Publication Date:
1998
abstract:
SYMMOL is a new stand-alone program to find the maximum symmetry compatible with a given tolerance. The input requirements are cell parameters, atomic coordinates and the tolerance. The output is a set of symmetrized coordinates, the point-group label and the point-group elements. Some parameters quantifying the deviation from the exact symmetry are also calculated.
Iris type:
05.11 Software
List of contributors: