[Pw_forum] Using the outdir from vc-relax

[Izaak Williamson]

Hello everyone,


When I run a vc-relax calculations and attempt running projwfc, it does not give me the correct charge on the atoms. When I run projwfc on relax calculations (for the same system), however, it works fine. Is there a problem with vc-relax that is not allowing projwfc to work with its outdir files properly? Do I need to run an scf calculation on the vc-relax output before running projwfc?

Thanks for any help.

-- 
Izaak Williamson
Research Assistant
Physics Department
Boise State University
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