mixed Waste Management meeting between the DOE and CNEA representatives. Additionally, HCET is evaluating the possibility of establishing similar arrangements with other Latin American countries.

  8. A survey on the energy consumption and demand in a tertiary institution

    Directory of Open Access Journals (Sweden)

    Sunday A. Oke

    2008-05-01

    Full Text Available The need for energy supply, particularly electricity, has been on the increase in the last two decades in developing countries such as Nigeria. Economic and industrial developments have led to this increase in demand for electricity. In universities, much of the electricity consumption is consumed in air conditioning systems, which are used to overcome the indoor thermal discomfort during harsh seasons. An amount of electricity is also consumed by laboratory equipment and machinery used for practical and demonstrations. Thus, if universities are to achieve the goals of teaching, research and community service, then proper management of electricity supplied to the system is needed in view of its limited availability. Since electrical energy in Nigeria is highly subsidised by the government, monitoring and controlling the energy consumption pattern in a university is a major aim in the country. However, there is still a lack of information about electricity end-use consumption in Nigerian universities. This paper presents the results of a walk-through energy audit conducted in a university and recommends means of tackling the problem from the demand end by focusing on the areas of potential savings flagged by the energy audit. It was noted that tackling the problem of energy demand from the users’ end is quite challenging, but it might be the only hope of the school in view of inflexibility of supply.

  9. A Conversation with Blake Simmons, Vice President, Deconstruction Division, and Jon Magnuson, Director, Fungal Biotechnology Group, Joint BioEnergy Institute, Emeryville, CA

    Energy Technology Data Exchange (ETDEWEB)

    Simmons, Blake A.; Magnuson, Jon K.

    2013-05-03

    An interview of myself and Blake Simmons conducted by Vicki Glaser, Executive Editor of Industrial Biotechnology. The subject of the interview was the relatively new PNNL led Fungal Biotechnology Group within the Joint BioEnergy Institute (JBEI).

  10. Ionization and charge transfer in high-energy ion-atom collisions

    Energy Technology Data Exchange (ETDEWEB)

    Schlachter, A.S.; Berkner, K.H.; Stearns, J.W.; Schmidt-Boecking, H.; Kelbch, S.; Ullrich, J.; Hagmann, S.; Richard, P.; Stockli, M.P.; Graham, W.G.

    1986-11-01

    Electron capture and loss by fast highly charged ions in a gas target, and ionization of the target by passage of the fast projectile beam, are fundamental processes in atomic physics. These processes, along with excitation, can be experimentally studied separately (''singles'') or together (''coincidence''). This paper is a review of recent results on singles measurements for electron capture and loss and for target ionization, for velocities which are generally high relative to the active electron, including recent ionization measurements for a nearly relativistic projectile. 11 refs., 6 figs.

  11. Low energy (anti)atoms for precision tests of basic physics

    CERN Document Server

    Silveira, D M; Veloso, M; Cesar, C L

    2001-01-01

    Recent advances in techniques to manipulate and study, with high precision, atomic hydrogen, from one hand, and successful trapping schemes for positrons and antiprotons, from the other hand, have encouraged the pursuit of experiments to test CPT violation and the weak equivalence principle (WEP) through the comparison of hydrogen and antihydrogen. A description of the hydrogen trap and laser system being built in Rio, to trap and perform high resolution spectroscopy on cold hydrogen, is presented along with a discussion on the techniques and experimental system being implemented by the ATHENA collaboration at CERN to produce cold antihydrogen. A new technique to make a cold antihydrogen beam is proposed. (25 refs).

  12. Heat pump centered integrated community energy systems: system development. Georgia Institute of Technology final report

    Energy Technology Data Exchange (ETDEWEB)

    Wade, D.W.; Trammell, B.C.; Dixit, B.S.; McCurry, D.C.; Rindt, B.A.

