set RWIGS
Posted: Tue Dec 04, 2007 6:01 pm
Dear VASP users,
I am using VASP with PAW pseudopotencials for TiCO .I would like to know what happens if I do not set the RWIGS values in the INCAR file alloys? Should I set the RWIGS values?
I observed that if I do not set the RWIGS in the INCAR file, VASP set the RWIGS to -1 in the OUTCAR.
...
Atomic Wigner-Seitz radii
RWIGS = -1.00 -1.00 -1.00
...
Best Regards
I am using VASP with PAW pseudopotencials for TiCO .I would like to know what happens if I do not set the RWIGS values in the INCAR file alloys? Should I set the RWIGS values?
I observed that if I do not set the RWIGS in the INCAR file, VASP set the RWIGS to -1 in the OUTCAR.
...
Atomic Wigner-Seitz radii
RWIGS = -1.00 -1.00 -1.00
...
Best Regards