Space fullerenes: A computer search for new Frank-Kasper structures

Mathieu Dutour Sikirić, Olaf Delgado-Friedrichs, Michel Deza

    Research output: Contribution to journalArticlepeer-review

    63 Citations (Scopus)

    Abstract

    A Frank-Kasper structure is a 3-periodic tiling of the Euclidean space E3by tetrahedra such that the vertex figure of any vertex belongs to four specified patterns with, respectively, 20, 24, 26 and 28 faces. Frank-Kasper structures occur in the crystallography of metallic alloys and clathrates. A new computer enumeration method has been devised for obtaining Frank-Kasper structures of up to 20 cells in a reduced fundamental domain. Here, the 84 obtained structures have been compared with the known 27 physical structures and the known special constructions by Frank-Kasper-Sullivan, Shoemaker-Shoemaker, Sadoc-Mosseri and Deza-Shtogrin.

    Original languageEnglish
    Pages (from-to)602-615
    Number of pages14
    JournalActa Crystallographica Section A: Foundations of Crystallography
    Volume66
    Issue number5
    DOIs
    Publication statusPublished - 1 Sept 2010

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