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<UPF version="2.0.1">
<PP_INFO>
Generated using "atomic" code by A. Dal Corso (Quantum ESPRESSO distribution)
Author: ADC
Generation date: 15Feb2010
Pseudopotential type: USPP
Element: Au
Functional: LDA
Suggested minimum cutoff for wavefunctions: 23. Ry
Suggested minimum cutoff for charge density: 297. Ry
The Pseudo was generated with a Scalar-Relativistic Calculation
L component and cutoff radius for Local Potential: 0 2.5000
Valence configuration:
nl pn l occ Rcut Rcut US E pseu
6P 2 1 0.00 3.300 3.300 -0.065163
5D 3 2 10.00 1.800 2.400 -0.523090
6S 1 0 1.00 3.718 3.950 -0.447624
Generation configuration:
6P 2 1 0.00 3.300 3.300 -0.065163
5D 3 2 10.00 1.800 2.400 -0.523089
5D 3 2 0.00 1.800 2.400 -0.300000
6S 1 0 1.00 2.500 2.500 -0.447622
Pseudization used: rrkj
</PP_INFO>
<!-- -->
<!-- END OF HUMAN READABLE SECTION -->
<!-- -->
<PP_HEADER generated='Generated using "atomic" code by A. Dal Corso (Quantum ESPRESSO distribution)'
author="ADC"
date="15Feb2010"
comment=""
element="Au"
pseudo_type="USPP"
relativistic="scalar"
is_ultrasoft="T"
is_paw="F"
is_coulomb="F"
has_so="F"
has_wfc="T"
has_gipaw="F"
core_correction="F"
functional="LDA "
z_valence="1.100000000000000E+001"
total_psenergy="-6.652153959829371E+001"
wfc_cutoff="2.278263766196461E+001"
rho_cutoff="2.965868509776528E+002"
l_max="2"
l_max_rho="4"
l_local="0"
mesh_size="1279"
number_of_wfc="3"
number_of_proj="3"/>
<PP_MESH dx="1.250000000000000E-002" mesh="1279" xmin="-7.000000000000000E+000" rmax="1.000000000000000E+002"
zmesh="7.900000000000000E+001">
<PP_R type="real" size="1279" columns="4">
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6.876284947850041E-022 3.584564180777060E-022 1.853109886875252E-022 9.499538612358834E-023
4.828297447727041E-023 2.432925147971257E-023 1.215231948943177E-023 6.016406792819077E-024
2.951984493831280E-024 1.435292746241163E-024 6.914591154908464E-025 3.300209855741394E-025
1.560322773985442E-025 7.306903039778542E-026 3.388798673300742E-026 1.556318875839774E-026
7.076817506696401E-027 3.185734175528831E-027 1.419574047454612E-027 6.260769422363128E-028
2.732511363104907E-028 1.180058706953480E-028 5.041905100944044E-029 2.130965703650800E-029
8.908192292235844E-030 3.682763962651491E-030 1.505457370450878E-030 6.084314463773836E-031
2.430754065252199E-031 9.598278652621413E-032 3.745455555915895E-032 1.444142665607264E-032
5.501031003755262E-033 2.069856296010286E-033 7.691855907832981E-034 2.822596650379488E-034
1.022643545717110E-034 3.657528326322430E-035 1.291125255577943E-035 4.497744033417785E-036
1.545945933866541E-036 5.241959830042250E-037 1.753148059255490E-037 5.782209039624944E-038
1.880369040394197E-038 6.028223927156122E-039 1.904822642252238E-039 5.931431532984290E-040
1.819802428722132E-040 5.500062569574323E-041 1.637222121138310E-041 4.799113763438424E-042
1.384980932014085E-042 3.934328658603966E-043 1.099905281199466E-043 3.025592117431429E-044
8.187427193442752E-045 2.179098825082438E-045 5.703062199131922E-046 1.467402176353640E-046
3.711137867227415E-047 9.223329824221218E-048 2.252142003523397E-048 5.401752037048712E-049
1.272350047480495E-049 2.942474377413152E-050 6.679633905401524E-051 1.488075756009386E-051
3.252573169084019E-052 6.973562772651949E-053 1.466231697398555E-053 3.022484370021539E-054
6.107044341065116E-055 1.209189185519539E-055 2.345540054893537E-056
</PP_RHOATOM>
</UPF>
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