Thank you very much for the reply. I still would like more information by asking
a couple of questions:
1-What is the definition of short? How long should the electrode be or what is
the minimum length of the electrode to be acceptable?
2- From the error file what use does it give me when it
In your electrode calculation, look for:
superc: Internal auxiliary supercell: 3 x 5 x 3 = 45
This should have a 3 along the semi-infinite direction.
Your electrode in your attached output does seem too short.
Den tir. 10. dec. 2019 kl. 22.03 skrev El-abed Haidar <
