[Wien] Error while running elastic calculations
413119008 at nitt.edu
413119008 at nitt.edu
Wed Nov 30 06:38:02 CET 2022
Respected sir,
I was running elastic constant calculations in Wien2k 21.1
using IRelast package. When i run set_elast_pressure, i am getting the
following error.I am not getting this error for zero pressure. As i
include pressure gives the following error.Kindly help me to resolve
this error.
Error: basis can not satisfy the main conditions.
Error: basis can not satisfy the main conditions.
---> <---
---> <---
Error: basis can not satisfy the main conditions.
_set_elast_lapw: Command not found.
with regards
Narayanan P
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