***************************************************
                    Input file
***************************************************

 System.CurrrentDirectory    ./
 System.Name                 Cl_PBE
 Log.print                   OFF

 <<< Calculation type >>>
 eq.type                     dirac2
 calc.type                   VPS
 xc.type                     GGA

 <<< Atom >>>
 AtomSpecies                 17
 max.ocupied.N               3
 total.electron              17.0000
 valence.electron            7.0000

 <ocupied.electrons
 1  2.0000 
 2  2.0000  6.0000 
 3  2.0000  5.0000  0.0000 
 ocupied.electrons>

 <<< parameters for solving 1D-differential equations >>>
 grid.xmin                   -7.000
 grid.xmax                    2.700
 grid.num                    9000
 grid.num.output             2000

 <<< SCF >>>
 scf.maxIter                 60
 scf.Mixing.Type             Simple
 scf.Init.Mixing.Weight      0.10000
 scf.Min.Mixing.Weight       0.00100
 scf.Max.Mixing.Weight       0.80000
 scf.Mixing.History          7
 scf.Mixing.StartPulay       4
 scf.criterion               0.00000000000100

 <<< Pseudo potential >>>
 vps.type                    TM
 number.vps                  3
 <pseudo.NandL
  0    3   0   1.3000
  1    3   1   1.3000
  2    3   2   1.5000
 pseudo.NandL>
 Blochl.projector.num        2
 local.type                  Polynomial
 local.part.vps              3
 local.cutoff                1.50000
 local.origin.ratio          3.50000
 log.deri.RadF.calc          ON
 log.deri.MinE               -2.00000
 log.deri.MaxE               2.00000
 log.deri.num                50
 <log.deri.R
  0   2.2000  2.2000
  1   2.2000  2.2000
  2   2.2000  2.2000
 log.deri.R>
 ghost.check                 OFF

charge.states.num            1
<charge.states
   0.000
charge.states>

 <<< Core electron density for partial core correction >>>
 charge.pcc.calc             ON
 pcc.ratio                   0.04000
 pcc.ratio.origin            9.00000

 <<< Pseudo atomic orbitals >>>
 maxL.pao                    3
 num.pao                     5
 radial.cutoff.pao           4.50000
 height.of.wall              20000.00000
 rising.edge                 0.20000
 search.LowerE               -3.00000
 search.UpperE               20.00000
 num.of.partition            300
 matching.point.ratio        0.67000

***************************************************
    SCF history in all electrons calculations      
***************************************************


***************************************************
 Eigenvalues (Hartree) in all electrons calculations
***************************************************

                         j=l+1/2                j=l-1/2
 n=  1  l=  0       -97.8831193250612      -97.8831193250612
 n=  2  l=  0        -9.1192796158000       -9.1192796158000
 n=  2  l=  1        -7.0895995380365       -7.1510004354100
 n=  3  l=  0        -0.7537977262141       -0.7537977262141
 n=  3  l=  1        -0.3296830352987       -0.3342422443826


***************************************************
  Energies (Hartree) in all electrons calculations 
***************************************************

 Eeigen =     -259.8940064536929
 Ekin   =      454.5827857818204
 EHart  =      203.6670181729357
 Exc    =      -23.7129517221120
 Eec    =    -1091.9594741985027
 Etot   = Ekin + EHart + Exc + Eec
 Etot   =     -457.4226219658585


***********************************************************
** DATA for factorized norm conserving pseudo potentials **
***********************************************************

j.dependent.pseudo.potentials   on

<VPS> L=0, dif of log deris for all electrons =  197.0907824172  197.0907824172
<VPS> L=0, dif of log deris for semi local    =    0.7558311495    0.7558311495
<VPS> L=1, dif of log deris for all electrons =   23.8677003658   57.2179541836
<VPS> L=1, dif of log deris for semi local    =    3.1894382060    2.0773652045
<VPS> L=2, dif of log deris for all electrons =   75.3606972551   64.3406909280
<VPS> L=2, dif of log deris for semi local    =    3.6448319195    4.5866818728

<project.energies
 6
 0    9.56254017651548e-01   9.56254017651548e-01
 0    2.36155299770058e+00   2.36155299770058e+00
 1    1.69589074911595e+00   1.67757230202516e+00
 1    5.21632687806104e+00   5.11455325578153e+00
 2    2.16287040144439e+00   2.16517762893519e+00
 2    7.01098348877233e+00   7.04167892100329e+00
project.energies>

<Pseudo.Potentials
-7.00000000000000e+00 9.11881965554516e-04  -1.63383807806800e+01   5.94618775988716e+00 5.94618775988716e+00  6.97023710180980e+00 6.97023710180980e+00  8.58584966237741e-03 8.68412484423276e-03  9.33756037492286e-03 9.51818660174059e-03  3.23677948659039e-06 3.21346454542627e-06  1.26768338495507e-06 1.22263325935814e-06
-6.99514807403702e+00 9.16317100109924e-04  -1.63383807806800e+01   5.94618783773279e+00 5.94618783773279e+00  6.97023722033485e+00 6.97023722033485e+00  8.62760879049345e-03 8.72636195513461e-03  9.38297567254860e-03 9.56448041507031e-03  3.26834166412901e-06 3.24479937733443e-06  1.28004489210054e-06 1.23455547757469e-06
-6.99029614807404e+00 9.20773805898525e-04  -1.63383807806800e+01   5.94618791634554e+00 5.94618791634554e+00  6.97023734004315e+00 6.97023734004315e+00  8.66957102310894e-03 8.76880449531208e-03  9.42861185820061e-03 9.61099938929394e-03  3.30021160843442e-06 3.27643975915007e-06  1.29252694177002e-06 1.24659395474528e-06
-6.98544422211106e+00 9.25252187836665e-04  -1.63383807806800e+01   5.94618799573289e+00 5.94618799573289e+00  6.97023746094630e+00 6.97023746094630e+00  8.71173734806619e-03 8.81145346391459e-03  9.47447000622953e-03 9.65774461954444e-03  3.33239232059200e-06 3.30838867034193e-06  1.30513070947207e-06 1.25874982460846e-06
-6.98059229614807e+00 9.29752351350970e-04  -1.63383807806800e+01   5.94618807590241e+00 5.94618807590241e+00  6.97023758305600e+00 6.97023758305600e+00  8.75410875801208e-03 8.85430986495112e-03  9.52055119621158e-03 9.70471720628136e-03  3.36488683095147e-06 3.34064911943230e-06  1.31785738217947e-06 1.27102423195975e-06
-6.97574037018509e+00 9.34274402380832e-04  -1.63383807806800e+01   5.94618815686175e+00 5.94618815686175e+00  6.97023770638407e+00 6.97023770638407e+00  8.79668625042145e-03 8.89737470731388e-03  9.56685651297395e-03 9.75191825531680e-03  3.39769819941226e-06 3.37322414428037e-06  1.33070815844104e-06 1.28341833275941e-06
-6.97088844422211e+00 9.38818447380901e-04  -1.63383807806800e+01   5.94618823861863e+00 5.94618823861863e+00  6.97023783094244e+00 6.97023783094244e+00  8.83947082762057e-03 8.94064900480203e-03  9.61338704662031e-03 9.79934887784146e-03  3.43082951571166e-06 3.40611681236825e-06  1.34368424849463e-06 1.29593329424140e-06
-6.96603651825913e+00 9.43384593323596e-04  -1.63383807806800e+01   5.94618832118084e+00 5.94618832118084e+00  6.97023795674318e+00 6.97023795674318e+00  8.88246349681074e-03 8.98413377614558e-03  9.66014389255654e-03 9.84701019045076e-03  3.46428389971580e-06 3.43933022108988e-06  1.35678687438100e-06 1.30857029502325e-06
-6.96118459229615e+00 9.47972947701615e-04  -1.63383807806800e+01   5.94618840455624e+00 5.94618840455624e+00  6.97023808379845e+00 6.97023808379845e+00  8.92566527009199e-03 9.02783004502933e-03  9.70712815151646e-03 9.89490331517115e-03  3.49806450171341e-06 3.47286749804271e-06  1.37001727005907e-06 1.32133052521726e-06
-6.95633266633317e+00 9.52583618530472e-04  -1.63383807806800e+01   5.94618848875278e+00 5.94618848875278e+00  6.97023821212054e+00 6.97023821212054e+00  8.96907716448692e-03 9.07173884011700e-03  9.75434092958779e-03 9.94302937948654e-03  3.53217450271252e-06 3.50673180132219e-06  1.38337668152210e-06 1.33421518654247e-06
