[QE-users] question about epsilon.x

[Sabrine Ayari]

Thanks alot sir

but i have delete all the line after '/' and it dosnt work , i still 
have the same error :(

Le 03/05/2022 à 15:43, Paolo Giannozzi a écrit :
> Once again: add a character (whatever character) after the final "/". 
> There isn't one, not even a newline character.
>
>
> On 5/3/22 15:14, Sabrine Ayari wrote:
>> Dears
>>
>> please find attached the input band out put file
>>
>> scf
>>
>> nscf
>>
>> epsilon
>>
>> Le 03/05/2022 à 12:58, Paolo Giannozzi a écrit :
>>> Verify that there is something at the end of the namelist: a space, 
>>> a newline, whatever. With some compilers you get an error if the 
>>> last character of the namelist is also the last character of the file
>>>
>>> Paolo
>>>
>>> On 5/3/22 12:50, Sabrine Ayari wrote:
>>>> Dear QE users
>>>>
>>>>
>>>> Dear
>>>> i am new in DFT calculation ( i use quantum espresso) ,
>>>> now i am using epsilon.x input to find optical properties.
>>>> i have write the following input :
>>>> &inputpp
>>>> outdir = './out/'
>>>> prefix = 'aiida'
>>>> calculation = 'eps'
>>>> /
>>>> &ENERGY_GRID
>>>> smeartype = 'gauss'
>>>> intersmear =0.1
>>>> intrasmear = 0.0
>>>> wmax = 10.0
>>>> wmin = 0.0
>>>> nw = 500
>>>> shift = 0.0
>>>> /
>>>> but i have the following error :
>>>> task # 0
>>>> from epsilon : error # 5010
>>>> reading namelist ENERGY_GRID
>>>> can you please help me to solve/undrestand the origin of the error ??
>>>> Best regards
>>>> Thanks
>>>>
>>>>
>>>>
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>