Generated using Vanderbilt code, version 7 3 6 Author: kfg Generation date: 23 7 2013 Automatically converted from original format 1 The Pseudo was generated with a Scalar-Relativistic Calculation 2.30000000000E+00 Local Potential cutoff radius nl pn l occ Rcut Rcut US E pseu 4D 4 2 9.50 0.00000000000 1.80000000000 -1.31486105300 5S 5 0 2.00 0.00000000000 2.25000000000 -0.73306807900 5P 5 1 0.00 0.00000000000 2.25000000000 -0.32842014500 0 Version Number Cd Element US Ultrasoft pseudopotential T Nonlinear Core Correction SLA PW PSX PSC PBEsol Exchange-Correlation functional 12.00000000000 Z valence -113.86442026800 Total energy 0.00000 0.00000 Suggested cutoff for wfc and rho 2 Max angular momentum component 889 Number of points in mesh 3 6 Number of Wavefunctions, Number of Projectors Wavefunctions nl l occ 4D 2 9.50 5S 0 2.00 5P 1 0.00 0.00000000000E+00 1.19209398672E-09 2.41436597639E-09 3.66757992880E-09 4.95251914345E-09 6.26998674919E-09 7.62080620615E-09 9.00582182047E-09 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If not zero, Qij's inside rinner are computed using qfcoef's 1 1.00000000000E+00 2 1.00000000000E+00 3 1.00000000000E+00 4 1.00000000000E+00 5 1.00000000000E+00 1 1 0 i j (l(j)) -6.63643471246E-01 Q_int 0.00000000000E+00 -1.62719918764E-18 -6.67461052404E-18 -1.54020631215E-17 -2.80848462117E-17 -4.50145559361E-17 -6.64999869241E-17 -9.28680709868E-17 -1.24464865381E-16 -1.61656593217E-16 -2.04830738728E-16 -2.54397200245E-16 -3.10789503876E-16 -3.74466081052E-16 -4.45911613239E-16 -5.25638447316E-16 -6.14188085284E-16 -7.12132752146E-16 -8.20077046038E-16 -9.38659674855E-16 -1.06855528385E-15 -1.21047637896E-15 -1.36517535075E-15 -1.53344660423E-15 -1.71612880007E-15 -1.91410721284E-15 -2.12831621250E-15 -2.35974187539E-15 -2.60942473147E-15 -2.87846265486E-15 -3.16801390509E-15 -3.47930032680E-15 -3.81361071612E-15 -4.17230436242E-15 -4.55681477428E-15 -4.96865359943E-15 -5.40941474855E-15 -5.88077873338E-15 -6.38451723048E-15 -6.92249788193E-15 -7.49668934547E-15 -8.10916660684E-15 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