[Pw_forum] pwscf could not find wavefunction

Jia Chen jiachenchem at gmail.com
Wed Aug 31 20:41:23 CEST 2016


Dear All,

I am having troubles with restarting calculations with existing
wavefunctions. I have restart_mode = 'from_scratch', outdir = './'   wfcdir
= './' and startingwfc = 'file'. Wave functions file are in
'./prefix.save/K00.../' And I keep getting error "wavefunctions unit
(iunwfc) is not opened"
I would like to know how to let pwscf read existing wavefunction. Thank you
very much.

Cheers
Jia
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