Dear Yasmin,
it's impossible to get this error message:
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Error in routine read_cards (4):
species S2 in ATOMIC_POSITIONS is nonexistent
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from this input:
ATOMIC_POSITIONS
Cd1 0.00 0.00 0.00
Cd1 0.50 0.50 0.50
Cd1 1.00 1.00 1.00
S1 0.25 0.25 0.25
S1 0.75 0.75 0.75
S1 1.25 1.25 1.25
Hence, I guess your mistake is that you're not providing pw.x the input
you want, but another file.
kind regards
On 3/13/19 8:31 AM, yasmin kani wrote:
Hai, everyone i am working with quantum espresso. when i am working
there is a error .how can i solve the problem
_______________________________________________
users mailing list
[email protected]
https://lists.quantum-espresso.org/mailman/listinfo/users
--
Lorenzo Paulatto - Paris
_______________________________________________
users mailing list
[email protected]
https://lists.quantum-espresso.org/mailman/listinfo/users
