• DocumentCode
    2760123
  • Title

    A General Enumeration Method for Models of Crystal Structures

  • Author

    Klein, Hans Joachim

  • Author_Institution
    Inst. fur Inf., Christian-Albrechts-Univ., Kiel, Germany
  • fYear
    2009
  • fDate
    11-16 Oct. 2009
  • Firstpage
    29
  • Lastpage
    34
  • Abstract
    A graph-based method is described allowing to generate models of crystal structures for a given set of parameters. It uses symmetry-labeled periodic graphs and is complete insofar as all possible topologies are enumerated. Parameters and information on symmetries are taken into account as early as possible in order to reduce the number of graphs in intermediate results significantly.
  • Keywords
    crystal structure; graph theory; crystal structures model; general enumeration method; graph based method; symmetry labeled periodic graph; Anisotropic magnetoresistance; Buildings; Computer applications; Crystallography; Filling; Periodic structures; Proposals; Topology; Vectors; crystal structures; enumeration method; symmetry-labeled graphs; topological view;
  • fLanguage
    English
  • Publisher
    ieee
  • Conference_Titel
    Advanced Engineering Computing and Applications in Sciences, 2009. ADVCOMP '09. Third International Conference on
  • Conference_Location
    Sliema
  • Print_ISBN
    978-1-4244-5082-4
  • Electronic_ISBN
    978-0-7695-3829-7
  • Type

    conf

  • DOI
    10.1109/ADVCOMP.2009.13
  • Filename
    5359640
    • Link To Document
    https://search.isc.ac/dl/search/defaultta.aspx?DTC=49&DC=2760123