    1979-12-01

    Heat Pump Centered-Integrated Community Energy Systems (HP-ICES) show the promise of utilizing low-grade thermal energy for low-quality energy requirements such as space heating and cooling. The Heat Pump - Wastewater Heat Recovery (HP-WHR) scheme is one approach to an HP-ICES that proposes to reclaim low-grade thermal energy from a community's wastewater effluent. This report develops the concept of an HP-WHR system, evaluates the potential performance and economics of such a system, and examines the potential for application. A thermodynamic performance analysis of a hypothetical system projects an overall system Coefficient of Performance (C.O.P.) of from 2.181 to 2.264 for waste-water temperatures varying from 50/sup 0/F to 80/sup 0/F. Primary energy source savings from the nationwide implementation of this system is projected to be 6.0 QUADS-fuel oil, or 8.5 QUADS - natural gas, or 29.7 QUADS - coal for the period 1980 to 2000, depending upon the type and mix of conventional space conditioning systems which could be displaced with the HP-WHR system. Site-specific HP-WHR system designs are presented for two application communities in Georgia. Performance analyses for these systems project annual cycle system C.O.P.'s of 2.049 and 2.519. Economic analysis on the basis of a life cycle cost comparison shows one site-specific system design to be cost competitive in the immediate market with conventional residential and light commercial HVAC systems. The second site-specific system design is shown through a similar economic analysis to be more costly than conventional systems due mainly to the current low energy costs for natural gas. It is anticipated that, as energy costs escalate, this HP-WHR system will also approach the threshold of economic viability.

  13. Calibration of a new experimental chamber for PIXE analysis at the Accelerator Facilities Division of Atomic Energy Centre Dhaka (AECD)

    Energy Technology Data Exchange (ETDEWEB)

    Hassan, Md. Taufique, E-mail: thassan@tulane.edu [Department of Physics, University of Dhaka (Bangladesh); Shariff, Md. Asad [Tandem Accelerator Facilities division, INST, AERE, Savar (Bangladesh); Hossein, Amzad; Abedin, Md. Joynal [Accelerator Facilities division, AECD (Bangladesh); Fazlul Hoque, A.K.M. [Daffodil International University, Dhaka (Bangladesh); Chowdhuri, M.S. [Department of Physics, University of Dhaka (Bangladesh)

    2015-05-01

    A new experimental chamber has been installed at the 3 MV Van de Graaff Accelerator Facilities Division in the Atomic Energy Centre, Dhaka, to perform different Ion Beam Analysis (IBA) techniques. The calibration of this new setup for Particle Induced X-ray Emission (PIXE) technique has been done using a set of thin MicroMatter standards and GUPIX (PIXE spectrum analysis software), which is explicated in this paper. The effective thicknesses of the beryllium window of the X-ray detector and of the different absorbers used were determined. For standardization, the so called instrumental constant H (product of detector solid angle and the correction factor for the setup) as function of X-ray energy were determined and stored inside the GUPIX library for further PIXE analysis.

  14. Incipient manifestation of the shell structure of atoms within the WDA model for the exchange and kinetic energy density functionals

    Science.gov (United States)

    Glossman, M. D.; Balbás, L. C.; Alonso, J. A.

    1995-07-01

    The radial electron density obtained for all the atoms of the main groups of the Periodic Table through the solution of the Euler equation associated with the nonlocal weighted density approximation (WDA) for the exchange and kinetic energy density functionals shows an incipient shell structure which is absent in other calculations using kinetic energy functionals based on the electronic density. The WDA radial density reveals two local maxima and the position of the first maximum correlates with the position of the maximum for the 1s orbital in the Hartree-Fock approximation. The cusp condition at the nucleus is fulfilled accurately. Also we study the density-based electron localization function (DELF) as a complementary procedure for the visualization of shells.

  15. Paul Scherrer Institute Scientific Report 1998. Volume IV: Nuclear Energy and Safety

    Energy Technology Data Exchange (ETDEWEB)

    Birchley, Jon; Ringele, Ruth [eds.

    1999-09-01

    Nuclear energy related research in Switzerland is concentrated at PSI`s Nuclear Energy and Safety Research Department (NES). The total effort invested in nuclear energy research in 1998 amounted to about 195 py/a and 4.5 millions CHF of investment and maintenance costs. Approximately half of the salary, investment and maintenance costs are externally funded, primarily by the Swiss Utilities, the national co-operative for the disposal of nuclear waste (NAGRA), the Federal Office of Energy (BFE) through the nuclear safety inspectorate (HSK) and the Federal Office for Science and Education (BBW) in connection with the EC Framework Programmes; an increasing part of external funding is coming from domestic and foreign industry (nuclear component and fuel suppliers). The activities of the department are concentrated on three main domains of: Safety and related problems of operating plants; safety features of future reactor and fuel cycles; waste management. 4 % of the total resources are invested in addressing more global aspects of energy. Many of the programs are part of collaborations with universities, industry, or international organisations. A list of scientific publications in 1998 is included. (author) figs., tabs., refs.

