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quantum-espresso/atomic/examples/pseudo-gen/reference/Ptrel.RRKJ3.UPF

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<UPF version="2.0.0">
<PP_INFO>
Generated using "atomic" code by A. Dal Corso (espresso distribution)
Author: anonymous
Generation date: 7May2008
Pseudopotential type: USPP
Element: Pt
Functional: LDA
Suggested minimum cutoff for wavefunctions: 28. Ry
Suggested minimum cutoff for charge density: 229. Ry
The Pseudo was generated with a Fully-Relativistic Calculation
L component and cutoff radius for Local Potential: 0 2.6000
Pseudopotential contains additional information for spin-orbit calculations.
Valence configuration:
nl pn l occ Rcut Rcut US E pseu
5D 3 2 4.00 2.100 2.400 -0.663898
5D 3 2 4.00 2.100 2.400 -0.559619
6P 2 1 0.00 3.300 3.300 -0.132227
6P 2 1 0.00 3.300 3.300 -0.083449
6S 1 0 2.00 3.718 3.951 -0.497022
Generation configuration:
5D 3 2 4.00 2.100 2.400 -0.663898
5D 3 2 0.00 2.100 2.400 -0.200000
5D 3 2 4.00 2.100 2.400 -0.559618
5D 3 2 0.00 2.100 2.400 -0.200000
6P 2 1 0.00 3.300 3.300 -0.132227
6P 2 1 0.00 3.400 3.400 -0.083449
6S 1 0 2.00 2.600 2.600 -0.497020
Pseudization used: rrkj
</PP_INFO>
<!-- -->
<!-- END OF HUMAN READABLE SECTION -->
<!-- -->
<PP_HEADER generated='Generated using "atomic" code by A. Dal Corso (espresso distribution)'
author="anonymous"
date=" 7May2008"
comment=""
element="Pt"
pseudo_type="USPP"
relativistic="full"
is_ultrasoft="T"
is_paw="F"
is_coulomb="F"
has_so="T"
has_wfc="F"
has_gipaw="F"
core_correction="T"
functional="LDA "
z_valence="1.000000000000000E+001"
total_psenergy="-6.893998327176344E+001"
wfc_cutoff="2.779749632346541E+001"
rho_cutoff="2.286556822702076E+002"
l_max="2"
l_max_rho="4"
l_local="0"
mesh_size="1277"
number_of_wfc="5"
number_of_proj="6"/>
<PP_MESH dx="1.250000000000000E-002" mesh="1277" xmin="-7.000000000000000E+000" rmax="1.000000000000000E+002"
zmesh="7.800000000000000E+001">
<PP_R type="real" size="1277" columns="4">
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