[Pw_forum] what is the different pseudopotential?
Jianping Dai
jianping09 at gmail.com
Thu Apr 9 07:18:08 CEST 2009
Dear All,
I am a new user of PWSCF. I want to the difference between the two
pseudopotentials:
*Zn.pbe-van.UPF*<http://www.quantum-espresso.org/pseudo/1.3/UPF/Zn.pbe-van.UPF>
(
*details*<http://www.quantum-espresso.org/pseudo/upfdetails.php?upf=Zn.pbe-van.UPF>)
Perdew-Burke-Ernzerhof (PBE) exch-corr
Vanderbilt ultrasoft
*Zn.bp-van_ak.UPF*
<http://www.quantum-espresso.org/pseudo/1.3/UPF/Zn.bp-van_ak.UPF>
(*details* <http://www.quantum-espresso.org/pseudo/upfdetails.php?upf=Zn.bp-van_ak.UPF>)
Becke-Perdew gradient-corrected functional
Vanderbilt ultrasoft
author: ak
It just generated by differnent author?
Thanks!
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