Generated using "atomic" code by A. Dal Corso v.7.3 Author: Alberto Debernardi Generation date: 4Oct2024 Pseudopotential type: USPP Element: Ge Functional: PBE Suggested minimum cutoff for wavefunctions: 15. Ry Suggested minimum cutoff for charge density: 300. Ry The Pseudo was generated with a Scalar-Relativistic Calculation L component and cutoff radius for Local Potential: 2 4.8000 Valence configuration: nl pn l occ Rcut Rcut US E pseu 4S 1 0 2.00 1.500 2.350 -0.862222 4P 2 1 2.00 1.500 2.350 -0.286298 Generation configuration: 4S 1 0 2.00 1.500 2.350 -0.862222 4S 1 0 0.00 1.500 2.350 -0.500000 4P 2 1 2.00 1.500 2.350 -0.286298 4P 2 1 0.00 1.500 2.350 0.300000 4D 3 2 -1.00 4.800 4.800 0.300000 Pseudization used: rrkj @input title='Ge' prefix='Ge/ld1', zed=32, rel=1, rlderiv = 2.50, beta = 0.5, config = ' [Ar] 3d10 4s2 4p2 4d-1' iswitch=3, dft='PBE', nld=3, eminld=-8, emaxld=8, deld=0.01d0, / @inputp author='Alberto Debernardi', pseudotype=3, lloc=2, file_pseudopw='Ge4pbe0.pbe-rrkj3.UPF' rho0=0.02, !nX n l occ nrg rmin rcut / 5 4S 1 0 2.00 0.00 1.50 2.35 4S 1 0 0.00 -0.50 1.50 2.35 4P 2 1 2.00 0.00 1.50 2.35 4P 2 1 0.00 0.30 1.50 2.35 4D 3 2 -1.00 0.30 4.80 4.80 2.849631142357863E-05 2.885475089590694E-05 2.921769898176819E-05 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