The changes is ETEST/CTEST are not relevant, ignore them.
You probably setup the cell badly, with inappropriate lattice parameters or
symmetry. Use a viewer (e.g. Xcrygen) to look at it and check the
interatomic distances.
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Laurence Marks
Dept Mat Sci & Eng
Northwest
Dear Users
I am running optimization for a ternary half metallic ferromagnet at 75
doping. But I am unable to get the minimum energy point in the parabolic
curve. , Gmax is 12, and Rkmax is 7. 100 k-points are given and generated
k-points were 12 like this:
symmetry operations without inversion
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