/usr/share/espresso/pseudo/H.pz-vbc.UPF

<PP_INFO>
Generated using ld1 code
Author: P. Giannozzi    Generation date: 1990
Info: H LDA 1s1 VonBarth-Car local
    0        The Pseudo was generated with a Non-Relativistic Calculation
  0.00000000000E+00    Local Potential cutoff radius
nl pn  l   occ               Rcut            Rcut US             E pseu
1S  0  0  1.00      0.00000000000      0.00000000000      0.00000000000
</PP_INFO>


<PP_HEADER>
   0                   Version Number
  H                    Element
   NC                  Norm - Conserving pseudopotential
    F                  Nonlinear Core Correction
 SLA  PZ   NOGX NOGC   PZ   Exchange-Correlation functional
    1.00000000000      Z valence
    0.00000000000      Total energy
  0.0000000  0.0000000 Suggested cutoff for wfc and rho
   -1                  Max angular momentum component
  131                  Number of points in mesh
    1    0             Number of Wavefunctions, Number of Projectors
 Wavefunctions         nl  l   occ
                       1S  0  1.00
</PP_HEADER>


<PP_MESH>
  <PP_R>
  1.83156388887E-02  1.94968961086E-02  2.07543378737E-02  2.20928776651E-02
  2.35177458560E-02  2.50345101500E-02  2.66490973364E-02  2.83678164497E-02
  3.01973834223E-02  3.21449473269E-02  3.42181183117E-02  3.64249973374E-02
  3.87742078317E-02  4.12749293858E-02  4.39369336234E-02  4.67706223840E-02
  4.97870683679E-02  5.29980584034E-02  5.64161395038E-02  6.00546678953E-02
  6.39278612067E-02  6.80508540250E-02  7.24397570343E-02  7.71117199683E-02
  8.20849986239E-02  8.73790261954E-02  9.30144892107E-02  9.90134083638E-02
  1.05399224562E-01  1.12196890520E-01  1.19432968267E-01  1.27135732932E-01
  1.35335283237E-01  1.44063659101E-01  1.53354966845E-01  1.63245512454E-01
  1.73773943450E-01  1.84981399907E-01  1.96911675204E-01  2.09611387151E-01
  2.23130160148E-01  2.37520819095E-01  2.52839595805E-01  2.69146348729E-01
  2.86504796860E-01  3.04982768711E-01  3.24652467358E-01  3.45590752577E-01
  3.67879441171E-01  3.91605626677E-01  4.16862019679E-01  4.43747310081E-01
  4.72366552741E-01  5.02831577971E-01  5.35261428519E-01  5.69782824731E-01
  6.06530659713E-01  6.45648526428E-01  6.87289278791E-01  7.31615628947E-01
  7.78800783071E-01  8.29029118180E-01  8.82496902585E-01  9.39413062813E-01
  1.00000000000E+00  1.06449445892E+00  1.13314845307E+00  1.20623024942E+00
  1.28402541669E+00  1.36683794117E+00  1.45499141462E+00  1.54883029863E+00
  1.64872127070E+00  1.75505465696E+00  1.86824595743E+00  1.98873746958E+00
  2.11700001661E+00  2.25353478721E+00  2.39887529397E+00  2.55358945806E+00
  2.71828182846E+00  2.89359594417E+00  3.08021684892E+00  3.27887376794E+00
  3.49034295746E+00  3.71545073794E+00  3.95507672292E+00  4.21015725614E+00
  4.48168907034E+00  4.77073318197E+00  5.07841903718E+00  5.40594892514E+00
  5.75460267601E+00  6.12574266188E+00  6.52081912033E+00  6.94137582120E+00
  7.38905609893E+00  7.86560927394E+00  8.37289748813E+00  8.91290298120E+00
  9.48773583636E+00  1.00996422255E+01  1.07510131861E+01  1.14443939643E+01
  1.21824939607E+01  1.29681973170E+01  1.38045741861E+01  1.46948927288E+01
  1.56426318842E+01  1.66514949636E+01  1.77254241215E+01  1.88686157593E+01
  2.00855369232E+01  2.13809427591E+01  2.27598950935E+01  2.42277822126E+01
  2.57903399172E+01  2.74536739355E+01  2.92242837812E+01  3.11090881510E+01
  3.31154519587E+01  3.52512151146E+01  3.75247231596E+01  3.99448598758E+01
  4.25210820001E+01  4.52634561763E+01  4.81826982911E+01  5.12902153466E+01
  5.45981500331E+01  5.81194281774E+01  6.18678092504E+01
  </PP_R>
  <PP_RAB>
  1.14472743055E-03  1.21855600679E-03  1.29714611711E-03  1.38080485407E-03
  1.46985911600E-03  1.56465688437E-03  1.66556858352E-03  1.77298852811E-03
  1.88733646389E-03  2.00905920793E-03  2.13863239448E-03  2.27656233359E-03
  2.42338798948E-03  2.57968308661E-03  2.74605835146E-03  2.92316389900E-03
  3.11169177299E-03  3.31237865021E-03  3.52600871899E-03  3.75341674346E-03
  3.99549132542E-03  4.25317837656E-03  4.52748481464E-03  4.81948249802E-03
  5.13031241399E-03  5.46118913721E-03  5.81340557567E-03  6.18833802274E-03
  6.58745153512E-03  7.01230565752E-03  7.46456051667E-03  7.94598330825E-03
  8.45845520229E-03  9.00397869384E-03  9.58468542781E-03  1.02028445284E-02
  1.08608714657E-02  1.15613374942E-02  1.23069797003E-02  1.31007116969E-02
  1.39456350093E-02  1.48450511935E-02  1.58024747378E-02  1.68216467956E-02
  1.79065498038E-02  1.90614230444E-02  2.02907792099E-02  2.15994220361E-02
  2.29924650732E-02  2.44753516673E-02  2.60538762299E-02  2.77342068801E-02
  2.95229095463E-02  3.14269736232E-02  3.34538392824E-02  3.56114265457E-02
  3.79081662320E-02  4.03530329017E-02  4.29555799244E-02  4.57259768092E-02
  4.86750489420E-02  5.18143198863E-02  5.51560564115E-02  5.87133164258E-02
  6.25000000000E-02  6.65309036824E-02  7.08217783167E-02  7.53893905888E-02
  8.02515885430E-02  8.54273713234E-02  9.09369634136E-02  9.68018936646E-02
  1.03045079419E-01  1.09690916060E-01  1.16765372340E-01  1.24296091849E-01
  1.32312501038E-01  1.40845924201E-01  1.49929705873E-01  1.59599341129E-01
  1.69892614279E-01  1.80849746511E-01  1.92513553057E-01  2.04929610496E-01
  2.18146434841E-01  2.32215671121E-01  2.47192295183E-01  2.63134828509E-01
  2.80105566896E-01  2.98170823873E-01  3.17401189824E-01  3.37871807821E-01
  3.59662667250E-01  3.82858916368E-01  4.07551195021E-01  4.33835988825E-01
  4.61816006183E-01  4.91600579622E-01  5.23306093008E-01  5.57056436325E-01
  5.92983489772E-01  6.31227639093E-01  6.71938324130E-01  7.15274622771E-01
  7.61405872544E-01  8.10512332311E-01  8.62785886629E-01  9.18430795549E-01
  9.77664492762E-01  1.04071843523E+00  1.10783900759E+00  1.17928848495E+00
  1.25534605770E+00  1.33630892245E+00  1.42249344335E+00  1.51423638829E+00
  1.61189624482E+00  1.71585462097E+00  1.82651773633E+00  1.94431800944E+00
  2.06971574742E+00  2.20320094466E+00  2.34529519748E+00  2.49655374224E+00
  2.65756762500E+00  2.82896601102E+00  3.01141864319E+00  3.20563845916E+00
  3.41238437707E+00  3.63246426109E+00  3.86673807815E+00
  </PP_RAB>
</PP_MESH>


