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out_cif_diamond [2009/08/31 16:02]
johnsoevans
out_cif_diamond [2009/11/18 16:47] (current)
dch3sl
Line 1: Line 1:
 ====== Output cif file for Diamond ====== ====== Output cif file for Diamond ======
 Description:​ outputs cif data in a file format that Diamond will import. Description:​ outputs cif data in a file format that Diamond will import.
-Contributed by: Pamela Whitfield 
  
-<code topas>'​Description:​ output cif file for Diamond +Contributed by: Pamela Whitfield
-'Why: outputs Biso in format that Diamond will import properly +
-'Contributed by: Pamela Whitfield+
  
-macro Out_CIF_Diamond(file)+<code topas>macro Out_CIF_Diamond(file)
 { {
    out file    out file

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