IERR=0 Error reading item 'MAGMOM'
Posted: Tue Sep 13, 2005 12:11 pm
Hi there,
A noncollinear calculation halted almost immediately with the message:
Error reading item 'MAGMOM' from file INCAR.
Error code was IERR=0 ... . Found N= 49 data.
There are 19 ions in the POSCAR file and it reads that fine. The MAGMOM line is:
MAGMOM = 0.05 -0.05 4.0 0.02 -0.07 4.0 -0.03 -0.04 4.0 0.06 0.01 4.0 0.00 -0.05 4.0 0.00 0.08 4.0 -0.05 0.03 4.0 -0.05 -0.04 4.0 0.06 -0.02 4.0 0.02 -0.04 4.0 -0.07 -0.01 4.0 -0.00 0.05 4.0 -0.03 0.06 4.0 -0.03 -0.04 4.0 0.06 0.01 4.0 0.00 -0.05 4.0 0.00 0.08 4.0 -0.05 0.03 4.0 -0.05 -0.04 4.0
which is 19 sets of 3-vectors in the form which I thought was correct for a noncollinear calculation.
Can anyone see what's wrong?
Thanks
Ben
A noncollinear calculation halted almost immediately with the message:
Error reading item 'MAGMOM' from file INCAR.
Error code was IERR=0 ... . Found N= 49 data.
There are 19 ions in the POSCAR file and it reads that fine. The MAGMOM line is:
MAGMOM = 0.05 -0.05 4.0 0.02 -0.07 4.0 -0.03 -0.04 4.0 0.06 0.01 4.0 0.00 -0.05 4.0 0.00 0.08 4.0 -0.05 0.03 4.0 -0.05 -0.04 4.0 0.06 -0.02 4.0 0.02 -0.04 4.0 -0.07 -0.01 4.0 -0.00 0.05 4.0 -0.03 0.06 4.0 -0.03 -0.04 4.0 0.06 0.01 4.0 0.00 -0.05 4.0 0.00 0.08 4.0 -0.05 0.03 4.0 -0.05 -0.04 4.0
which is 19 sets of 3-vectors in the form which I thought was correct for a noncollinear calculation.
Can anyone see what's wrong?
Thanks
Ben