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Use ofSPIDERandSPIREin image reconstruction

A. Leith、William T. Baxter、Joachim Frank2012-02-27International Tables for Crystallography

SPIDER is a comprehensive command-operated suite of programs for image processing in electron microscopy, with special emphasis on single-particle reconstruction. This chapter provides an outline of the way SPIDER and SPIRE, its interactive graphical user interface, may be used to obtain a three-dimensional reconstruc…

Advanced Electron Microscopy Techniques and ApplicationsElectron and X-Ray Spectroscopy Techniques

Macromolecular model building and validation usingCoot

Paul Emsley、Bernhard Lohkamp、Kevin Cowtan2012-02-27International Tables for Crystallography

The Coot software package is a tool for interactive macromolecular model building and validation. The software is designed to be easy to learn for novice users by ensuring that tools for common tasks are ‘discoverable’ without consulting the documentation, while also providing enhanced usability for experts through cu…

Enzyme Structure and FunctionVarious Chemistry Research Topics

New Materials and Processes

Wen Zhe Chen、Qiang Li、Yong Lu Chen 等 5 位作者2012-02-27Trans Tech Publications Ltd. eBooks

This comprehensive work contains up-to-date information, gathered from all over the world, concerning state-of-the art manufacturing science and engineering, focusing on New Materials and Processes. The 534 peer-reviewed papers are grouped into 16 chapters: Non-Ferrous Metallic Materials; Iron and Steel; Micro/Nano Ma…

Corrosion Behavior and InhibitionIonic liquids properties and applicationsLayered Double Hydroxides Synthesis and Applications

Investigation of Carbon Tetrachloride Destruction by Copper Acetate

Yi‐Chi Chien2012-02-27Journal of Environmental Quality

Halogenated synthetic organic compounds are used in a wide variety of pesticides, solvents, refrigerants, fire retardants, and paints that cause extensive pollution to the air, surface water, groundwater, and soils. Carbon tetrachloride (CCl) is a typical halogenated synthetic organic compound that has been suspected…

Analytical chemistry methods developmentRadioactive element chemistry and processingThermal and Kinetic Analysis

Predicting the Long-Term Field Performance of Coating Systems on Steel Using a Rapid Electrochemical Test: The Damage Tolerance Test

S. R. Taylor、F. Contu、Leonardo Calle 等 5 位作者2012-02-27CORROSION

Abstract The pace of coatings development is limited by the time required to assess their corrosion protection properties. This study takes a step forward from past studies and correlates the corrosion performance of protective coatings assessed by a series of short-term electrochemical measurements with 18 month and…

Corrosion Behavior and InhibitionConcrete Corrosion and DurabilityNon-Destructive Testing Techniques

Hydrogen Permeation Properties and Chemical Stability of Novel Pd‐Free Alloy Membranes Based on the V‐Y System

Edoardo Magnone、Sung Il Jeon、J. H. Park 等 4 位作者2012-02-27Chemical Engineering & Technology

Abstract No investigation has yet been accomplished to screen the yttrium‐doped effects on vanadium‐based metal membranes. Synthesis, hydrogen permeation properties, and chemical stability of a novel palladium (Pd)‐coated V99Y1 alloy membrane are presented. Hydrogen permeation experiments have been performed to invest…

Catalysts for Methane ReformingHydrogen Storage and MaterialsMembrane Separation and Gas Transport

Emissive properties of SiO2 thin films through photonic windows

David Hernández、M. Garín、T. Trifonov 等 5 位作者2012-02-27Applied Physics Letters

In this work, we study the selective emission properties of silicon-based three-dimensional photonic crystals coated with thin films of silicon dioxide presenting temperature emission measurements at 600 K of oxidized macroporous silicon structures. The photonic band gap of the structure is centered at 9 μm with 2.5 μ…

Photonic and Optical DevicesPhotonic Crystals and ApplicationsSilicon Nanostructures and Photoluminescence

