[Pw_forum] Fwd: Final iteration often crashes after structure optimization
Youssef
aharbil at gmail.com
Mon Aug 10 12:15:34 CEST 2015
Dear Ronald,
Strange behavior, it happens here (ggen.f90) :
IF (ngm > ngm_g) CALL errore ('ggen', 'too many g-vectors', ngm)
I am not QE developer, but firstly I suggest to lower ecutrho to 280 Ry
and see!!!
Youssef Aharbil,
Laboratory of Physics and Chemistry of Materials
Faculty of sciences Ben msik, Casablanca
Morocco
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