[Pw_forum] question about small benchmark and pwgui

[Paolo Giannozzi]

Which file exactly are you refering to?

Paolo

On Thu, Nov 12, 2015 at 6:52 PM, mohammed shambakey <shambakey1 at gmail.com>
wrote:

> Thank you Paolo, but the file still contains "nelec" variable.
>
> Is it safe to remove it? or something else needs to be changed?
>
> Regards
>
> On Thu, Nov 12, 2015 at 10:53 AM, Paolo Giannozzi <p.giannozzi at gmail.com>
> wrote:
>
>>
>>
>> On Tue, Nov 10, 2015 at 3:41 PM, mohammed shambakey <shambakey1 at gmail.com
>> > wrote:
>>
>>>
>>> 1- I'm trying to run the pwscf-small-benchmark, but it gives me an error
>>> about namelist. So, I tried to open the generated "large-test.in" file
>>> in PWgui, but it gives me the following syntax error:
>>>
>>> namelist's variable "nelec" not allowed. Skipping the rest of the file
>>>
>>
>> The updated version of the "small" benchmarks is here:
>>
>> http://qe-forge.org/gf/download/frsrelease/43/76/pwscf-small-benchmark.tar.gz
>> it runs with recent versions of QE, does not contain obsolete variable
>> "nelec"
>>
>> Paolo
>> --
>> Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
>> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
>> Phone +39-0432-558216, fax +39-0432-558222
>>
>> _______________________________________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>
>
>
> --
> Mohammed
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>



-- 
Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
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/20151112/f2a02ff5/attachment.html>