[Pw_forum] wavefunction output in PAW calculations

Ryky Nelson nelson.ryky at gmail.com
Fri Jun 3 10:43:57 CEST 2016


Hello QE users,

I'm still quite new with Quantum Espresso. In PAW calculations, is it the
true wave-function or the smooth one which is output/written in case.wfc
(or evc.dat in the case wf_collect = .true.)?

Thanks in advance!

Ryky Nelson
Institut für Anorganische Chemie
RWTH Aachen University
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