Generated using "atomic" code by A. Dal Corso (espresso distribution) Author: anonymous Generation date: 27Dec2005 O 2 The Pseudo was generated with a Fully-Relativistic Calculation 2 1.4000000E+00 L component and cutoff radius for Local Potential nl pn l occ Rcut Rcut US E pseu 2S 1 0 2.00 1.40000000000 1.70000000000 -1.74555034618 2S 1 0 0.00 1.40000000000 1.70000000000 -0.67746494963 2P 2 1 2.00 1.40000000000 1.70000000000 -0.67476159832 2P 2 1 0.00 1.40000000000 1.70000000000 0.05000000000 2P 2 1 2.00 1.40000000000 1.70000000000 -0.67478973516 2P 2 1 0.00 1.40000000000 1.70000000000 0.05000000000 3D 3 2 -2.00 1.40000000000 1.40000000000 0.15000000000 3D 3 2 -2.00 1.40000000000 1.40000000000 0.15000000000 0 Version Number O Element US Ultrasoft pseudopotential F Nonlinear Core Correction SLA PZ NOGX NOGC PZ Exchange-Correlation functional 6.00000000000 Z valence -31.31048463398 Total energy 0.0000000 0.0000000 Suggested cutoff for wfc and rho 2 Max angular momentum component 1095 Number of points in mesh 3 6 Number of Wavefunctions, Number of Projectors Wavefunctions nl l occ 2S 0 2.00 2P 1 2.00 2P 1 2.00 1.13985245694E-04 1.15419003584E-04 1.16870795927E-04 1.18340849570E-04 1.19829394212E-04 1.21336662440E-04 1.22862889769E-04 1.24408314674E-04 1.25973178631E-04 1.27557726154E-04 1.29162204831E-04 1.30786865365E-04 1.32431961613E-04 1.34097750625E-04 1.35784492683E-04 1.37492451344E-04 1.39221893481E-04 1.40973089321E-04 1.42746312494E-04 1.44541840068E-04 1.46359952599E-04 1.48200934170E-04 1.50065072439E-04 1.51952658681E-04 1.53863987834E-04 1.55799358549E-04 1.57759073231E-04 1.59743438088E-04 1.61752763183E-04 1.63787362476E-04 1.65847553878E-04 1.67933659298E-04 1.70046004693E-04 1.72184920123E-04 1.74350739797E-04 1.76543802129E-04 1.78764449788E-04 1.81013029757E-04 1.83289893380E-04 1.85595396422E-04 1.87929899122E-04 1.90293766251E-04 1.92687367169E-04 1.95111075879E-04 1.97565271092E-04 2.00050336281E-04 2.02566659741E-04 2.05114634654E-04 2.07694659147E-04 2.10307136352E-04 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