Generated using Vanderbilt code, version 7 3 4 Author: unknown Generation date: 4 3 5 Automatically converted from original format 1 The Pseudo was generated with a Scalar-Relativistic Calculation 2.00000000000E+00 Local Potential cutoff radius nl pn l occ Rcut Rcut US E pseu 3D 3 2 9.50 10.00000000000 2.00000000000 -0.60492460120 4S 4 0 1.00 10.00000000000 2.10000000000 -0.43710222811 4P 4 1 0.50 10.00000000000 2.20000000000 -0.10740671642 0 Version Number Cu Element US Ultrasoft pseudopotential T Nonlinear Core Correction SLA PW PBE PBE PBE Exchange-Correlation functional 11.00000000000 Z valence -121.01063523375 Total energy 0.0000000 0.0000000 Suggested cutoff for wfc and rho 2 Max angular momentum component 867 Number of points in mesh 3 6 Number of Wavefunctions, Number of Projectors Wavefunctions nl l occ 3D 2 9.50 4S 0 1.00 4P 1 0.50 0.00000000000E+00 1.46106238207E-06 2.94709958648E-06 4.45853852296E-06 5.99581339868E-06 7.55936584296E-06 9.14964503416E-06 1.07671078287E-05 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-1.65144947200E+00 3 3 -8.66178336333E-01 3 4 3.02401592804E+00 4 4 -7.80069687891E-01 5 5 5.43464872408E+01 5 6 -6.12661258441E+01 6 6 6.88019649270E+01 8 nqf. If not zero, Qij's inside rinner are computed using qfcoef's 1 1.40000000000E+00 2 1.40000000000E+00 3 1.40000000000E+00 4 1.40000000000E+00 5 1.40000000000E+00 1 1 0 i j (l(j)) -6.01791003780E-01 Q_int 0.00000000000E+00 -7.34781101025E-13 -2.98957933095E-12 -6.84235347795E-12 -1.23741870366E-11 -1.96694034113E-11 -2.88156852196E-11 -3.99041978388E-11 -5.30297173441E-11 -6.82907629926E-11 -8.57897344121E-11 -1.05633053658E-10 -1.27931312311E-10 -1.52799423788E-10 -1.80356781055E-10 -2.10727419921E-10 -2.44040188116E-10 -2.80428920357E-10 -3.20032619598E-10 -3.62995644691E-10 -4.09467904689E-10 -4.59605059996E-10 -5.13568730636E-10 -5.71526711860E-10 -6.33653197372E-10 -7.00129010420E-10 -7.71141843035E-10 -8.46886503706E-10 -9.27565173770E-10 -1.01338767285E-09 -1.10457173359E-09 -1.20134328616E-09 -1.30393675262E-09 -1.41259535177E-09 -1.52757141464E-09 -1.64912671110E-09 -1.77753278792E-09 -1.91307131872E-09 -2.05603446621E-09 -2.20672525712E-09 -2.36545797030E-09 -2.53255853844E-09 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