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POSCAR2CIF:
POSCAR2CIF converter - determines space group and prepares a CIF-file from a POSCAR file. Detailed description can be found
here
.
Validity of the resulted CIF-file can be checked
here
.
Example:
POSCAR
Authors:
Harold T. Stokes
(space group code),
Maksim Rakitin
(web interface)
POSCAR:
Note:
POSCAR file must have the line with elements names!
Tolerance:
default: 0.02, valid values: 0-0.2