Dear shwhyshwhy ,
I would suggest PseudoDojo-LDA-v0.4 for atomic and electronic structure, and NanoDCAL material-optimized set for transport calculations. NanoDCAL generic LDA set is similar to NanoDCAL material-optimized set, we will merge them soon.
In general, if you are unsure, you might want to check the BS or DOS against another code and method, like VASP. Soon we'll publish this kind of data along with the PP.
