[Pw_forum] PP by atomic.x

[Paolo Giannozzi]

On Jan 31, 2009, at 6:45 , Karoly Nemeth wrote:

> I am trying to reproduce Ru.pbe-n-van.UPF from the PP library of  
> PWSCF,
> by atomic.x.

that PP was generated using the original Vanderbilt code, not by the
"atomic" code (whose executable is called "ld1.x", for no better reason
than the original code from which it descend used to be called "ld1"
once upon a time). The latter uses a different logic to generate US PP.
You may find some inspiration in the following sample file for Ru:
    atomic_doc/pseudo_library/PBE/SRRu.pbe-rrkjus.in

Paolo
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Paolo Giannozzi, Democritos and University of Udine, Italy