you use just one input file with : restart_mode='restart', from the begining
> Date: Tue, 3 Jun 2014 17:03:21 +0530 > From: manchugh at iitk.ac.in > To: pw_forum at pwscf.org > Subject: [Pw_forum] pwscf restart problem > > Dear QE users > > I am running a relax calculation for 5x5 unit cell. Due to less number of > available processors, I had to restart the calculation twice after the > walltime exceeds the limit. For the first time, I made copy of my first > input file with some another name and changed the restart_mode from > "from_scratch" to "restart". It worked perfectly. > For the second time also, I made copy of my second input file with some > another name and ran it. But for the second restart, calculation has been > stopped at iteration 1. Is it wrong to do restart the calculation twice. > > Thanks for any help > Regards > -- > Manjusha > Research Scholar > Department of Chemistry > Indian Institute of Technology,Kanpur > U.P., India 208016 > > > > _______________________________________________ > 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/20140603/efda40c8/attachment.html