  16. Paul Scherrer Institute Scientific Report 1999. Volume IV: Nuclear Energy and Safety

    Energy Technology Data Exchange (ETDEWEB)

    Smith, Brian; Gschwend, Beatrice [eds.

    2000-07-01

    Nuclear energy related research in Switzerland is concentrated at PSI's Nuclear Energy and Safety Research Department (NES). The total effort invested in nuclear energy research in 1999 amounted to about 185 py/a and 4.7 MCHF of investment and maintenance costs. Approximately half of the salary, investment and maintenance costs are externally funded, primarily by the Swiss Utilities, the national co-operative for the disposal of nuclear waste (NAGRA), the Federal Office of Energy (BFE) through the nuclear safety inspectorate (HSK) and the Federal Office for Science and Education (BBW) in connection with the EU Framework Programmes; an increasing part of external funding is coming from domestic and foreign industry (nuclear component and fuel suppliers). The activities of the department are concentrated on three main domains of: Safety and related problems of operating plants; safety features of future reactor and fuel cycles; waste management. 4 % of the total resources are invested in addressing more global aspects of energy. Many of the programs are part of collaborations with universities, industry, or international organisations. Progress in 1999 in these topical areas is described in this report. A list of scientific publications in 1999 is also provided.

  17. Spectral and Atomic Physics Analysis of Xenon L-Shell Emission From High Energy Laser Produced Plasmas

    Science.gov (United States)

    Thorn, Daniel; Kemp, G. E.; Widmann, K.; Benjamin, R. D.; May, M. J.; Colvin, J. D.; Barrios, M. A.; Fournier, K. B.; Liedahl, D.; Moore, A. S.; Blue, B. E.

    2016-10-01

    The spectrum of the L-shell (n =2) radiation in mid to high-Z ions is useful for probing plasma conditions in the multi-keV temperature range. Xenon in particular with its L-shell radiation centered around 4.5 keV is copiously produced from plasmas with electron temperatures in the 5-10 keV range. We report on a series of time-resolved L-shell Xe spectra measured with the NIF X-ray Spectrometer (NXS) in high-energy long-pulse (>10 ns) laser produced plasmas at the National Ignition Facility. The resolving power of the NXS is sufficiently high (E/ ∂E >100) in the 4-5 keV spectral band that the emission from different charge states is observed. An analysis of the time resolved L-shell spectrum of Xe is presented along with spectral modeling by detailed radiation transport and atomic physics from the SCRAM code and comparison with predictions from HYDRA a radiation-hydrodynamics code with inline atomic-physics from CRETIN. This work was performed under the auspices of the U.S. Department of Energy by LLNL under Contract DE-AC52-07NA27344.

  18. Mid-South solar total energy: institutional analysis. Final report, May 1, 1978-December 31, 1979

    Energy Technology Data Exchange (ETDEWEB)

    Powe, R.E.; Carley, C.T.; Forbes, R.E.; Johnson, L.R.; Stiffler, A.K.; Hodge, B.K.; Bouchillon, C.W.

    1979-01-01

    A comprehensive survey was undertaken to determine the current usage of energy by the Mississippi State University, considering electricity and fuel separately. A variety of individual components likely to be employed in total energy systems are then considered in detail, including: solar assisted space heating system, space cooling system design, solar electric system, flat plate solar collector system, central solar receiver, and geothermal heat pump system. Also, algorithms have been developed for the approximate prediction of building heating and cooling loads based on gross parameters such as floor area, type of wall construction, etc. System considerations and evaluation are then presented. (LEW)

  19. Angular distribution of sputtered atoms induced by low-energy heavy ion bombardment

    Institute of Scientific and Technical Information of China (English)

    ZHANG Lai; ZHANG Zhu-Lin

    2004-01-01

    The sputtering yield angular distributions have been calculated based on the ion energy dependence of total sputtering yields for Ni and Motargets bombarded by low-energy Hg+ ion. The calculated curves show excellent agreement with the corresponding Wehner's experimental results of sputtering yield angular distribution. The fact clearly demonstrated the intrinsic relation between the ion energy dependence of total sputtering yields and the sputtering yield angular distribution. This intrinsic relation had been ignored in Yamamura's papers (1981,1982) due to some obvious mistakes.

