Error EDDDAV: Call to ZHEGV failed. Returncode = 234 2 240
Posted: Tue Jul 06, 2021 12:09 pm
Dear all,
I was running an optimization calculation, when I ran into the error mentioned in the subject line. I have run the exact same calculation earlier as well, but without the Sm atom and the ISPIN=2 line in the INCAR file, and it ran fine. I have attached the pastebin link with the INCAR, POSCAR files and the OUTCAR files herewith.
https://pastebin.com/SfCUZp3V
Yours sincerely,
Soham
I was running an optimization calculation, when I ran into the error mentioned in the subject line. I have run the exact same calculation earlier as well, but without the Sm atom and the ISPIN=2 line in the INCAR file, and it ran fine. I have attached the pastebin link with the INCAR, POSCAR files and the OUTCAR files herewith.
https://pastebin.com/SfCUZp3V
Yours sincerely,
Soham