Generated using "atomic" code by A. Dal Corso v.6.2.2 Author: ADC Generation date: 4May2018 Pseudopotential type: PAW Element: Ne Functional: SLA PW PBX PBC Suggested minimum cutoff for wavefunctions: 54. Ry Suggested minimum cutoff for charge density: 264. Ry The Pseudo was generated with a Fully-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 1.0000 Pseudopotential contains additional information for spin-orbit calculations. 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 -2.675620 2P 2 1 2.00 1.000 1.400 -0.985010 2P 2 1 4.00 1.000 1.400 -0.977416 Generation configuration: 2S 1 0 2.00 1.000 1.400 -2.675620 2S 1 0 0.00 1.000 1.400 0.400000 2P 2 1 2.00 1.000 1.400 -0.985008 2P 2 1 4.00 1.000 1.400 -0.977412 2P 2 1 0.00 1.000 1.400 0.050000 2P 2 1 0.00 1.000 1.400 0.050000 Pseudization used: troullier-martins &input title='Ne', zed=10., rel=2, config='[He] 2s2 2p6', iswitch=3, dft='PBE' / &inputp lpaw=.true., use_xsd=.FALSE., pseudotype=3, file_pseudopw='Ne.rel-pbe-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 1.046294922922419e-4 1.059455692907610e-4 1.072782005000297e-4 1.086275941463858e-4 1.099939610753318e-4 1.113775147844803e-4 1.127784714569132e-4 1.141970499949607e-4 1.156334720544058e-4 1.170879620791174e-4 1.185607473361213e-4 1.200520579511101e-4 1.215621269444015e-4 1.230911902673481e-4 1.246394868392049e-4 1.262072585844614e-4 1.277947504706424e-4 1.294022105465848e-4 1.310298899811960e-4 1.326780431026992e-4 1.343469274383727e-4 1.360368037547894e-4 1.377479360985617e-4 1.394805918375999e-4 1.412350417028882e-4 1.430115598307874e-4 1.448104238058696e-4 1.466319147042903e-4 1.484763171377087e-4 1.503439192977572e-4 1.522350130010732e-4 1.541498937348950e-4 1.560888607032332e-4 1.580522168736217e-4 1.600402690244564e-4 1.620533277929307e-4 1.640917077235726e-4 1.661557273173934e-4 1.682457090816541e-4 1.703619795802574e-4 1.725048694847742e-4 1.746747136261120e-4 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