Generated using "atomic" code by A. Dal Corso v.5.0.99 svn rev. 10869 Author: ADC Generation date: 10Apr2014 Pseudopotential type: PAW Element: Mg Functional: SLA PW PBX PBC Suggested minimum cutoff for wavefunctions: 13. Ry Suggested minimum cutoff for charge density: 87. Ry The Pseudo was generated with a Scalar-Relativistic Calculation L component and cutoff radius for Local Potential: 2 2.3000 Pseudopotential contains additional information for GIPAW reconstruction. Valence configuration: nl pn l occ Rcut Rcut US E pseu 3S 1 0 2.00 2.300 2.500 -0.345843 3P 2 1 0.00 2.400 2.600 -0.097756 Generation configuration: 3S 1 0 2.00 2.300 2.500 -0.345842 3S 2 0 0.00 1.400 2.500 6.500000 3P 2 1 0.00 2.400 2.600 -0.097756 3P 3 1 0.00 1.400 2.600 6.300000 3D 3 2 -2.00 2.300 2.300 0.300000 Pseudization used: troullier-martins &input title='Mg c', zed=12.0, rel=1, config='[Ne] 3s2.0 3p0 3d-2', iswitch=3, dft='PBE' / &inputp lpaw=.true., pseudotype=3, file_pseudopw='Mg.pbe-n-kjpaw_psl.0.3.0.UPF', author='ADC', lloc=2, which_augfun='PSQ', rmatch_augfun=1.9, nlcc=.true., new_core_ps=.true., rcore=2.1, tm=.true. lgipaw_reconstruction=.true. use_paw_as_gipaw=.true. / 5 3S 1 0 2.00 0.00 2.30 2.50 0.0 3S 2 0 0.00 6.50 1.40 2.50 0.0 3P 2 1 0.00 0.00 2.40 2.60 0.0 3P 3 1 0.00 6.30 1.40 2.60 0.0 3D 3 2 -2.00 0.30 2.30 2.30 0.0 7.599016379620969E-005 7.694600238908519E-005 7.791386395138184E-005 7.889389971343783E-005 7.988626280783498E-005 8.089110829332575E-005 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