Dear everyone:
When i compute a supercell with 64 atoms, i encounter such a problem-
lapw1.error:
Cholesky INFO=7178
'SECLR4'-POTRF(Scalapack/LAPACK) failed.
Please help me!
yours
DW Liu
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20060313/ab4d4307/attachment.html