[Pw_forum] Relax output

2013-05-27 Thread Andrei Malashevich
gt; > Thanks, > Yantao Wu > > ___ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum > -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20130527/c20c41bb/attachment.html

[Pw_forum] restart_mode

2013-05-27 Thread Paolo Giannozzi
Restart is tricky. In the current version of QE, if I remember correctly, it works only if you specify " disk_io='high' " in both the interrupted and restarted run, which however sometimes increases disk I/O to unacceptable level. If your job doesn't restart, get the latest useful atomic/lattice

[Pw_forum] Relax output

2013-05-27 Thread Yantao Wu
ttachments/20130527/dfbc3018/attachment.html

[Pw_forum] restart_mode

2013-05-27 Thread Giuseppe Mattioli
Dear Sakhraoui Taoufik Which kind of calculation? For example, an EXX calculation can restart properly only under particular circumstances. HTH Giuseppe On Monday 27 May 2013 10:42:13 Sakhrawi Taoufek wrote: > Dear all, > i am doing relax calculation, i want to restart calculation from the last

[Pw_forum] restart_mode

2013-05-27 Thread Sakhrawi Taoufek
ere is all files *.wfc *.save *.igk there is any idea how to fix that. thinks Sakhraoui Taoufik Phd student, LMCN Monastir, Tunisia -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachment