Generated using "atomic" code by A. Dal Corso v.5.1.2 Author: ADC Generation date: 30Jul2016 Pseudopotential type: USPP Element: C Functional: PBE Suggested minimum cutoff for wavefunctions: 40. Ry Suggested minimum cutoff for charge density: 326. Ry The Pseudo was generated with a Scalar-Relativistic Calculation Local Potential by smoothing AE potential with Bessel fncs, cutoff radius: 1.0000 Pseudopotential contains additional information for GIPAW reconstruction. Valence configuration: nl pn l occ Rcut Rcut US E pseu 2S 1 0 2.00 1.000 1.200 -1.010677 2P 2 1 2.00 0.900 1.400 -0.388489 Generation configuration: 2S 1 0 2.00 1.000 1.200 -1.010668 2S 1 0 0.00 1.000 1.200 3.000000 2P 2 1 2.00 0.900 1.400 -0.388486 2P 2 1 0.00 0.900 1.400 0.050000 Pseudization used: troullier-martins &input title='C', zed=6., rel=1, config='[He] 2s2 2p2', iswitch=3, dft='PBE' / &inputp lpaw=.false., pseudotype=3, file_pseudopw='C.pbe-n-rrkjus_psl.1.0.0.UPF', author='ADC', lloc=-1, rcloc=1.0 which_augfun='PSQ', rmatch_augfun_nc=.true., nlcc=.true., new_core_ps=.true., rcore=0.7, tm=.true. / 4 2S 1 0 2.00 0.00 1.00 1.20 0.0 2S 1 0 0.00 3.00 1.00 1.20 0.0 2P 2 1 2.00 0.00 0.90 1.40 0.0 2P 2 1 0.00 0.05 0.90 1.40 0.0 1.519803275924194E-004 1.538920047781704E-004 1.558277279027637E-004 1.577877994268757E-004 1.597725256156700E-004 1.617822165866515E-004 1.638171863581231E-004 1.658777528982519E-004 1.679642381747518E-004 1.700769682051924E-004 1.722162731079395E-004 1.743824871537364E-004 1.765759488179350E-004 1.787970008333828E-004 1.810459902439763E-004 1.833232684588864E-004 1.856291913074672E-004 1.879641190948554E-004 1.903284166582679E-004 1.927224534240096E-004 1.951466034651957E-004 1.976012455602021E-004 2.000867632518501E-004 2.026035449073358E-004 2.051519837789135E-004 2.077324780653416E-004 2.103454309741024E-004 2.129912507844041E-004 2.156703509109747E-004 2.183831499686600E-004 2.211300718378319E-004 2.239115457306211E-004 2.267280062579823E-004 2.295798934976029E-004 2.324676530626665E-004 2.353917361714803E-004 2.383525997179791E-004 2.413507063431159E-004 2.443865245071505E-004 2.474605285628478E-004 2.505731988295954E-004 2.537250216684553E-004 2.569164895581584E-004 2.601481011720554E-004 2.634203614560362E-004 2.667337817074274E-004 2.700888796548844E-004 2.734861795392877E-004 2.769262121956557E-004 2.804095151360902E-004 2.839366326337623E-004 2.875081158079570E-004 2.911245227101866E-004 2.947864184113868E-004 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