Generated using "atomic" code by A. Dal Corso v.6.2.2 Author: ADC Generation date: 4May2018 Pseudopotential type: PAW Element: Ho Functional: SLA PZ NOGX NOGC Suggested minimum cutoff for wavefunctions: 39. Ry Suggested minimum cutoff for charge density: 269. Ry The Pseudo was generated with a Fully-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 2.0000 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 5S 1 0 2.00 1.200 1.600 -4.034989 6S 2 0 1.50 1.200 1.600 -0.353810 5P 2 1 2.00 1.200 1.700 -2.465113 5P 2 1 4.00 1.200 1.700 -2.069405 6P 3 1 0.50 1.200 1.700 -0.137956 6P 3 1 0.00 1.200 1.700 -0.115684 5D 3 2 1.00 1.200 2.000 -0.218168 5D 3 2 0.00 1.200 2.000 -0.195728 Generation configuration: 5S 1 0 2.00 1.200 1.600 -4.034985 6S 2 0 1.50 1.200 1.600 -0.353809 5P 2 1 2.00 1.200 1.700 -2.465108 5P 2 1 4.00 1.200 1.700 -2.069396 6P 3 1 0.50 1.200 1.700 -0.137959 6P 3 1 0.00 1.200 1.700 -0.115683 5D 3 2 1.00 1.200 2.000 -0.218170 5D 3 2 0.00 1.200 2.000 -0.195722 5D 3 2 0.00 1.200 2.000 2.000000 5D 3 2 0.00 1.200 2.000 2.000000 Pseudization used: troullier-martins &input title='Ho', zed=67.0, rel=2, config='[Xe] 4f10.0 5d1.0 6s1.5 6p0.5', iswitch=3, dft='LDA' / &inputp lpaw=.true., use_xsd=.FALSE., pseudotype=3, file_pseudopw='Ho.rel-pz-spdn-kjpaw_psl.1.0.0.UPF', author='ADC', lloc=-1, rcloc=2.0, which_augfun='PSQ', rmatch_augfun_nc=.true., nlcc=.true., new_core_ps=.true., rcore=1.1, tm=.true. / 6 5S 1 0 2.00 0.00 1.20 1.60 0.0 6S 2 0 1.50 0.00 1.20 1.60 0.0 5P 2 1 6.00 0.00 1.20 1.70 0.0 6P 3 1 0.50 0.00 1.20 1.70 0.0 5D 3 2 1.00 0.00 1.20 2.00 0.0 5D 3 2 0.00 2.00 1.20 2.00 0.0 1.361017859036591e-5 1.378137356222422e-5 1.395472190174003e-5 1.413025069494409e-5 1.430798736856746e-5 1.448795969432700e-5 1.467019579326476e-5 1.485472414014195e-5 1.504157356788822e-5 1.523077327210678e-5 1.542235281563637e-5 1.561634213317042e-5 1.581277153593448e-5 1.601167171642234e-5 1.621307375319191e-5 1.641700911572117e-5 1.662350966932542e-5 1.683260768013630e-5 1.704433582014339e-5 1.725872717229937e-5 1.747581523568917e-5 1.769563393076437e-5 1.791821760464330e-5 1.814360103647783e-5 1.837181944288778e-5 1.860290848346342e-5 1.883690426633753e-5 1.907384335382723e-5 1.931376276814698e-5 1.955669999719343e-5 1.980269300040286e-5 2.005178021468249e-5 2.030400056041633e-5 2.055939344754652e-5 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