Generated using "atomic" code by A. Dal Corso v.6.2.2 Author: ADC Generation date: 4May2018 Pseudopotential type: PAW Element: Tc Functional: SLA PZ NOGX NOGC Suggested minimum cutoff for wavefunctions: 62. Ry Suggested minimum cutoff for charge density: 839. Ry The Pseudo was generated with a Scalar-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 1.2000 Pseudopotential contains additional information for GIPAW reconstruction. Valence configuration: nl pn l occ Rcut Rcut US E pseu 4S 1 0 2.00 1.350 1.700 -5.393872 5S 2 0 2.00 0.950 1.100 -0.387059 4P 2 1 6.00 0.700 1.700 -3.336607 5P 3 1 0.00 0.700 1.200 -0.112118 4D 3 2 5.00 1.300 2.000 -0.500621 Generation configuration: 4S 1 0 2.00 1.350 1.700 -5.393925 5S 2 0 2.00 0.950 1.100 -0.387067 4P 2 1 6.00 0.700 1.700 -3.336654 5P 3 1 0.00 0.700 1.200 -0.112124 4D 3 2 5.00 1.300 2.000 -0.500644 4D 3 2 -2.00 1.300 2.000 0.300000 Pseudization used: troullier-martins &input title='Tc', zed=43.0, rel=1, config='[Kr] 4d5.0 5s2 5p0', iswitch=3, dft='LDA' / &inputp lpaw=.true., use_xsd=.FALSE., pseudotype=3, file_pseudopw='Tc.pz-spn-kjpaw_psl.0.3.0.UPF', author='ADC', lloc=-1, rcloc=1.2, which_augfun='PSQ', rmatch_augfun_nc=.true., nlcc=.true., new_core_ps=.true., rcore=0.9, tm=.true. / 6 4S 1 0 2.00 0.00 1.35 1.70 0.0 5S 2 0 2.00 0.00 0.95 1.10 0.0 4P 2 1 6.00 0.00 0.70 1.70 0.0 5P 3 1 0.00 0.00 0.70 1.20 0.0 4D 3 2 5.00 0.00 1.30 2.00 0.0 4D 3 2 -2.00 0.30 1.30 2.00 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