Generated using Vanderbilt code, version 7 3 5 Author: unknown Generation date: 9 6 2004 Automatically converted from original format 1 The Pseudo was generated with a Scalar-Relativistic Calculation 1.80000000000E+00 Local Potential cutoff radius nl pn l occ Rcut Rcut US E pseu 3S 3 0 2.00 10.00000000000 1.80000000000 -4.04520446215 3P 3 1 6.00 10.00000000000 2.20000000000 -2.47137924383 4S 4 0 2.00 10.00000000000 1.80000000000 -0.30744853016 3D 3 2 1.00 10.00000000000 2.40000000000 -0.23765911236 0 Version Number Sc Element US Ultrasoft pseudopotential T Nonlinear Core Correction SLA PW PBE PBE PBE Exchange-Correlation functional 11.00000000000 Z valence -93.98873217195 Total energy 0.0000000 0.0000000 Suggested cutoff for wfc and rho 2 Max angular momentum component 849 Number of points in mesh 4 6 Number of Wavefunctions, Number of Projectors Wavefunctions nl l occ 3S 0 2.00 3P 1 6.00 4S 0 2.00 3D 2 1.00 0.00000000000E+00 2.01765757524E-06 4.06980419085E-06 6.15702938885E-06 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