Dear Drs,
I need the fully relativistic PPs of Tin (Sn), some transition elements Fe, Co
and
Ni, with the same functional, like PBE or PW91. How can i find them? Only scalar
relativistic ones are valid on the PPs download webpage. Should i generate them
myself? I find it's a terrible job to adjust lots of parameters.
Shujun Hu- [Pw_forum] Spin-orbital effects and relativistic US-PPs Shujun Hu
- [Pw_forum] Spin-orbital effects and relativistic US-P... Paolo Giannozzi
- [Pw_forum] Spin-orbital effects and relativistic US-P... Shujun Hu
