Generated using "atomic" code by A. Dal Corso v.6.3 Author: ADC Generation date: 6Sep2018 Pseudopotential type: PAW Element: Co Functional: SLA PW PSX PSC Suggested minimum cutoff for wavefunctions: 60. Ry Suggested minimum cutoff for charge density: 450. Ry The Pseudo was generated with a Fully-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 1.1000 Pseudopotential contains additional information for spin-orbit calculations. Pseudopotential contains additional information for GIPAW reconstruction. Valence configuration: nl pn l occ Rcut Rcut US E pseu 3S 1 0 2.00 1.100 1.400 -7.502724 4S 2 0 2.00 1.100 1.400 -0.403235 3P 2 1 2.00 0.900 1.300 -4.902953 3P 2 1 4.00 0.900 1.300 -4.766583 3D 3 2 4.00 1.100 1.400 -0.611502 3D 3 2 3.00 1.100 1.400 -0.597380 Generation configuration: 3S 1 0 2.00 1.100 1.400 -7.502723 4S 2 0 2.00 1.100 1.400 -0.403235 3P 2 1 2.00 0.900 1.300 -4.902950 3P 2 1 4.00 0.900 1.300 -4.766576 4P 3 1 0.00 0.900 1.300 6.300000 4P 3 1 0.00 0.900 1.300 6.300000 3D 3 2 4.00 1.100 1.400 -0.611500 3D 3 2 3.00 1.100 1.400 -0.597368 3D 3 2 0.00 1.100 1.400 -2.000000 3D 3 2 0.00 1.100 1.400 -2.000000 Pseudization used: troullier-martins &input title='Co', zed=27., rel=2, config='[Ar] 3d7.0 4s2.0 4p0.0', iswitch=3, dft='PBESOL' / &inputp lpaw = .true., use_xsd=.FALSE., pseudotype=3, file_pseudopw='Co.rel-pbesol-spn-kjpaw_psl.0.3.1.UPF', author='ADC', lloc=-1, rcloc=1.1, which_augfun='PSQ', rmatch_augfun_nc=.true., nlcc=.true., rcore=0.65, tm=.true. / 6 3S 1 0 2.00 0.00 1.10 1.40 0.0 4S 2 0 2.00 0.00 1.10 1.40 0.0 3P 2 1 6.00 0.00 0.90 1.30 0.0 4P 3 1 0.00 6.30 0.90 1.30 0.0 3D 3 2 7.00 0.00 1.10 1.40 0.0 3D 3 2 0.00 -2.00 1.10 1.40 0.0 3.377340613164876e-5 3.419822328403787e-5 3.462838397839193e-5 3.506395542819459e-5 3.550500569237110e-5 3.595160368592255e-5 3.640381919069402e-5 3.686172286627819e-5 3.732538626105594e-5 3.779488182337610e-5 3.827028291287544e-5 3.875166381194142e-5 3.923909973731890e-5 3.973266685186285e-5 4.023244227643918e-5 4.073850410197475e-5 4.125093140165937e-5 4.176980424330120e-5 4.229520370183732e-5 4.282721187200214e-5 4.336591188115460e-5 4.391138790226715e-5 4.446372516707781e-5 4.502300997940795e-5 4.558932972864744e-5 4.616277290340923e-5 4.674342910535609e-5 4.733138906320090e-5 4.792674464688326e-5 4.852958888192445e-5 4.914001596396266e-5 4.975812127347136e-5 5.038400139066273e-5 5.101775411057840e-5 5.165947845837032e-5 5.230927470477339e-5 5.296724438177312e-5 5.363349029847021e-5 5.430811655714455e-5 5.499122856952173e-5 5.568293307324341e-5 5.638333814854563e-5 5.709255323514631e-5 5.781068914934564e-5 5.853785810134137e-5 5.927417371276164e-5 6.001975103441877e-5 6.077470656428615e-5 6.153915826570126e-5 6.231322558579782e-5 6.309702947416942e-5 6.389069240176823e-5 6.469433838004147e-5 6.550809298030816e-5 6.633208335338036e-5 6.716643824943019e-5 6.801128803810768e-5 6.886676472891116e-5 6.973300199181397e-5 7.061013517815099e-5 7.149830134176700e-5 7.239763926043210e-5 7.330828945752580e-5 7.423039422399404e-5 7.516409764058274e-5 7.610954560035031e-5 7.706688583146404e-5 7.803626792028274e-5 7.901784333472992e-5 8.001176544796127e-5 8.101818956232908e-5 8.203727293364876e-5 8.306917479577049e-5 8.411405638545951e-5 8.517208096759022e-5 8.624341386065607e-5 8.732822246260120e-5 8.842667627697679e-5 8.953894693942605e-5 9.066520824450308e-5 9.180563617282809e-5 9.296040891858512e-5 9.412970691736511e-5 9.531371287435926e-5 9.651261179290735e-5 9.772659100340451e-5 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