  20. Prediction of Tetraoxygen Reaction Mechanism with Sulfur Atom on the Singlet Potential Energy Surface

    Directory of Open Access Journals (Sweden)

    Ashraf Khademzadeh

    2014-01-01

    Full Text Available The mechanism of S+O4 (D2h reaction has been investigated at the B3LYP/6-311+G(3df and CCSD levels on the singlet potential energy surface. One stable complex has been found for the S+O4 (D2h reaction, IN1, on the singlet potential energy surface. For the title reaction, we obtained four kinds of products at the B3LYP level, which have enough thermodynamic stability. The results reveal that the product P3 is spontaneous and exothermic with −188.042 and −179.147 kcal/mol in Gibbs free energy and enthalpy of reaction, respectively. Because P1 adduct is produced after passing two low energy level transition states, kinetically, it is the most favorable adduct in the 1S+1O4 (D2h atmospheric reactions.

  1. Long-range correlation energy calculated from coupled atomic response functions

    CERN Document Server

    Ambrosetti, Alberto; DiStasio, Robert A; Tkatchenko, Alexandre

    2013-01-01

    An accurate determination of the electron correlation energy is essential for describing the structure, stability, and function in a wide variety of systems, ranging from gas-phase molecular assemblies to condensed matter and organic/inorganic interfaces. Even small errors in the correlation energy can have a large impact on the description of chemical and physical properties in the systems of interest. In this context, the development of efficient approaches for the accurate calculation of the long-range correlation energy (and hence dispersion) is the main challenge. In the last years a number of methods have been developed to augment density functional approximations via dispersion energy corrections, but most of these approaches ignore the intrinsic many-body nature of correlation effects, leading to inconsistent and sometimes even qualitatively incorrect predictions. Here we build upon the recent many-body dispersion (MBD) framework, which is intimately linked to the random-phase approximation for the co...

  2. Institutional options for rural energy access: Exploring the concept of the multifunctional platform in West Africa

    DEFF Research Database (Denmark)

    Nygaard, Ivan

    2010-01-01

    in the dominant discourse of development, and how including concerns, such as poverty alleviation, gender equity, local democracy, decentralisation and the environment, have attracted donors outside the energy sector. The paper thus argues that, while the integration of multiple technical functions, preconceived...

  3. The National Energy Policy Institute (NEPI) at The University of Tulsa (FINAL REPORT)

    Energy Technology Data Exchange (ETDEWEB)

    Blais, Roger [The University of Tulsa

    2013-10-31

    NEPI, a non-profit organization located at The University of Tulsa (TU), was established to develop and disseminate national energy policy recommendations. Research under this grant covered a wide variety of projects, including research into the future of nuclear power, oil market pricing, and the feasibility of biofuels.

  4. (National Institute for Petroleum and Energy Research) quarterly technical report, July 1--September 30, 1991

    Energy Technology Data Exchange (ETDEWEB)

    1992-01-01

    The report is submitted in two volumes, Volume I representing the work accomplished under Fuels Research and Volume II the work for Energy Production Research during the period July 1--Sept. 30, 1991. Topics covered include: chemical flooding, gas displacement, thermal recovery, geoscience technology, resource assessment technology, microbial technology, environmental technology.

  5. Energy Quantization and Probability Density of Electron in Intense-Field-Atom Interactions

    Institute of Scientific and Technical Information of China (English)

    敖淑艳; 程太旺; 李晓峰; 吴令安; 付盘铭

    2003-01-01

    We find that, due to the quantum correlation between the electron and the field, the electronic energy becomes quantized also, manifesting the particle aspect of light in the electron-light interaction. The probability amplitude of finding electron with a given energy is given by a generalized Bessel function, which can be represented as a coherent superposition of contributions from a few electronic quantum trajectories. This concept is illustrated by comparing the spectral density of the electron with the laser assisted recombination spectrum.

  6. Paul Scherrer Institut Scientific Report 2001. Volume IV: Nuclear Energy and Safety

    Energy Technology Data Exchange (ETDEWEB)

    Smith, B.L. (ed.)

