it's the smooth one, the only one whose Fourier components are
reasonably converged within ecutwfc.
stefano
On 03/06/2016 10:43, Ryky Nelson wrote:
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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