Generated using "atomic" code by A. Dal Corso v.6.3MaX Author: ADC Generation date: 4Sep2018 Pseudopotential type: USPP Element: O Functional: PBE Suggested minimum cutoff for wavefunctions: 47. Ry Suggested minimum cutoff for charge density: 323. Ry The Pseudo was generated with a Fully-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 1.1000 Pseudopotential contains additional information for spin-orbit calculations. Valence configuration: nl pn l occ Rcut Rcut US E pseu 2S 1 0 2.00 1.000 1.300 -1.760749 2P 2 1 2.00 0.900 1.350 -0.665154 2P 2 1 2.00 0.900 1.350 -0.662475 Generation configuration: 2S 1 0 2.00 1.000 1.300 -1.760745 2S 1 0 0.00 1.000 1.300 1.000000 2P 2 1 2.00 0.900 1.350 -0.665154 2P 2 1 2.00 0.900 1.350 -0.662469 2P 2 1 0.00 0.900 1.350 0.050000 2P 2 1 0.00 0.900 1.350 0.050000 Pseudization used: troullier-martins &input title='O', zed=8., rel=2, config='[He] 2s2 2p4', iswitch=3, dft='PBE' / &inputp lpaw=.false., use_xsd=.FALSE., pseudotype=3, file_pseudopw='O.rel-pbe-n-rrkjus_psl.1.0.0.UPF', author='ADC', lloc=-1, rcloc=1.1 which_augfun='PSQ', rmatch_augfun_nc=.true., nlcc=.true., new_core_ps=.true., rcore=0.7, tm=.true. / 4 2S 1 0 2.00 0.00 1.00 1.30 0.0 2S 1 0 0.00 1.00 1.00 1.30 0.0 2P 2 1 4.00 0.00 0.90 1.35 0.0 2P 2 1 0.00 0.05 0.90 1.35 0.0 1.139852456943145e-4 1.154190035836278e-4 1.168707959270728e-4 1.183408495701567e-4 1.198293942117525e-4 1.213366624399886e-4 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