    2002-03-01

    The year 2001 was marked by the extensive audit of energy research at PSI. The audit took place on 21/22 June, and nuclear energy research was evaluated by five international experts. It was possible to present the quality and relevance of our research in a convincing way. This, together with optimal use of the available resources in our department Nuclear Energy and Safety (NES), prompted the highly welcome result that the auditors attested a high degree of scientific quality to the NES projects in general, with some of them judged to be of world-class standard. They recommended all audited projects be maintained, adequate resources to be allocated accordingly and, if necessary, an increase of public funding in nuclear energy research to be granted to achieve this. Finally, it was recommended that energy research should be explicitly mentioned in the statement of the ultimate mission of PSI. At the level of 'daily work', efforts in several directions related to the future of the Hotlab were one of the main focuses during the past year. On the one hand, the safety-related backfitting of the facility (particularly in regard to fire protection) has been continued, and was coupled with intensive planning studies, and with a thorough radiological cleaning of the labs; this invariably led to some impediment to the current research activities. Despite external burdens, which have led to some delays and additional costs, three of the four refurbishment phases have been completed, and the corresponding laboratories were brought back into operation after inspection and approval by the regulatory authority HSK. Given the size and complexity of the project, progress must be considered very satisfactory. A list of scientific publications in 2000 is also provided.

  7. Residual risks of the 13{sup th} amendment to the German Atomic Energy Act; Restrisiken der 13. Atomgesetzaenderung

    Energy Technology Data Exchange (ETDEWEB)

    Schneider, Horst

    2011-08-15

    The 13th amendment to the German Atomic Energy Act, which was adopted by the German federal parliament on June 30 and entered into force on August 6, 2011, must be judged in the light of its genesis. Federal Chancellor Merkel, in her government declaration of June 9, 2011, had mentioned topics such as residual risk, safety standards, and risk assumptions, on which the federal government, in the week after the event of March 11, 2011, had commissioned the Advisory Committee on Reactor Safeguards (RSK) to conduct a comprehensive safety review of all German nuclear power plants, and appointed an Ethics Committee to write an opinion on safe energy supply. On the basis of quickly drafted reports, the federal cabinet, without any international harmonization (EU, IEA), adopted a draft opt out law on June 6, 2011. How should the declarations by the Federal Chancellor on June 9, 2011 be classified in terms of atomic energy law? In her words, it all revolved around the residual risk. The debate, which has been shifted to the realm of constitutional law, is open to considerations and steps to attack the new opt out law on grounds of material unconstitutionality (violation of the property guarantee under Sec. 14 or the principle of equality under Art.3 of the Basic Law). As far as final storage is concerned, the amendment to the German Atomic Energy Act announced still for this year, also for transposition of the EURATOM Directive of July 19, 2011 about nuclear waste management, the ''re-assessment of the residual risk'' is not likely to play a role. All these events are reminiscent of a sentence by former Federal Chancellor Schmidt: ''The history of the NATO dual-track decision remains a textbook case showing that even in a democracy emotions using ethical arguments, mixed with demagogy, can become strong enough to cast aside balanced reason.'' There is also a distinction by Max Weber between ''ethics of ideology

  8. A general discrete variable method to calculate vibrational energy levels of three- and four-atom molecules

    Science.gov (United States)

    Bramley, Matthew J.; Carrington, Tucker, Jr.

    1993-12-01

    We present a general variational method to calculate vibrational energy levels of polyatomic molecules without dynamical approximation. The method is based on a Lanczos algorithm, which does not require storage of the Hamiltonian matrix. The rate-determining step of each Lanczos iteration is the evaluation of the product of the matrix and a trial vector. We use simple product basis functions and write the Hamiltonian as a sum of factorizable terms. With n one-dimensional functions in each of f dimensions, the matrix-vector product requires no more than cnf+1 multiplications for a single term involving c coordinates. Choosing a (potential optimized) discrete variable representation (DVR) in each dimension, the potential energy matrix is diagonal. The rate-determining step is now the multiplication of a vector by the kinetic energy matrix and c is effectively (with rare exceptions) at most two. The nf+1 scaling holds for both diagonal and mixed second derivative operators. The method is directly applicable to any three-atom and any nonlinear four-atom molecule. We use a variety of coordinate systems (Jacobi, Radau, a hybrid of the two, and bond), for which the total number of factorizable terms in the exact kinetic energy operator is never large, to calculate very well-converged band origins of H2O up to 22 000 cm-1, of H+3 up to 18 000 cm-1, and of CH2O up to 5700 cm-1; and low-lying levels of H2O2. The results for CH2O are new, and those for H+3 clarify the causes of discrepancies in published work. The product basis results in very large matrices (up to 500 000×500 000 for four atoms), but the cost is within an order of magnitude of that of contracted-basis approaches using explicit diagonalization. While contracted basis approaches are molecule and Hamiltonian specific, it was possible to apply the DVR-Lanczos method to all the examples presented here with a single computer program. The principal advantage of our method is thus its generality, and in this