-6.95148074037018e+00 9.57216714351037e-04  -1.63383807806800e+01   5.94618857377850e+00 5.94618857377850e+00  6.97023834172186e+00 6.97023834172186e+00  9.01270020196464e-03 9.11586119507542e-03  9.80178333823815e-03 9.99138951636482e-03  3.56661711474001e-06 3.54092631981921e-06  1.39686636691514e-06 1.34722549243795e-06
-6.94662881440720e+00 9.61872344232094e-04  -1.63383807806800e+01   5.94618865964148e+00 5.94618865964148e+00  6.97023847261494e+00 6.97023847261494e+00  9.05653540946481e-03 9.16019814859891e-03  9.84945649434128e-03 1.00399848642846e-02  3.60139558114408e-06 3.57545427352038e-06  1.41048759665349e-06 1.36036266817714e-06
-6.94177688844422e+00 9.66550617772902e-04  -1.63383807806800e+01   5.94618874634992e+00 5.94618874634992e+00  6.97023860481244e+00 6.97023860481244e+00  9.10058381892185e-03 9.20475074443369e-03  9.89736152020332e-03 1.00888165672618e-02  3.63651317689968e-06 3.61031891381132e-06  1.42424165354244e-06 1.37362795098329e-06
-6.93692496248124e+00 9.71251645105786e-04  -1.63383807806800e+01   5.94618883391207e+00 5.94618883391207e+00  6.97023873832714e+00 6.97023873832714e+00  9.14484646728922e-03 9.24952003140245e-03  9.94549954358922e-03 1.01378857748771e-02  3.67197320891694e-06 3.64552352378270e-06  1.43812983289812e-06 1.38702259014589e-06
-6.93207303651826e+00 9.75975536898717e-04  -1.63383807806800e+01   5.94618892233627e+00 5.94618892233627e+00  6.97023887317195e+00 6.97023887317195e+00  9.18932439656379e-03 9.29450706342909e-03  9.99387169774930e-03 1.01871936423022e-02  3.70777901635256e-06 3.68107141853959e-06  1.45215344266958e-06 1.40054784713861e-06
-6.92722111055528e+00 9.80722404357928e-04  -1.63383807806800e+01   5.94618901163095e+00 5.94618901163095e+00  6.97023900935988e+00 6.97023900935988e+00  9.23401865381045e-03 9.33971289956346e-03  1.00424791214459e-02 1.02367413303280e-02  3.74393397092423e-06 3.71696594551349e-06  1.46631380356178e-06 1.41420499573785e-06
-6.92236918459230e+00 9.85492359230525e-04  -1.63383807806800e+01   5.94618910180463e+00 5.94618910180463e+00  6.97023914690412e+00 6.97023914690412e+00  9.27893029118665e-03 9.38513860400633e-03  1.00913229589804e-02 1.02865300053909e-02  3.78044147722824e-06 3.75321048477771e-06  1.48061224916047e-06 1.42799532214312e-06
-6.91751725862931e+00 9.90285513807121e-04  -1.63383807806800e+01   5.94618919286588e+00 5.94618919286588e+00  6.97023928581795e+00 6.97023928581795e+00  9.32406036596731e-03 9.43078524613445e-03  1.01404043602197e-02 1.03365608396012e-02  3.81730497305999e-06 3.78980844936549e-06  1.49505012605732e-06 1.44192012509783e-06
-6.91266533266633e+00 9.95101980924480e-04  -1.63383807806800e+01   5.94618928482337e+00 5.94618928482337e+00  6.97023942611477e+00 6.97023942611477e+00  9.36940994056957e-03 9.47665390052571e-03  1.01897244806239e-02 1.03868350107699e-02  3.85452792973782e-06 3.82676328559163e-06  1.50962879397720e-06 1.45598071601195e-06
-6.90781340670335e+00 9.99941873968169e-04  -1.63383807806800e+01   5.94618937768588e+00 5.94618937768588e+00  6.97023956780815e+00 6.97023956780815e+00  9.41498008257790e-03 9.52274564698445e-03  1.02392844812729e-02 1.04373537024372e-02  3.89211385242981e-06 3.86407847337681e-06  1.52434962590599e-06 1.47017841908535e-06
