[QE-users] question about epsilon.x

[Paolo Giannozzi]

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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-- 
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