Error for test of Monte Carlo simulation (MC-MD)
Samuel Andermatt
samuel.a... at student.ethz.ch
Mon Aug 22 14:10:38 UTC 2016
Ok, I see what you did. You moved keywords from subsections of MC into the
MC section.
Insted of
&MC
PMSWAP
PMTRAION
PMTRANS
PMVOLUME
&END MC
write
&MC
&MOVE_PROBABILITIES
PMSWAP
PMTRAION
PMTRANS
PMVOLUME
&END MOVE_PROBABILITIES
&END MC
etc.....
you made this mistake many times
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20160822/020f946b/attachment.htm>
More information about the CP2K-user
mailing list