-6.90296148074037e+00 1.00480530687523e-03  -1.63383807806800e+01   5.94618947146224e+00 5.94618947146224e+00  6.97023971091178e+00 6.97023971091178e+00  9.46077186476917e-03 9.56906157056685e-03  1.02890855288942e-02 1.04881181038997e-02  3.93006628048398e-06 3.90175752657549e-06  1.53921400822017e-06 1.48451457143278e-06
-6.89810955477739e+00 1.00969239413687e-03  -1.63383807806800e+01   5.94618956616138e+00 5.94618956616138e+00  6.97023985543944e+00 6.97023985543944e+00  9.50678636513795e-03 9.61560276160652e-03  1.03391287958902e-02 1.05391294102386e-02  3.96838878776149e-06 3.93980399330667e-06  1.55422334081724e-06 1.49899052320963e-06
-6.89325762881441e+00 1.01460325080114e-03  -1.63383807806800e+01   5.94618966179231e+00 5.94618966179231e+00  6.97024000140512e+00 6.97024000140512e+00  9.55302466692185e-03 9.66237031574010e-03  1.03894154603658e-02 1.05903888223483e-02  4.00708498297329e-06 3.97822145628814e-06  1.56937903724784e-06 1.51360763773935e-06
-6.88840570285143e+00 1.01953799247565e-03  -1.63383807806800e+01   5.94618975836416e+00 5.94618975836416e+00  6.97024014882290e+00 6.97024014882290e+00  9.59948785862705e-03 9.70936533393313e-03  1.04399467061560e-02 1.06418975469640e-02  4.04615851001983e-06 4.01701353317375e-06  1.58468252484863e-06 1.52836729164170e-06
-6.88355377688844e+00 1.02449673533030e-03  -1.63383807806800e+01   5.94618985588610e+00 5.94618985588610e+00  6.97024029770700e+00 6.97024029770700e+00  9.64617703405390e-03 9.75658892250592e-03  1.04907237228542e-02 1.06936567966904e-02  4.08561304833439e-06 4.05618387689418e-06  1.60013524487711e-06 1.54327087496262e-06
-6.87870185092546e+00 1.02947959610001e-03  -1.63383807806800e+01   5.94618995436743e+00 5.94618995436743e+00  6.97024044807179e+00 6.97024044807179e+00  9.69309329232270e-03 9.80404219315962e-03  1.05417477058397e-02 1.07456677900303e-02  4.12545231322940e-06 4.09573617600093e-06  1.61573865264714e-06 1.55831979130507e-06
-6.87384992496248e+00 1.03448669208745e-03  -1.63383807806800e+01   5.94619005381752e+00 5.94619005381752e+00  6.97024059993178e+00 6.97024059993178e+00  9.74023773789954e-03 9.85172626300235e-03  1.05930198563062e-02 1.07979317514133e-02  4.16568005624643e-06 4.13567415501364e-06  1.63149421766622e-06 1.57351545796145e-06
-6.86899799899950e+00 1.03951814116584e-03  -1.63383807806800e+01   5.94619015424583e+00 5.94619015424583e+00  6.97024075330162e+00 6.97024075330162e+00  9.78761148062233e-03 9.89964225457555e-03  1.06445413812899e-02 1.08504499112246e-02  4.20630006550940e-06 4.17600157477083e-06  1.64740342377376e-06 1.58885930604682e-06
-6.86414607303652e+00 1.04457406178168e-03  -1.63383807806800e+01   5.94619025566193e+00 5.94619025566193e+00  6.97024090819610e+00 6.97024090819610e+00  9.83521563572688e-03 9.94779129588035e-03  1.06963134936979e-02 1.09032235058339e-02  4.24731616608141e-06 4.21672223278412e-06  1.66346776928121e-06 1.60435278063418e-06
-6.85929414707354e+00 1.04965457295756e-03  -1.63383807806800e+01   5.94619035807547e+00 5.94619035807547e+00  6.97024106463016e+00 6.97024106463016e+00  9.88305132387323e-03 9.99617452040420e-03  1.07483374123371e-02 1.09562537776245e-02  4.28873222032485e-06 4.25783996359581e-06  1.67968876711287e-06 1.61999734089026e-06
-6.85444222111056e+00 1.05475979429499e-03  -1.63383807806800e+01   5.94619046149620e+00 5.94619046149620e+00  6.97024122261888e+00 6.97024122261888e+00  9.93111967117198e-03 1.00447930671475e-02  1.08006143619424e-02 1.10095419750228e-02  4.33055212826524e-06 4.29935863914000e-06  1.69606794494878e-06 1.63579446021320e-06
