Dear all,
I built a script to customize the PDOS of a spin-polarized nanoribbon. But an error occurs.
How can I modify the PDOS script to make it run correctly.
The error information is as follows:
Traceback (most recent call last):
File "/public/home/heyy/ATKJOBS/221208-LGvHMutP/pdos-z-GN-1.py", line 126, in <module>
Traceback (most recent call last):
File "/public/home/heyy/ATKJOBS/221208-LGvHMutP/pdos-z-GN-1.py", line 126, in <module>
Traceback (most recent call last):
File "/public/home/heyy/ATKJOBS/221208-LGvHMutP/pdos-z-GN-1.py", line 126, in <module>
projection_list = Projection(atom=[Carbon], l_quantum_numbers=[1], m_quantum_numbers=[-1, 0, 1], spin=Spin.up)
AttributeError: 'module' object has no attribute 'up'
projection_list = Projection(atom=[Carbon], l_quantum_numbers=[1], m_quantum_numbers=[-1, 0, 1], spin=Spin.up)
application called MPI_Abort(MPI_COMM_WORLD, 1) - process 2
