Generated using "atomic" code by A. Dal Corso (espresso distribution) Author: Hande Ustunel Generation date: 10Mar2006 1 The Pseudo was generated with a Scalar-Relativistic Calculation 1 3.0000000E+00 L component and cutoff radius for Local Potential nl pn l occ Rcut Rcut US E pseu 4D 3 2 10.00 1.00000000000 2.00000000000 -1.37524736006 4D 3 2 0.00 1.00000000000 2.00000000000 1.50000000000 5S 1 0 0.00 2.00000000000 2.50000000000 -0.35000000000 5S 1 0 2.00 2.00000000000 2.50000000000 -0.62374923652 5P 2 1 1.00 3.00000000000 3.00000000000 -0.19866755225 0 Version Number In Element US Ultrasoft pseudopotential T Nonlinear Core Correction SLA PW PBX PBC PBE Exchange-Correlation functional 13.00000000000 Z valence -114.86650168195 Total energy 30.00000 300.0000000 Suggested cutoff for wfc and rho 2 Max angular momentum component 1241 Number of points in mesh 3 4 Number of Wavefunctions, Number of Projectors Wavefunctions nl l occ 4D 2 10.00 5S 0 2.00 5P 1 1.00 1.86098360317E-05 1.88439189524E-05 1.90809462738E-05 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