[Pw_forum] about Pseudopotential generation
Bipul Rakshit
bipulrr at gmail.com
Mon Jun 1 22:08:19 CEST 2009
Dear Pwscf users,
1. I want to generate the PP of some rare earth elements having
f-electrons. There is a code in espresso folder, named
atomic_doc/pseudo-gen
So can I generate nice PP (ultra-soft) from the script ld1.x, so that
I can calculate the electronic and phonon properties?
2. There is another programme named uspp-xxx which i got from the
pwscf site only. Is that script is same as the above one, or better
one?
regards
--
Bipul Rakshit
PhD Student,
Barkatullah University,
Bhopal 462026,
MP, India
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