Re: [QE-users] question about epsilon.x

2022-05-06 Thread Sabrine Ayari
Dear , Paolo , Qe user with your help i was able to run the epsilon.x input to calculate the dielectric function for bulk Ptse2 , which is a semi_metals now after having the results i have another problem , the value of the reel and imagenuarry part of the dielectric constant are very large

Re: [QE-users] question about epsilon.x

2022-05-03 Thread 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

Re: [QE-users] question about epsilon.x

2022-05-03 Thread Paolo Giannozzi
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

Re: [QE-users] question about epsilon.x

2022-05-03 Thread Sabrine Ayari
Dear Paolo thank you very much for your reply i have verified but it still show the same error 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

Re: [QE-users] question about epsilon.x

2022-05-03 Thread 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