  9. HEALTH CARE INSTITUTIONS ENERGY CONSERVATION STATUS AND THOUGHTS%我国医疗卫生机构节能工作现状与思考

    Institute of Scientific and Technical Information of China (English)

    侯惠荣; 李兆宇

    2015-01-01

    Health care institutions energy conservation work is an important part of national public service institutions energy conservation work. The article explains the urgency and importance of health care institutions energy conservation work; describes the progress of the energy conservation work; and gives advice to carry out energy-saving work in the future.%医疗卫生机构的节能工作是我国公共服务机构节能领域的一项重要内容。文章概述了我国医疗卫生机构节能工作的紧迫性和重要性,阐述了医疗卫生机构节能工作的进展情况,并提出了未来开展节能工作的建议。

  10. The H + OCS hot atom reaction - CO state distributions and translational energy from time-resolved infrared absorption spectroscopy

    Science.gov (United States)

    Nickolaisen, Scott L.; Cartland, Harry E.

    1993-01-01

    Time-resolved infrared diode laser spectroscopy has been used to probe CO internal and translational excitation from the reaction of hot H atoms with OCS. Product distributions should be strongly biased toward the maximum 1.4 eV collision energy obtained from 278 nm pulsed photolysis of HI. Rotations and vibrations are both colder than predicted by statistical density of states theory, as evidenced by large positive surprisal parameters. The bias against rotation is stronger than that against vibration, with measurable population as high as v = 4. The average CO internal excitation is 1920/cm, accounting for only 13 percent of the available energy. Of the energy balance, time-resolved sub-Doppler line shape measurements show that more than 38 percent appears as relative translation of the separating CO and SH fragments. Studies of the relaxation kinetics indicate that some rotational energy transfer occurs on the time scale of our measurements, but the distributions do not relax sufficiently to alter our conclusions. Vibrational distributions are nascent, though vibrational relaxation of excited CO is unusually fast in the OCS bath, with rates approaching 3 percent of gas kinetic for v = 1.

  11. Development of electrostatic supercapacitors by atomic layer deposition on nanoporous anodic aluminium oxides for energy harvesting applications

    Directory of Open Access Journals (Sweden)

    Lucia eIglesias

    2015-03-01

    Full Text Available Nanomaterials can provide innovative solutions for solving the usual energy harvesting and storage drawbacks that take place in conventional energy storage devices based on batteries or electrolytic capacitors, because they are not fully capable for attending the fast energy demands and high power densities required in many of present applications. Here, we report on the development and characterization of novel electrostatic supercapacitors made by conformal Atomic Layer Deposition on the high open surface of nanoporous anodic alumina membranes employed as templates. The structure of the designed electrostatic supercapacitor prototype consists of successive layers of Aluminium doped Zinc Oxide, as the bottom and top electrodes, together Al2O3 as the intermediate dielectric layer. The conformality of the deposited conductive and dielectric layers, together with their composition and crystalline structure have been checked by XRD and electron microscopy techniques. Impedance measurements performed for the optimized electrostatic supercapacitor device give a high capacitance value of 200 µF/cm2 at the frequency of 40 Hz, which confirms the theoretical estimations for such kind of prototypes, and the leakage current reaches values around of 1.8 mA/cm2 at 1 V. The high capacitance value achieved by the supercapacitor prototype together its small size turns these devices in outstanding candidates for using in energy harvesting and storage applications.

  12. An Overview of the Cooperative Effort between the United States Department of Energy and the China Atomic Energy Authority to Enhance MPC&A Inspections for Civil Nuclear Facilities in China

    Energy Technology Data Exchange (ETDEWEB)

    Ahern, Keith [U.S. Enrichment Corporation Paducah Gaseous Diffusion Plant; Daming, Liu [China Institute of Atomic Energy (CIAE); Hanley, Tim [U.S. Department of Energy, NNSA; Livingston, Linwood [Pacific Northwest National Laboratory (PNNL); McAninch, Connie [U.S. Department of Energy, NNSA; McGinnis, Brent R [ORNL; Ning, Shen [China Institute of Atomic Energy (CIAE); Qun, Yang [China Institute of Atomic Energy (CIAE); Roback, Jason William [ORNL; Tuttle, Glenn [U.S. Nuclear Regulatory Commission; Xuemei, Gao [China Institute of Atomic Energy (CIAE); Galer, Regina [U.S. National Nuclear Security Administration; Peterson, Nancy [U.S. National Nuclear Security Administration; Jia, Jinlie [China Atomic Energy Authority (CAEA)

    2011-01-01

    Institute of Atomic Energy (CIAE) in Beijing. This paper provides details of the successful cooperation between DOE/NNSA and CAEA for all phases of the cooperative effort to enhance civil domestic MPC&A inspections in China.

