[QE-users] Hydrogen atom pseudopotential files with q=1.25e and q=0.75e (PBE, USPP)

[GOKHAN HASEKI]

Hi 

Dear Quantum Espresso users, I would like to passivate the surface of a III-V nanowire with pseudo-Hydrogen atoms. So I need Hydrogen atom pseudopotential files with q=1.25e and q=0.75e (PBE, USPP). I've searched many pessupotential libraries but haven't been able to find it. your help and suggestions will guide me in this regard. Kind regards..
----- İletilen Mesaj -----
Kimden: GOKHAN HASEKI <gokhanhaseki at trakya.edu.tr>
Kime: users at lists.quantum-espresso.org
Gönderilenler: Mon, 10 Apr 2023 22:02:37 +0300 (TRT)
Konu: [QE-users] Hydrogen atom pseudopotential files with q=1.25e and q=0.75e (PBE, USPP)

Hi 

Dear Quantum Espresso users, I would like to passivate the surface of a III-V nanowire with pseudo-Hydrogen atoms. So I need Hydrogen atom pseudopotential files with q=1.25e and q=0.75e (PBE, USPP). I've searched many pessupotential libraries but haven't been able to find it. your help and suggestions will guide me in this regard. Kind regards..