[QE-users] Regarding Stm image

[Paolo Giannozzi]

There is nothing wrong in the code. See point 5.9, 4.3, 4.4 of the FAQ:

http://www.quantum-espresso.org/resources/faq/frequent-errors-during-execution
Paolo

On Mon, Jul 26, 2021 at 10:50 AM Satyasiban Dash ph19d005 <
ph19d005 at smail.iitm.ac.in> wrote:

> I checked.Even I created a new file and used PWSCF to make sure all the
> tabulations are correct but still the same problem.
>
> On Mon, Jul 26, 2021 at 2:05 PM pboulet <pascal.boulet at univ-amu.fr> wrote:
>
>> Hello,
>>
>> Have you checked that do not have invisible, special characters
>> (tabulations, …) in your input file?
>>
>> Best,
>>
>>
>> Pascal Boulet
>> —
>> *Professor in computational materials chemistry - DEPARTMENT OF CHEMISTRY*
>> University of Aix-Marseille - Avenue Escadrille Normandie Niemen -
>> F-13013 Marseille - FRANCE
>> Tél: +33(0)4 13 55 18 10 - Fax : +33(0)4 13 55 18 50
>> Email : pascal.boulet at univ-amu.fr
>>
>>
>>
>>
>>
>>
>>
>>
>>
>>
>> Le 26 juil. 2021 à 10:30, Paolo Giannozzi <p.giannozzi at gmail.com> a
>> écrit :
>>
>> It works for me
>>
>> PG
>>
>> On Mon, Jul 26, 2021 at 9:38 AM Satyasiban Dash ph19d005 <
>> ph19d005 at smail.iitm.ac.in> wrote:
>>
>>> Dear Users
>>>
>>> I have been trying to figure out stm image of one of the examples given
>>> in qe-6.7 but while running with pp.x I am getting the following result
>>>
>>>
>>> Error in routine postproc (1):
>>>      reading inputpp namelist
>>>
>>>
>>>
>>> The input file
>>>
>>> &INPUTPP
>>>                       prefix = 'alas' ,
>>>                       outdir = './' ,
>>>                      filplot = 'alasstm' ,
>>>                     plot_num = 5,
>>>                  sample_bias = -0.0735d0 ,
>>>  /
>>> &PLOT
>>>                        nfile = 1 ,
>>>                    filepp(1) = 'stm-1',
>>>                    weight(1) = 1.0,
>>>                      fileout = 'alasstm_out' ,
>>>                        iflag = 2 ,
>>>                output_format = 2 ,
>>>                        e1(1) = 7.0,
>>>                        e1(2) = 0.0,
>>>                        e1(3) = 0.0,
>>>                        e2(1) = 0.0,
>>>                        e2(2) = 7.07107,
>>>                        e2(3) = 0.0,
>>>                        x0(1) = 0.0,
>>>                        x0(2) = -0.18,
>>>                        x0(3) = 3.25,
>>>                           nx = 36 ,
>>>                           ny = 56 ,
>>>  /
>>>
>>> Please suggest what is going wrong.
>>>
>>>
>>> Thank You.
>>> Satyasiban Dash
>>> PhD Scholar
>>> IIT Madras
>>> _______________________________________________
>>> 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 206, 33100 Udine, Italy
>> Phone +39-0432-558216, fax +39-0432-558222
>>
>> _______________________________________________
>> 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 206, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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