  13. Understanding the response of commercial and institutional organizations to the California energy crisis. A report to the California Energy Commission - Sylvia Bender, Project Manager

    Energy Technology Data Exchange (ETDEWEB)

    Lutzenhiser, Loren; Janda, Kathryn; Kunkle, Rick; Payne, Christopher

    2002-07-24

    Beginning in the summer of 2000, California experienced serious energy supply problems, sharp increases in wholesale (and retail) electricity and natural gas prices, and isolated blackouts. In response to the rapidly worsening electricity situation in California in late 2000, the state set, as an initial goal, the reduction of the state's peak demand for the summer of 2001 by 5,000 megawatts. To meet this goal, the governor and legislature took a variety of steps to enhance supply, encourage rapid voluntary reductions in demand, and provide incentives for actions that would result in load reductions. Three bills-Assembly Bill 970, Senate Bill X1 5 and Assembly Bill X1 29-allocated roughly $950 million for consumption and demand reduction programs. The governor also enacted a variety of additional measures, including the ''Flex Your Power'' (media awareness and direct business involvement) campaign, requirements for retail sector outdoor lighting reductions, and toughening of energy efficiency building codes. There were, in fact, significant reductions in electricity demand in California during the summer of 2001 and the large number of expected supply disruptions was avoided. To understand the nature of these demand reductions and the motivations for consumer response, Washington State University (WSU) undertook a study for the California Energy Commission (CEC) focusing on conservation behavior in the residential, commercial, and agricultural sectors. The research presented in this report represents an exploration of the response of commercial and institutional organizations to the California energy situation and the unique set of influences that existed during this time. These influences included informational messages and media attention, program interventions, price changes, and external triggering events (e.g., blackouts). To better understand the effects of these influences on organizational response to the energy situation, we

  14. Nuclear law: transports. Nuclear civil liability. International cooperation and trade. Non proliferation and peaceful use of atomic energy; Droit nucleaire: transports. Responsabilite civile nucleaire. Cooperation et commerce internationaux. Non-proliferation et utilisation de l'energie atomique a des fins pacifiques

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    2006-07-15

    The object of this work is since its first edition in 1983 under the title 'Collection of nuclear activities legislation and regulation ' to realize an ordered collection of texts constituting the juridical and institutional frame of nuclear activities, gathering the legislative, regulatory and technical texts; the international, European and national texts. Aiming to include the whole of the atom applications, this collection tackles various themes, in ten chapters. The volume number five is constituted by the following chapters: Transports; nuclear civil liability; international trading and cooperation; nonproliferation and peaceful use of nuclear energy. (N.C.)

  15. Children in school cafeterias select foods containing more saturated fat and energy than the Institute of Medicine recommendations.

    Science.gov (United States)

    Martin, Corby K; Thomson, Jessica L; LeBlanc, Monique M; Stewart, Tiffany M; Newton, Robert L; Han, Hongmei; Sample, Alicia; Champagne, Catherine M; Williamson, Donald A

    2010-09-01

    In this study, we examined if children's food selection met the School Meals Initiative (SMI) standards and the recently released Institute of Medicine (IOM) recommendations. Mean food selection, plate waste, and food intake were also examined. Food intake of 2049 4th-6th grade students was measured objectively at lunch over 3 d with digital photography in 33 schools. The percent of children whose food selection met the SMI standards and IOM recommendations for energy (kJ), fat and saturated fat, calcium, iron, and vitamin A and C were calculated. The SMI standards provide lower limits for most nutrients; the IOM provides a range of values, including an upper limit for energy. Seventy-seven percent of children's energy selection met the SMI lower limit, but only 16% of children met the IOM's recommended range and 74% of children exceeded the upper limit. More than 70% of children exceeded the SMI and IOM's saturated fat recommendations. Children selected (mean +/- SD) 3168 +/- 621 kJ, discarded 882 +/- 581 kJ, and consumed 2286 +/- 716 kJ. Children were less likely to discard fat than carbohydrate, resulting in proportionally more fat being consumed. Most children met SMI and IOM recommendations for protein, calcium, iron, and vitamin A. With few exceptions, energy selection was similar among groups of children, but plate waste differed (P < 0.001), resulting in greater energy intake among boys compared with girls, Caucasians compared with African Americans, and heavier compared with lighter children. Children's selection was high in saturated fat and, based on IOM criteria, included excess energy.

