Generated using "atomic" code by A. Dal Corso v.6.3 Author: ADC Generation date: 4Sep2018 Pseudopotential type: USPP Element: Pb Functional: PBE Suggested minimum cutoff for wavefunctions: 46. Ry Suggested minimum cutoff for charge density: 211. Ry The Pseudo was generated with a Fully-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 2.1000 Pseudopotential contains additional information for spin-orbit calculations. Valence configuration: nl pn l occ Rcut Rcut US E pseu 6S 1 0 2.00 1.700 2.000 -0.825747 6P 2 1 2.00 2.200 2.400 -0.293354 6P 2 1 0.00 2.200 2.400 -0.192694 5D 3 2 4.00 1.400 1.600 -1.589381 5D 3 2 6.00 1.400 1.600 -1.400192 Generation configuration: 6S 1 0 2.00 1.700 2.000 -0.825744 6S 1 0 0.00 1.700 2.000 4.000000 6P 2 1 2.00 2.200 2.400 -0.293354 6P 2 1 0.00 2.200 2.400 -0.192693 6P 2 1 0.00 2.200 2.400 6.000000 6P 2 1 0.00 2.200 2.400 6.000000 5D 3 2 4.00 1.400 1.600 -1.589381 5D 3 2 6.00 1.400 1.600 -1.400190 5D 3 2 0.00 1.400 1.600 6.700000 5D 3 2 0.00 1.400 1.600 6.700000 Pseudization used: troullier-martins &input title='Pb', zed=82., rel=2, config='[Xe] 4f14 6s2 6p2 5d10', iswitch=3, dft='PBE' / &inputp lpaw=.false., use_xsd=.FALSE., pseudotype=3, file_pseudopw='Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF', author='ADC', lloc=-1, rcloc=2.1, which_augfun='PSQ', rmatch_augfun_nc=.true., nlcc=.true., new_core_ps=.true., rcore=1.6, tm=.true. / 6 6S 1 0 2.00 0.00 1.70 2.00 0.0 6S 1 0 0.00 4.00 1.70 2.00 0.0 6P 2 1 2.00 0.00 2.20 2.40 0.0 6P 2 1 0.00 6.00 2.20 2.40 0.0 5D 3 2 10.00 0.00 1.40 1.60 0.0 5D 3 2 0.00 6.70 1.40 1.60 0.0 1.112051177505507e-5 1.126039059352466e-5 1.140202887093393e-5 1.154544873855188e-5 1.169067260602463e-5 1.183772316487694e-5 1.198662339205779e-5 1.213739655353063e-5 1.229006620790866e-5 1.244465621013603e-5 1.260119071521508e-5 1.275969418198071e-5 1.292019137692208e-5 1.308270737805240e-5 1.324726757882754e-5 1.341389769211363e-5 1.358262375420492e-5 1.375347212889186e-5 1.392646951158058e-5 1.410164293346412e-5 1.427901976574603e-5 1.445862772391723e-5 1.464049487208660e-5 1.482464962736603e-5 1.501112076431074e-5 1.519993741941524e-5 1.539112909566603e-5 1.558472566715152e-5 1.578075738372986e-5 1.597925487575561e-5 1.618024915886575e-5 1.638377163882594e-5 1.658985411643773e-5 1.679852879250753e-5 1.700982827287803e-5 1.722378557352295e-5 1.744043412570578e-5 1.765980778120361e-5 1.788194081759638e-5 1.810686794362301e-5 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