Generated using "atomic" code by A. Dal Corso v.6.2.2 Author: ADC Generation date: 4May2018 Pseudopotential type: PAW Element: Ne Functional: SLA PZ NOGX NOGC Suggested minimum cutoff for wavefunctions: 54. Ry Suggested minimum cutoff for charge density: 264. Ry The Pseudo was generated with a Scalar-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 1.0000 Pseudopotential contains additional information for GIPAW reconstruction. Valence configuration: nl pn l occ Rcut Rcut US E pseu 2S 1 0 2.00 1.000 1.400 -2.654173 2P 2 1 6.00 1.000 1.400 -0.994582 Generation configuration: 2S 1 0 2.00 1.000 1.400 -2.654173 2S 1 0 0.00 1.000 1.400 0.400000 2P 2 1 6.00 1.000 1.400 -0.994579 2P 2 1 0.00 1.000 1.400 0.050000 Pseudization used: troullier-martins &input title='Ne', zed=10., rel=1, config='[He] 2s2 2p6', iswitch=3, dft='LDA' / &inputp lpaw=.true., use_xsd=.FALSE., pseudotype=3, file_pseudopw='Ne.pz-n-kjpaw_psl.1.0.0.UPF', author='ADC', lloc=-1, rcloc=1.0 which_augfun='PSQ', rmatch_augfun_nc=.true., nlcc=.true., new_core_ps=.true., rcore=0.8, tm=.true. / 4 2S 1 0 2.00 0.00 1.00 1.40 0.0 2S 1 0 0.00 0.40 1.00 1.40 0.0 2P 2 1 6.00 0.00 1.00 1.40 0.0 2P 2 1 0.00 0.05 1.00 1.40 0.0 9.118819655545161e-5 9.233520286690224e-5 9.349663674165821e-5 9.467267965612539e-5 9.586351536940196e-5 9.706932995199089e-5 9.829031181487386e-5 9.952665173895113e-5 1.007785429048511e-4 1.020461809231155e-4 1.033297638647637e-4 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