Generated using "atomic" code by A. Dal Corso v.5.0.99 svn rev. 10869 Author: ADC Generation date: 10Apr2014 Pseudopotential type: PAW Element: Cr Functional: SLA PW PBX PBC Suggested minimum cutoff for wavefunctions: 50. Ry Suggested minimum cutoff for charge density: 239. Ry The Pseudo was generated with a Scalar-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 2.0000 Pseudopotential contains additional information for GIPAW reconstruction. Valence configuration: nl pn l occ Rcut Rcut US E pseu 3S 1 0 2.00 1.000 1.500 -5.438246 4S 2 0 1.00 1.000 1.500 -0.294512 3P 2 1 6.00 1.400 1.500 -3.339995 3D 3 2 5.00 1.300 1.700 -0.214102 Generation configuration: 3S 1 0 2.00 1.000 1.500 -5.438241 4S 2 0 1.00 1.000 1.500 -0.294504 3P 2 1 6.00 1.400 1.500 -3.339989 4P 3 1 0.00 0.900 1.700 3.100000 3D 3 2 5.00 1.300 1.700 -0.214093 3D 3 2 -2.00 1.300 1.700 0.300000 Pseudization used: troullier-martins &input title='Cr c', zed=24.0, rel=1, config='[Ar] 3d5.0 4s1 4p0', iswitch=3, dft='PBE' / &inputp lpaw=.true., pseudotype=3, file_pseudopw='Cr.pbe-spn-kjpaw_psl.0.2.3.UPF', author='ADC', lloc=-1, rcloc=2.0, which_augfun='PSQ', rmatch_augfun=1.3, nlcc=.true., new_core_ps=.true., rcore=0.7, tm=.true. lgipaw_reconstruction=.true. use_paw_as_gipaw=.true. / 6 3S 1 0 2.00 0.00 1.00 1.50 0.0 4S 2 0 1.00 0.00 1.00 1.50 0.0 3P 2 1 6.00 0.00 1.40 1.50 0.0 4P 3 1 0.00 3.10 0.90 1.70 0.0 3D 3 2 5.00 0.00 1.30 1.70 0.0 3D 3 2 -2.00 0.30 1.30 1.70 0.0 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