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Structure refinement using precession electron diffraction tomography and dynamical diffraction: theory and implementation

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216208%3A11320%2F15%3A10318481" target="_blank" >RIV/00216208:11320/15:10318481 - isvavai.cz</a>

  • Alternative codes found

    RIV/68378271:_____/15:00455910

  • Result on the web

    <a href="http://dx.doi.org/10.1107/S2053273315001266" target="_blank" >http://dx.doi.org/10.1107/S2053273315001266</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1107/S2053273315001266" target="_blank" >10.1107/S2053273315001266</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    Structure refinement using precession electron diffraction tomography and dynamical diffraction: theory and implementation

  • Original language description

    Accurate structure refinement from electron-diffraction data is not possible without taking the dynamical-diffraction effects into account. A complete three-dimensional model of the structure can be obtained only from a sufficiently complete three-dimensional data set. In this work a method is presented for crystal structure refinement from the data obtained by electron diffraction tomography, possibly combined with precession electron diffraction. The principle of the method is identical to that used in X-ray crystallography: data are collected in a series of small tilt steps around a rotation axis, then intensities are integrated and the structure is optimized by least-squares refinement against the integrated intensities. In the dynamical theory ofdiffraction, the reflection intensities exhibit a complicated relationship to the orientation and thickness of the crystal as well as to structure factors of other reflections. This complication requires the introduction of several specia

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

  • CEP classification

    BM - Solid-state physics and magnetism

  • OECD FORD branch

Result continuities

  • Project

    <a href="/en/project/GA13-25747S" target="_blank" >GA13-25747S: Nanoobjects of ternary transition metal silicide-germanides for photovoltaics: morphology, structural and phase relationships, and physical properties</a><br>

  • Continuities

    S - Specificky vyzkum na vysokych skolach<br>I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace

Others

  • Publication year

    2015

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Acta Crystallographica Section A: Foundations of Crystallography

  • ISSN

    0108-7673

  • e-ISSN

  • Volume of the periodical

    71

  • Issue of the periodical within the volume

    A71

  • Country of publishing house

    DK - DENMARK

  • Number of pages

    10

  • Pages from-to

    235-244

  • UT code for WoS article

    000350544400013

  • EID of the result in the Scopus database

    2-s2.0-84924025545