Hello Everyone,
I've encountered an issue in running pw.x in quantum espresso 6.8. The
issue is in the subroutine open_buffer. The output file is returning:
Error in subroutine open_buffer (2)
Cannot open unit
As far as I can tell, the issue is appearing when the system tries to use
open_buffer from pw/src/buffers.f90 as part of the subroutine wfcinit()
from pw/src/wfc.f90. more specifically it is attempting to create a buffer
with a record length less than 0 at some point. I assume there's something
wrong with my input file but obviously I haven't been able to find it. Has
anyone encountered this issue, and if so, did you fix it and how?
The relevant input and output files should be attached below. The error
message is at the end of the output file
Thank you,
Devin Thrush
NYU Chem - Avalos Lab
This is my first time posting to this forum, so I apologize in advance if
the formatting of the post is wrong
RVCBTp_smaller.scf.in
Description: Binary data
RVCBTp_smaller.scf.out
Description: Binary data
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