Generated using "atomic" code by A. Dal Corso v.6.3MaX Author: ADC Generation date: 4Sep2018 Pseudopotential type: USPP Element: Li Functional: PBE Suggested minimum cutoff for wavefunctions: 103. Ry Suggested minimum cutoff for charge density: 410. Ry The Pseudo was generated with a Fully-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 0.6000 Pseudopotential contains additional information for spin-orbit calculations. Valence configuration: nl pn l occ Rcut Rcut US E pseu 1S 1 0 2.00 0.800 1.000 -3.811228 2S 2 0 1.00 0.800 1.000 -0.211250 2P 2 1 0.00 0.850 1.200 -0.080114 2P 2 1 0.00 0.850 1.200 -0.080108 Generation configuration: 1S 1 0 2.00 0.800 1.000 -3.811230 2S 2 0 1.00 0.800 1.000 -0.211251 2P 2 1 0.00 0.850 1.200 -0.080117 2P 2 1 0.00 0.850 1.200 -0.080108 2P 2 1 0.00 0.850 1.200 1.000000 2P 2 1 0.00 0.850 1.200 1.000000 Pseudization used: troullier-martins &input title='Li', zed=3., rel=2, config='[He] 2s1 2p0', iswitch=3, dft='PBE' / &inputp lpaw=.false., use_xsd=.FALSE., pseudotype=3, file_pseudopw='Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF', author='ADC', lloc=-1, rcloc=0.6 which_augfun='PSQ', rmatch_augfun_nc=.true., tm=.true. / 4 1S 1 0 2.00 0.00 0.80 1.00 0.0 2S 2 0 1.00 0.00 0.80 1.00 0.0 2P 2 1 0.00 0.00 0.85 1.20 0.0 2P 2 1 0.00 1.00 0.85 1.20 0.0 3.039606551848387e-4 3.077840095563408e-4 3.116554558055273e-4 3.155755988537513e-4 3.195450512313400e-4 3.235644331733030e-4 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