Electronic Structure Properties of Graphene/Boron Nitride Layered Systems

Max Petulante、Nam B. Le、Lilia M. Woods2012-02-27OpenAlex

We explore the properties of systems composed of two or three layers of graphene and hexagonal boron nitride (h-BN) using the Vienna Ab-Initio Simulation Package (VASP), a software package for performing first principles simulations based on density functional theory (DFT). Particular attention is given to the contrib…

Graphene research and applicationsBoron and Carbon Nanomaterials ResearchMXene and MAX Phase Materials

Anomalous low-temperature magnetic and magnetotransport properties in Ru-deficient SrRuO3

Chanchal Sow、D. Samal、P. S. Anil Kumar2012-02-27Journal of Applied Physics

SrRuO3 is a well-known itinerant ferromagnet with many intriguing characteristics. The Ru deficiency in this system is believed to play a pivotal role in influencing many of its magnetic and transport properties. The present study involves the magnetic and transport properties of the Ru-deficient SrRu0.93O3 sample to…

Magnetic and transport properties of perovskites and related materialsMultiferroics and related materialsAdvanced Condensed Matter Physics

Enhancing the Efficiency and Contrast Ratio of White Organic Light-Emitting Diode Using Energy-Recyclable Photovoltaic Cells

Meiso Yokoyama、Chung-Ming Wu、Shui‐Hsiang Su2012-02-27Japanese Journal of Applied Physics

We demonstrate that power recycling is feasible by using a semitransparent strip of Al electrode as an interconnecting layer to merge a white organic light-emitting device (WOLED) and an organic photovoltaic (OPV) cell. The device is called a photovoltaic organic light-emitting device (PVOLED). It has a glass/indium t…

Organic Electronics and PhotovoltaicsOrganic Light-Emitting Diodes ResearchConducting polymers and applications

Introduction to cryocrystallography

H. Hope、Sean Parkin2012-02-27International Tables for Crystallography

A general introduction to cryocrystallography is provided. The chapter covers crystal mounting, cooling of biocrystals, principles of cooling equipment and frost prevention. Operational considerations, such as dual-stream instruments, electrically heated nozzles, temperature calibration and transfer of crystals to dif…

Enzyme Structure and FunctionCrystallization and Solubility Studiesthermodynamics and calorimetric analyses

Detecting twinning by merohedry

Todd O. Yeates、Yingssu Tsai2012-02-27International Tables for Crystallography

The chapter defines various kinds of twinning and focuses on the detection and analysis of twinning by hemihedry. The perfect overlap of lattices causes distinct intensities to be added together, thereby affecting the intensity distribution as well as the apparent symmetry properties of the crystal, to a degree determ…

Crystal Structures and PropertiesSolid-state spectroscopy and crystallographyInorganic Fluorides and Related Compounds

Thermoelectric efficiency of nanowires with long-range surface disorder

Gürsoy B. Akgüç、Oğuz Gülseren2012-02-27Physical Review B

The electron transmission plays an important role in the design of thermoelectric devices made up from silicon nanowires. It has been shown that the transmission spectra of a rough silicon wire can be modified by introducing long-range correlations to its disordered surface. Although using the linear response theory i…

Advanced Thermoelectric Materials and DevicesAdvanced Thermodynamics and Statistical MechanicsThermal Radiation and Cooling Technologies

Pressure dependence of the large polaron transport in anatase $TiO_{2}$ single crystals

Ja 'cim Ja 'cimovi 'c、C. Vaju、H. Berger 等 7 位作者2012-02-27Bulletin of the American Physical Society

We have measured the pressure and temperature dependences of the resistivity and the thermoelectric power of anatase, TiO2. The resistivity varies with T 3 at high temperatures, and its absolute value is in the 1 Ωcm range. Below 60 K, the resistivity is activated. Most surprisingly, the activation energy shows non-mo…

