[Pw_forum] QE calculations terminated with errors

[Jibiao Li]

Dear Prof. Paolo Giannozzi, 


Thank you very much for pointing out the errors. I have checked the input. As you said, the input is incomplete (&IONS is missing) when doing a structural relax. It works now by adding &IONS list. Thanks again.


Best
Jibiao Li


Yangtze Normal University
Chongqing, China




------------------ Original ------------------
From:  "Paolo Giannozzi";<p.giannozzi at gmail.com>;
Date:  Fri, Sep 8, 2017 06:58 PM
To:  "PWSCF Forum"<pw_forum at pwscf.org>; 

Subject:  Re: [Pw_forum] QE calculations terminated with errors



On Fri, Sep 8, 2017 at 12:48 PM, Jibiao Li <jibiaoli at foxmail.com> wrote:

Dear QE experts,



no need to be a QE expert, it is sufficient to have a careful look at the error message:


$ forrtl: severe (24): end-of-file during read, unit 9, file /home/bmllzr/Calc/NO_Fe100/H.25ml/input_tmp.in


"end-of-file during read": your input is not complete. Likely, a termination character of a namelist is missing, since it crashes while reading namelists:
 

Image              PC                Routine            Line        Source             
[...]
pw.x               00000000008CA1AC  read_namelists_mo        1963  read_namelists.f90





Paolo

-- 
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
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