Hi Quantum espresso users,
I have tried to set up calculation in quantum espresso , however in the output
file, it is showing as
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from read_cards : error # 1
wrong number of columns in ATOMIC_POSITIONS
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
I have given the coordinates directly from my structure as I got in Material
studio, Can anybody please help me?
Dimpy
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