[QE-users] [SUSPECT ATTACHMENT REMOVED] Error in routine davcio (10)?
Vasilios Passias
billy.passias at gmail.com
Fri Aug 28 21:40:04 CEST 2020
Hello fellow quantum espresso users.
Recently, I tried running a relaxation calculation. The convergence
thresholds on the total energy and total force are such that I need to run
this relaxation calculation multiple times. The first relaxation run, with
restart_mode = 'from_scratch' , ran fine for the max_time I had set.
Then I set restart_mode = 'restart' and I ran this relaxation calculation
again, expecting it to continue where it left off.
Instead I got the following error: error in routine davcio (10): error
while reading from file.
All of the files associated with this error are in the same folder as my
input and output files. Why is this happening? Should I just re-run this
calculation?
I have my input, output, job submission, and crash files attached in this
email.
Thank you for your time and input.
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