[QE-users] qe6.6 is not writing wavefunctions in tmp dir

Dr. K. C. Bhamu kcbhamu85 at gmail.com
Tue Dec 15 06:59:17 CET 2020


Dear QE Users

I am using PAW PPs from the QE webpage with QE-6.6. The code is compiled
with MKL-ifort-2020.

I noticed that it is not writing wavefunction in the tmp directory and
stuck after printing the Energy (grep ! *out). Then I need to delete the
job.

What could be the problem?



Thank you very much

K.C. Bhamu
University of Ulsan
ROK
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