[Pw_forum] Error in routine phq_readin (5010)

Louis Fry-Bouriaux ellf at leeds.ac.uk
Fri Feb 24 19:21:49 CET 2017


Paolo you are right, just tested it, I recalled having an issue in PWSCF where the &control namelist was happy with a comma, and the &system as I recall seemed to not like a comma on the last parameter, it must have been something else then, sorry again [☹]


Louis

________________________________
From: pw_forum-bounces at pwscf.org <pw_forum-bounces at pwscf.org> on behalf of dario rocca <roccad at gmail.com>
Sent: 24 February 2017 18:14:36
To: PWSCF Forum
Subject: Re: [Pw_forum] Error in routine phq_readin (5010)

Dear Sunetra,
you input file works for me with QE 6.0
I just get the following warning

     Message from routine phq_readin:

     iverbosity is obsolete, use "verbosity" instead


Best,

Dario Rocca

On Fri, Feb 24, 2017 at 8:54 AM, Sunetra Das <sunetra.das.88 at gmail.com<mailto:sunetra.das.88 at gmail.com>> wrote:
Hello all,

I am trying to run the ph.x code for my system in espress0-5.0.3, but the code stops with the following error code:



 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     Error in routine phq_readin (5010):
     reading inputph namelist
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%


Following is my input:

phonon
 &INPUTPH
                      outdir = './tmp' ,
                      prefix = 'In4' ,
                       ldisp = .true.,
              dvscf_star%pat = .true. ,
                     recover = .false. ,
                       qplot = .false. ,
                         q2d = .false. ,
              q_in_band_form = .true. ,
                    amass(1) = 114.82,
                  iverbosity = 1,
                      tr2_ph = 1e-10 ,
                alpha_mix(1) = 0.7 ,
                         nk1 = 31 ,
                         nk2 = 31 ,
                         nk3 = 1 ,
                          k1 = 0 ,
                          k2 = 0 ,
                          k3 = 0 ,
                         nq1 = 5 ,
                         nq2 = 5 ,
                         nq3 = 1 ,
 /
1.0 0.0 0.0


Can anyone please help me with the above error message ?
Thanks you.

Sunetra.

_______________________________________________
Pw_forum mailing list
Pw_forum at pwscf.org<mailto:Pw_forum at pwscf.org>
http://pwscf.org/mailman/listinfo/pw_forum

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20170224/e05a6738/attachment.html>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: OutlookEmoji-?.png
Type: image/png
Size: 506 bytes
Desc: OutlookEmoji-?.png
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20170224/e05a6738/attachment.png>


More information about the users mailing list