[QE-users] help: Pseudopotentials PAW_PBE
Franck Ngassamnyakam
franck.ngassamnyakam at ipcms.unistra.fr
Fri Jun 15 20:00:05 CEST 2018
Hi,
I am a new user of Quantum Espresso user. I would like to remake
calculations already performed with VASP using the speudoptential
PAW_PBE and I am confused with the different speudopentiel on the site
https://www.quantum-espresso.org/pseudopotentials. for example for
nitrogen N I have two types "N.rel-pbe-n-kjpaw_psl.0.1.UPF" and
"N.pbe-n-kjpaw_psl.0.1.UPF" same for Mn, F, C, H, Cu, Co, that i want to
use.
please which should I choose which would be equivalent to PAW_PBE
in VASP?.
thank you in advance
Franck O.
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