[QE-users] mismatch in number of G-vectors

Jagapathi Babu bjbabu.mt at gmail.com
Sat Feb 12 16:01:09 CET 2022


Hello everyone, hope you are doing well.
I am trying to calculate the HSE bandstructure for MgO, while running
VC-RELAX i am getting error as shown below:
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     task #         1
     from ggens : error #         2
     mismatch in number of G-vectors
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Please help me to resolve this issue. I am attaching the input file.
Thank you. Regards
Jagapathi Babu Battu
M.Tech(2020-2022)
IIT Kharagpur.
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