[Pw_forum] overlap matrix

Negar Ashari Astani negarastani at gmail.com
Sat Jan 20 21:34:22 CET 2018


Dear Kevin,

Could be! I figured out that whenever I run with only one processor
everything is fine. However, the parallel implementation does not write the
overlap matrix. Also the output format is different. So I ended up running
projwfc.x only on one processor! Maybe there is something wrong with the
compilation and MKL libraries as you said!

Many thanks,

Negar


-- 
Negar Ashari-Astani, PhD
Sharif university of technology,
Department of Physics
Room 624
Tel: (+98)2166164504
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