-6.84959029514757e+00 1.05988984597716e-03  -1.63383807806800e+01   5.94619056593395e+00 5.94619056593395e+00  6.97024138217751e+00 6.97024138217751e+00  9.97942180921078e-03 1.00936480806503e-02  1.08531455732058e-02 1.10630893525272e-02  4.37277982795831e-06 4.34128216910715e-06  1.71260684536820e-06 1.65174562637120e-06
-6.84473836918459e+00 1.06504484877180e-03  -1.63383807806800e+01   5.94619067139867e+00 5.94619067139867e+00  6.97024154332140e+00 6.97024154332140e+00  1.00279588750810e-02 1.01427407110197e-02  1.09059322828055e-02 1.11168971707382e-02  4.41541929586111e-06 4.38361450131240e-06  1.72930702599554e-06 1.66785234164303e-06
-6.83988644322161e+00 1.07022492403404e-03  -1.63383807806800e+01   5.94619077790040e+00 5.94619077790040e+00  6.97024170606611e+00 6.97024170606611e+00  1.00767320114046e-02 1.01920721139561e-02  1.09589757334347e-02 1.11709666963879e-02  4.45847454720630e-06 4.42635962206724e-06  1.74617005964671e-06 1.68411612295924e-06
-6.83503451725863e+00 1.07543019370922e-03  -1.63383807806800e+01   5.94619088541764e+00 5.94619088541764e+00  6.97024187031903e+00 6.97024187031903e+00  1.01257423662719e-02 1.02416434506916e-02  1.10122771735424e-02 1.12252992020765e-02  4.50194963602062e-06 4.46952155619476e-06  1.76319753364212e-06 1.70053850121644e-06
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2.61651725862931e+00 1.36879688193111e+01  -5.11398008909803e-01   1.97535962136032e-12 1.97535962136032e-12  -2.13565263488434e-12 -2.13565263488434e-12  2.13739202701957e-10 1.99555396058429e-10  -2.29156324972056e-10 -2.14145002316810e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.62136918459230e+00 1.37545432070028e+01  -5.08922753323480e-01   1.80460018135801e-12 1.80460018135801e-12  -1.95103675667887e-12 -1.95103675667887e-12  2.00582669826346e-10 1.87203668055547e-10  -2.15050813001889e-10 -2.00890240649705e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.62622111055528e+00 1.38214413935835e+01  -5.06459478493742e-01   1.64819179733161e-12 1.64819179733161e-12  -1.78193645875983e-12 -1.78193645875983e-12  1.88215096646988e-10 1.75596663809679e-10  -2.01791167478466e-10 -1.88434648657677e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.63107303651826e+00 1.38886649539189e+01  -5.04008126254331e-01   1.50453655574585e-12 1.50453655574585e-12  -1.62662416670785e-12 -1.62662416670785e-12  1.76540509321939e-10 1.64644124313748e-10  -1.89274492495096e-10 -1.76681368990263e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.63592496248124e+00 1.39562154705344e+01  -5.01568639078122e-01   1.37286423901534e-12 1.37286423901534e-12  -1.48426716223199e-12 -1.48426716223199e-12  1.65548535206501e-10 1.54335720101321e-10  -1.77489667062636e-10 -1.65619316839169e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.64077688844422e+00 1.40240945336525e+01  -4.99140959352923e-01   1.25226614451973e-12 1.25226614451973e-12  -1.35388300555839e-12 -1.35388300555839e-12  1.55207444368772e-10 1.44641225765525e-10  -1.66402672591804e-10 -1.55216057038958e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.64562881440720e+00 1.40923037412298e+01  -4.96725030114699e-01   1.14176862956624e-12 1.14176862956624e-12  -1.23441904783610e-12 -1.23441904783610e-12  1.45470486940451e-10 1.35516462524425e-10  -1.55963387297898e-10 -1.45424181037934e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.65048074037018e+00 1.41608446989951e+01  -4.94320794300142e-01   1.04060699934855e-12 1.04060699934855e-12  -1.12504854257755e-12 -1.12504854257755e-12  1.36310125290365e-10 1.26935201276030e-10  -1.46142287267414e-10 -1.36215542130741e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.65533266633317e+00 1.42297190204870e+01  -4.91928195502703e-01   9.48029543773888e-13 9.48029543773888e-13  -1.02495878185773e-12 -1.02495878185773e-12  1.27694553690128e-10 1.18867273797607e-10  -1.36905272675081e-10 -1.27557766542452e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.66018459229615e+00 1.42989283270918e+01  -4.89547177202827e-01   8.63341095423941e-13 8.63341095423941e-13  -9.33398188580079e-13 -9.33398188580079e-13  1.19593552583682e-10 1.11284026792697e-10  -1.28219944274092e-10 -1.19420106176471e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.66503651825913e+00 1.43684742480820e+01  -4.87177683545895e-01   7.85900730497563e-13 7.85900730497563e-13  -8.49673830865376e-13 -8.49673830865376e-13  1.11978499996932e-10 1.04158331526399e-10  -1.20055615628932e-10 -1.11773448954464e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.66988844422211e+00 1.44383584206540e+01  -4.84819658551025e-01   7.15116106188903e-13 7.15116106188903e-13  -7.73145299937647e-13 -7.73145299937647e-13  1.04822204597753e-10 9.74644249017022e-11  -1.12383134134496e-10 -1.04590148274246e-10  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.67474037018509e+00 1.45085824899675e+01  -4.82473046910031e-01   6.50441601179589e-13 6.50441601179589e-13  -7.03222699728719e-13 -7.03222699728719e-13  9.80989332768711e-11 9.11779342360834e-11  -1.05174910586458e-10 -9.78440495978638e-11  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.67959229614807e+00 1.45791481091835e+01  -4.80137793175667e-01   5.91373355652031e-13 5.91373355652031e-13  -6.39361284414062e-13 -6.39361284414062e-13  9.17842553613620e-11 8.52757290891682e-11  -9.84047521583268e-11 -9.15103314467998e-11  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.68444422211105e+00 1.46500569395035e+01  -4.77813842580740e-01   5.37447799822629e-13 5.37447799822629e-13  -5.81059867546137e-13 -5.81059867546137e-13  8.58550748424741e-11 7.97359506167786e-11  -9.20478969540330e-11 -8.55655369022563e-11  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.68929614807404e+00 1.47213106502089e+01  -4.75501140206646e-01   4.88249840298292e-13 4.88249840298292e-13  -5.27869672713153e-13 -5.27869672713153e-13  8.02911265350031e-11 7.45394041306518e-11  -8.60826180874794e-11 -7.99890679770068e-11  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.69414807403702e+00 1.47929109186997e+01  -4.73199631821804e-01   4.43153488000574e-13 4.43153488000574e-13  -4.79113914289193e-13 -4.79113914289193e-13  7.50418840225587e-11 6.96386880262171e-11  -8.04547446585894e-11 -7.47300575215676e-11  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
2.69900000000000e+00 1.48648594305345e+01  -4.70909263022745e-01   4.04759208637800e-13 4.04759208637800e-13  -4.37604077492156e-13 -4.37604077492156e-13  7.04777112290029e-11 6.53789482328818e-11  -7.55613554395212e-11 -7.01588855587150e-11  0.00000000000000e+00 0.00000000000000e+00  0.00000000000000e+00 0.00000000000000e+00
Pseudo.Potentials>


***********************************************************
**            Core electron densities for PCC            **
***********************************************************
<density.PCC
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2.69900000000000e+00 1.48648594305345e+01  1.51739608542480e-17
density.PCC>