Dear developers,
I want to calculate the path of hydrogen diffusion. I selected the initial and
final states, relaxed both structures, and then launched the neb.x calculation,
which gave me the following results:
tcpu = 5925.8 self-consistency for image 2
tcpu = 6346.4 self-consistency for image 3
tcpu = 6823.6 self-consistency for image 4
tcpu = 7369.4 self-consistency for image 5
WARNING : scf convergence NOT achieved on image 5
Best regards.
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