abinit / pseudo_dojo

Python framework for generating and validating pseudo potentials

http://www.pseudo-dojo.org/

abinit/pseudo_dojo Issues

v0.5 `.djrepo` files seem incomplete?
Closed 9 months ago1
norm-conserving pseudopotential of rare earth metal
Updated a year ago
Ru pbesol with valence 8 instead of 16
Updated 2 years ago
convert the pseudopotential files into other formats
Updated 2 years ago
Conversion from psp8 (ABINIT) to UPF (Quantum ESPRESSO)
Updated 2 years ago
Stringent LDA PSP for Cu does not pass the test
Updated 4 years ago
LDA pseudo for oxygen missing on website
Updated 5 years ago2
Lattice parameter wrong by 8% with FR PBEsol for KTaO3
Updated 6 years ago
recpot format? (CASTEP & ONETEP)
Updated 6 years ago3
No UPF format pseudopotentials for NC FR (ONCVPSP v0.4), PBEsol on pseudo-dojo.org
Updated 6 years ago6
There is no pseudopotential for carbon in the LDA set
Closed 6 years ago2
http://pseudo-dojo.org does not work, only http://www.pseudo-dojo.org
Updated 6 years ago
broken link in github presentation
Closed 7 years ago1
include GMTKN30 data
Updated 9 years ago