Chalcogenide Semiconductor Thin FilmsMagnetic and transport properties of perovskites and related materialsElectronic and Structural Properties of Oxides

Morphology control and optical properties of SiGe nanostructures grown on glass substrate

Hsu-Kai Chang、Si‐Chen Lee2012-02-27Nanoscale Research Letters

With the rapid progress of nanotechnology, nanostructures with different morphologies have been realized, which may be very promising to enhance the performance of semiconductor devices. In this study, SiGe nanostructures with several kinds of configurations have been synthesized through a chemical vapor deposition pr…

Semiconductor materials and devicesSilicon Nanostructures and PhotoluminescenceNanowire Synthesis and Applications

Fabrication of [001] L1-FePtRh ferro-antiferromagnetic pattern by flat-patterning method

Takashi Hasegawa、T. Tomioka、Yuji Kondo 等 5 位作者2012-02-27Journal of Applied Physics

A flat-patterning method that exploits the ferromagnetic (FM) – antiferromagnetic (AF) transition in [001]-oriented L10 FePt1-xRhx films was investigated. FM–AF patterns with dot diameters between 15 and 1000 nm were fabricated by locally diffusing a small percentage of FePt atoms onto the FePt1-xRhx film. The geometr…

Magnetic properties of thin filmsMetal and Thin Film MechanicsCopper Interconnects and Reliability

Organometallic‐complex‐grafted adamantane as novel hydrogen‐storage material: A first principles computation

Xiaodong Li、Hong Zhang、Yongjian Tang 等 4 位作者2012-02-27physica status solidi (b)

Abstract A novel type of hydrogen‐storage materials C10H16–m–(RTi‐nH2)m (m = 1–4, n = 1–5, R = C5H4, C6H5) was theoretically designed by grafting the organometallic complexes C5H5Ti and C6H6Ti onto the adamantane C10H16. The calculated binding energies of the organometallic complexes reveal that the grafting processes…

Advanced Battery Materials and TechnologiesHydrogen Storage and MaterialsHybrid Renewable Energy Systems

Application of Laser Remelting Treatments to Improve the Properties of Ti6Al4V Alloy

M. R. Amaya‐Vázquez、J.M. Sánchez-Amaya、Zouhair Boukha 等 5 位作者2012-02-27Materials science forum

Ti6Al4V is the α-β alloy most employed in industry. The modification of its properties can be achieved with conventional heat treatments and/or with laser processing. Laser remelting (LR) has been applied to Ti6Al4V by other authors with excimer and Nd-YAG laser, employing pure argon as shielding gas to prevent risk o…

Additive Manufacturing Materials and ProcessesHigh Entropy Alloys StudiesTitanium Alloys Microstructure and Properties

Ab initiophasing of low-resolution Fourier syntheses

Vladimir Y. Lunin、Alexandre Urzhumtsev、A. Podjarny2012-02-27International Tables for Crystallography

Low-resolution phasing addresses the cases where experimental X-ray diffraction intensities are only available to a low-resolution limit, or when the standard phasing methods to solve macromolecular structures fail. Ab initio phasing is based on general properties of macromolecular objects (connectivity, electron-dens…

Computational Drug Discovery MethodsEnzyme Structure and FunctionMachine Learning in Materials Science

Polyurethane Organosilicate Nanocomposites as Blood Compatible Coatings

Johnson Chung、Menno L. W. Knetsch、Léo H. Koole 等 5 位作者2012-02-27Coatings

Polymer clay nanocomposites (NCs) show remarkable potential in the field of drug delivery due to their enhanced barrier properties. It is hypothesised that well dispersed clay particles within the polymer matrix create a tortuous pathway for diffusing therapeutic molecules, thereby resulting in more sustained release…

Orthopaedic implants and arthroplastyElectrospun Nanofibers in Biomedical ApplicationsPolymer Surface Interaction Studies