Crystallographic Information Framework

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Index

Core dictionary (coreCIF) version 2.4.5

Category EXPTL_CRYSTAL_FACE

Name:
'_exptl_crystal_face_[]'

Definition:

   Data items in the EXPTL_CRYSTAL_FACE category record details
   of the crystal faces.

Example:

Example 1 - based on structure PAWD2 of Vittal & Dean [Acta Cryst. (1996), C52, 1180-1182]. 
 
    loop_
    _exptl_crystal_face_index_h
    _exptl_crystal_face_index_k
    _exptl_crystal_face_index_l
    _exptl_crystal_face_perp_dist
         0   -1   -2    .18274
         1    0   -2    .17571
        -1    1   -2    .17845
        -2    1    0    .21010
        -1    0    2    .18849
         1   -1    2    .20605
         2   -1    0    .24680
        -1    2    0    .19688
         0    1    2    .15206


Type: null

Category: category_overview


International Tables for Crystallography

Volume G: Definition and exchange of crystallographic data

First online edition (2006)

Edited by S. R. Hall and B. McMahon

An essential guide and reference to CIF for programmers, data managers handling crystal-structure information and practising crystallographers.