[QE-users] error in recovering phonon calculation

[Paolo Giannozzi]

On Mon, Oct 19, 2020 at 7:35 AM Jacopo Simoni <simonij at tcd.ie> wrote:

>
> I am using recover=true
>

recover=.true., "dot true dot". Code version?

Paolo

On Sun, 18 Oct 2020 at 22:12, Oscar Baseggio <obaseggi at sissa.it> wrote:
>
>> Dear Jacopo,
>> It's hard to understand what's happening without the error, the only
>> error that I see in your input is in recover.
>>
>> Recover =true, >>>> recover =.true.,
>>
>> Best regards
>> Oscar Baseggio
>>
>>
>> Il 2020-10-19 01:35 Jacopo Simoni ha scritto:
>> > Dear QE users,
>> > I am running a phonon calculation, the calculation is quite long and
>> > expensive so I need to restart it a couple of times before I complete
>> > it.
>> > The first run ends smoothly, but when I try to restart it I get an
>> > error because it is not able to restart from the previous run.
>> > This is my input file
>> > %%%%%%%%%%%%%%%%%%%%%%%%%%%%
>> >
>> > phonons - mithrene
>> >  &inputph
>> >   recover=true,
>> >   max_seconds=39600,
>> >   tr2_ph=1.0d-12,
>> >   prefix='mthr',
>> >   ldisp=.true.,
>> >   nq1=1, nq2=1, nq3=1,
>> >   amass(1)=107.86820,
>> >   amass(2)=78.96000,
>> >   amass(3)=12.01070,
>> >   amass(4)=1.00794,
>> >   outdir='/lustre/scratch3/turquoise/jacopo/mithrene3/data.save/',
>> >   fildyn='mthr.dyn',
>> >  /
>> > %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>> > I appreciate any suggestion.
>> > Thanks, Jacopo Simoni
>> > Research associate, Lawrence Berkeley National Lab.
>> > _______________________________________________
>> > Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
>> > users mailing list users at lists.quantum-espresso.org
>> > https://lists.quantum-espresso.org/mailman/listinfo/users
>> _______________________________________________
>> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
>> users mailing list users at lists.quantum-espresso.org
>> https://lists.quantum-espresso.org/mailman/listinfo/users
>>
> _______________________________________________
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> users mailing list users at lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users



-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20201019/572d8426/attachment.html>