Generated using "atomic" code by A. Dal Corso v.6.2.2 Author: ADC Generation date: 4May2018 Pseudopotential type: PAW Element: Tm Functional: SLA PZ NOGX NOGC Suggested minimum cutoff for wavefunctions: 38. Ry Suggested minimum cutoff for charge density: 318. Ry The Pseudo was generated with a Scalar-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 2.1000 Pseudopotential contains additional information for GIPAW reconstruction. Valence configuration: nl pn l occ Rcut Rcut US E pseu 5S 1 0 2.00 1.100 1.600 -4.301631 6S 2 0 1.50 1.100 1.600 -0.373886 5P 2 1 6.00 1.100 1.700 -2.295438 6P 3 1 0.50 1.100 1.700 -0.127865 5D 3 2 1.00 1.100 2.000 -0.199646 Generation configuration: 5S 1 0 2.00 1.100 1.600 -4.301678 6S 2 0 1.50 1.100 1.600 -0.373893 5P 2 1 6.00 1.100 1.700 -2.295474 6P 3 1 0.50 1.100 1.700 -0.127868 5D 3 2 1.00 1.100 2.000 -0.199660 5D 3 2 0.00 1.100 2.000 2.000000 Pseudization used: troullier-martins &input title='Tm', zed=69.0, rel=1, config='[Xe] 4f12 5d1.0 6s1.5 6p0.5', iswitch=3, dft='LDA' / &inputp lpaw=.true., use_xsd=.FALSE., pseudotype=3, file_pseudopw='Tm.pz-spdn-kjpaw_psl.1.0.0.UPF', author='ADC', lloc=-1, rcloc=2.1, which_augfun='PSQ', rmatch_augfun_nc=.true., nlcc=.true., new_core_ps=.true., rcore=1.1, tm=.true. / 6 5S 1 0 2.00 0.00 1.10 1.60 0.0 6S 2 0 1.50 0.00 1.10 1.60 0.0 5P 2 1 6.00 0.00 1.10 1.70 0.0 6P 3 1 0.50 0.00 1.10 1.70 0.0 5D 3 2 1.00 0.00 1.10 2.00 0.0 5D 3 2 0.00 2.00 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