Yambo Community Forum

Dear users and developers,
I want to run Yambo (including spin-orbit calculations)
but I have this error:

| Y || _ || Y || _ \ | _ |
| | ||. | ||. ||. | / |. | |
\_ _/ |. _ ||.\_/ ||. _ \ |. | |
|: | |: | ||: | ||: | \|: | |
|::| |:.|:.||:.|:.||::. /|::. |
`--" `-- --"`-- --"`-----" `-----"
<---> DBs path set to .
<---> Index file set to data-file.xml
<---> Header/K-points/Energies... done
<01s> Cell data... done
<01s> Atomic data...
[ERROR]Error in check_pseudo : Pb.rel-pbe-dn-kjpaw_psl.0.2.2.UPF file not norm conserving! ierr: 1

How do I generate Norm-Conserving pseudopotential with a fully-relativistic calculation?

Best,
Yang Huang
Suzhou University

Dear Yang Huang ,

Yambo for the moment support norm conserving pseudopotential only.
You can check if you find your desired pseudos in the available libraries (QE website) or in the
theos group at epfl:

http://theossrv1.epfl.ch/Main/Pseudopotentials

Otherwise you need to generate it by yourself: you can find on line different codes.
Best,

Daniele

Dear Daniele,
Thank you so much for your kind help!

Best,
Yang Huang
Suzhou University