Bilbao crystallographic server: Useful databases and tools for phase-transition studies

被引:751
作者
Kroumova, E [1 ]
Aroyo, MI
Perez-Mato, JM
Kirov, A
Capillas, C
Ivantchev, S
Wondratschek, H
机构
[1] Univ Basque Country, Dept Fis Mat Condensada, E-48080 Bilbao, Spain
[2] Univ Basque Country, Dept Fis Aplicada 2, E-48080 Bilbao, Spain
[3] Univ Sofia, Dept Condensed Matter Phys, BU-1126 Sofia, Bulgaria
[4] Univ Karlsruhe, Inst Kristallog, D-76128 Karlsruhe, Germany
关键词
space groups; group-subgroup relations; representations of space groups; pseudosymmetry;
D O I
10.1080/0141159031000076110
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The Bilbao Crystallographic Server is a web site with crystallographic programs and databases available on-line. The programs give access to general information related to space groups (generators, general positions, Wyckoff positions, irreducible representations), group-subgroup or group-supergroup pairs of space groups, and/or results on specific crystal structures. The utility of the programs is illustrated by treating phase-transition problems related to structural pseudosymmetry. The programs can be accessed through the main page of the server (www.cryst.ehu.es) and can be used free of charge with any web browser.
引用
收藏
页码:155 / 170
页数:16
相关论文
共 21 条
  • [1] STRUCTURAL BASIS OF FERROELECTRICITY AND FERROELASTICITY
    ABRAHAMS, SC
    KEVE, ET
    [J]. FERROELECTRICS, 1971, 2 (02) : 129 - +
  • [2] [Anonymous], 18 EUR CRYST M PRAH
  • [3] [Anonymous], 1998, J APPL CRYSTALLOGR, DOI DOI 10.1107/S0021889898005524
  • [4] CRYSTALLOGRAPHIC VIEWPOINTS IN THE CLASSIFICATION OF SPACE-GROUP REPRESENTATIONS
    AROYO, MI
    WONDRATSCHEK, H
    [J]. ZEITSCHRIFT FUR KRISTALLOGRAPHIE, 1995, 210 (04): : 243 - 254
  • [5] Cracknell A.P., 1979, Kronecker product tables. Vol. 1, V1
  • [6] CSEUNANB5O15 - 1ST MEMBER OF A NEW FERROELECTRIC FAMILY
    DION, M
    GANNE, M
    TOURNOUX, M
    [J]. JOURNAL OF SOLID STATE CHEMISTRY, 1984, 53 (03) : 422 - 429
  • [7] HAHN T, 1995, SPACE GROUP SYMMETRY, VA
  • [8] Search for Pnma materials with high-temperature structural phase transitions
    Igartua, JM
    Aroyo, MI
    Kroumova, E
    Perez-Mato, JM
    [J]. ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS, 1999, 55 : 177 - 185
  • [9] SUBGROUPGRAPH:: a computer program for analysis of group-subgroup relations between space groups
    Ivantchev, S
    Kroumova, E
    Madariaga, G
    Pérez-Mato, JM
    Aroyo, MI
    [J]. JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2000, 33 : 1190 - 1191
  • [10] IVANTCHEV S, 2002, IN PRESS J APPL CRYS