[Pw_forum] pseudopotential generation warning: wfc 5 2 not converged

Fen Hong gm030212 at gmail.com
Wed Jan 19 03:02:18 CET 2011


Dear Giannozzi,
Thank you very much.
Actually, this warning not only show up at the beginning, also after the
pseudo potential generated.
"     ------------------- End of pseudopotential generation
-------------------

 warning: wfc  5 2 not converged
 warning: wfc  5 1 not converged
 warning: wfc  4 3 not converged
 warning: wfc  5 2 not converged
 warning: wfc  6 0 not converged
 warning: wfc  6 1 not converged
     --------------------------- All-electron run
----------------------------
"
By the way, How can I check whether the wavefunctions are sufficiently
localized or not.
And I did not get the line "eps = 3.2E-16  iter = 36"

Regards,
Gao Min
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