  16. Theoretical characterization of the potential energy surface for H + O2 yields HO2(asterisk) yields HO + O. II - The potential for H atom exchange in HO2

    Science.gov (United States)

    Walch, Stephen P.; Rohlfing, Celeste Mcmichael

    1989-01-01

    The results of CASSCF multireference contracted CI calculations with large ANO basis sets are presented for the exchange region of the HO2 potential-energy surface. The saddle point for H atom exchange is about 13 kcal/mol below the energy of H + O2; therefore, this region of the surface should be accessible during H + O2 recombination and methathesis reactions.

  17. The dependence of the atomic energy levels on a superstrong magnetic field with account of a finite nucleus radius and mass

    CERN Document Server

    Godunov, S I

    2013-01-01

    The influence of the finiteness of the proton radius and mass on the energies of a hydrogen atom and hydrogen-like ions in a superstrong magnetic field is studied. The finiteness of the nucleus size pushes the ground energy level up leading to a nontrivial dependence of the value of critical nucleus charge on the external magnetic field.

  18. Atomic phase diagram

    Institute of Scientific and Technical Information of China (English)

    LI Shichun

    2004-01-01

    Based on the Thomas-Fermi-Dirac-Cheng model, atomic phase diagram or electron density versus atomic radius diagram describing the interaction properties of atoms of different kinds in equilibrium state is developed. Atomic phase diagram is established based on the two-atoms model. Besides atomic radius, electron density and continuity condition for electron density on interfaces between atoms, the lever law of atomic phase diagram involving other physical parameters is taken into account, such as the binding energy, for the sake of simplicity.

  19. Non-radioactive waste management in a Nuclear Energy Research Institution

    Energy Technology Data Exchange (ETDEWEB)

    Furusawa, Helio A.; Martins, Elaine A.J.; Cotrim, Marycel E.B.; Pires, Maria A. F., E-mail: helioaf@ipen.br, E-mail: elaine@ipen.br, E-mail: mecotrim@ipen.br, E-mail: mapires@ipen.br [Instituto de Pesquisas Energeticas e Nucleares (IPEN/CNEM-SP), Sao Paulo, SP (Brazil). Centro de Quimica e Meio Ambiente

    2013-07-01

    For more than 50 years, non-radioactive materials have been used in processes at IPEN to support the nuclear fuel development and all related activities. Reagents, raw materials, products and by-products have been stored. Many of these are hazardous highly toxic or reactants materials. Some years ago actions sent part of these non-radioactive waste materials to proper disposal (technical incineration) resulting in an Institutional Non-Radioactive Waste Management Program. In 2005, an internal set of procedures and information entitled - Guia de Procedimentos para Armazenamento, Tratamento e Descarte de Residuos de Laboratorio Quimico - (Guide of Procedures for Storage, Treatment, and Disposal of Chemistry Laboratory Wastes) - was published to be used at the IPEN's facilities. A data base managed by software was created in order to allow the Units to input data and information about the routinely generated wastes and those already existing. Even after disposing so huge amount of wastes, a latent demand still exists. Several goals were achieved notably a well-organized and roomy space; safer storage places; local, state, and nationwide laws enforcement (for radioactive and non-radioactive materials); and improvement in chemicals control as hazardous and aged materials are more frequently disposed. A special stress was conducted to know and follow laws, regulations, and technical norms as the entire process is very detailed and this is not a day-by-day routine for the IPEN's technical personnel. The immediate consequence is that the safer the workplace the safer the nuclear related activities are done. (author)

  20. Physical and chemical nature of the scaling relations between adsorption energies of atoms on metal surfaces

    DEFF Research Database (Denmark)

    Calle-Vallejo, F.; Martínez, J. I.; García Lastra, Juan Maria;

    2012-01-01

    phenomenon between any set of adsorbates bound similarly to the surface. On the example of the near-surface alloys of Pt, we show that scalability is a result of identical variations of adsorption energies with respect to the valence configuration of both the surface components and the adsorbates....