[Wien] Bug in lapw2 -almd ?

Gary Amini aminigary at gmail.com
Thu Apr 25 11:03:54 CEST 2019


Dear all,

We are interested in obtaining the ALM, BLM and CLM coefficients.
However, we have noticed that lapw2 -almd gives very different results if
we run the serial or parallel versions of Wien2k. The difference is up to a
factor of 10^10.

Is this a bug, or is it not yet possible to run lapw2 -almd with the
parallel version?
<Wien at zeus.theochem.tuwien.ac.at>

Best whishes,
Gary
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