[QE-users] error

Giovanni Cantele giovanni.cantele at spin.cnr.it
Sat Mar 16 21:05:23 CET 2024


There is likely an error in your input file, no way to figure out which
without more details.
Please kindly  provide (see post guidelines here:
https://www.quantum-espresso.org/users-forum/ ):
1) name
2) affiliation
3) input file.

Giovanni
-- 

Giovanni Cantele, PhD
CNR-SPIN
c/o Dipartimento di Fisica
Universita' di Napoli "Federico II"
Complesso Universitario M. S. Angelo - Ed. 6
Via Cintia, I-80126, Napoli, Italy
e-mail: giovanni.cantele at spin.cnr.it <giovanni.cantele at spin.cnr.it>
Phone: +39 081 676910
Skype contact: giocan74

ResearcherID: http://www.researcherid.com/rid/A-1951-2009
Web page: https://sites.google.com/view/giovanni-cantele/home


Il giorno sab 16 mar 2024 alle ore 19:52 Muhammad Ishfaq via users <
users at lists.quantum-espresso.org> ha scritto:

>   kindly,help me solve :
>  Error in routine  card_atomic_species (5010):
>      cannot read atomic specie from: ATOMIC_POSITIONS crystal
>
> Also i want to know,my compound is antiferromagnetic,what can be the total
> magnetization?
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