Generated using "atomic" code by A. Dal Corso v.5.0.99 svn rev. 10869 Author: ADC Generation date: 10Apr2014 Pseudopotential type: PAW Element: Au Functional: SLA PW PBX PBC Suggested minimum cutoff for wavefunctions: 26. Ry Suggested minimum cutoff for charge density: 357. Ry The Pseudo was generated with a Scalar-Relativistic Calculation Local Potential according to Troullier-Martins recipe, cutoff radius: 2.4000 Pseudopotential contains additional information for GIPAW reconstruction. Valence configuration: nl pn l occ Rcut Rcut US E pseu 6S 1 0 1.00 1.900 2.300 -0.423495 6P 2 1 0.00 2.000 2.400 -0.056605 5D 3 2 10.00 1.800 2.200 -0.505445 Generation configuration: 6S 1 0 1.00 1.900 2.300 -0.423493 6S 1 0 0.00 1.700 2.300 2.300000 6P 2 1 0.00 2.000 2.400 -0.056605 6P 2 1 0.00 1.800 2.400 3.600000 5D 3 2 10.00 1.800 2.200 -0.505442 5D 3 2 0.00 1.100 2.200 -0.300000 Pseudization used: troullier-martins &input title='Au', zed=79., rel=1, config='[Xe] 4f14 5d10.0 6s1.0 6p0.0', iswitch=3, dft='PBE' / &inputp lpaw=.true., pseudotype=3, file_pseudopw='Au.pbe-dn-kjpaw_psl.0.3.0.UPF', author='ADC', lloc=-2, rcloc=2.4, which_augfun='PSQ', rmatch_augfun=1.00, nlcc=.true., new_core_ps=.true., rcore=1.6, tm=.true. lgipaw_reconstruction=.true. use_paw_as_gipaw=.true. / 6 6S 1 0 1.00 0.00 1.90 2.30 0.0 6S 1 0 0.00 2.30 1.70 2.30 0.0 6P 2 1 0.00 0.00 2.00 2.40 0.0 6P 2 1 0.00 3.60 1.80 2.40 0.0 5D 3 2 10.00 0.00 1.80 2.20 0.0 5D 3 2 0.00 -0.30 1.10 2.20 0.0 1.154280969056350E-005 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