[QE-users] Error while parsing atomic position card

Laurens Siemons laurenssiemons at hotmail.be
Tue Dec 11 15:43:31 CET 2018


Can you attach your input file please?

Kind regards,
Laurens Siemons
PhD - University of Antwerp

Op 12/11/18 om 12:14 PM schreef hamed asadi:

Dear users,
I'm trying to relax CoFe2O4 lattice but after executing calculation, I faced following error, does anybody know how can I solve this error?

CRASH

 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     task #         3
     from card_atomic_positions : error #         1
     Error while parsing atomic position card.

 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%


 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     task #         1
     from card_atomic_positions : error #         1
     Error while parsing atomic position card.

 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%

Best regards,
H. Asadi
KN Toosi university of technology




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