<PP_LOCAL>
 -1.28520734427E+01 -1.28477738461E+01 -1.28429043374E+01 -1.28373897623E+01
 -1.28311451659E+01 -1.28240745458E+01 -1.28160694557E+01 -1.28070074434E+01
 -1.27967503082E+01 -1.27851421602E+01 -1.27720072639E+01 -1.27571476510E+01
 -1.27403404858E+01 -1.27213351692E+01 -1.26998501721E+01 -1.26755695914E+01
 -1.26481394325E+01 -1.26171636282E+01 -1.25821998225E+01 -1.25427549619E+01
 -1.24982807663E+01 -1.24481691770E+01 -1.23917479276E+01 -1.23282764256E+01
 -1.22569422046E+01 -1.21768582750E+01 -1.20870617994E+01 -1.19865146239E+01
 -1.18741063179E+01 -1.17486605129E+01 -1.16089454723E+01 -1.14536899624E+01
 -1.12816056190E+01 -1.10914170789E+01 -1.08819011471E+01 -1.06519361513E+01
 -1.04005623252E+01 -1.01270535093E+01 -9.83099956200E+00 -9.51239758030E+00
 -9.17174826485E+00 -8.81015154043E+00 -8.42939293729E+00 -8.03200948773E+00
 -7.62132142072E+00 -7.20141440844E+00 -6.77705742491E+00 -6.35354445007E+00
 -5.93645523944E+00 -5.53134165780E+00 -5.14336112886E+00 -4.77689553020E+00
 -4.43520848186E+00 -4.12020105875E+00 -3.83231994255E+00 -3.57064956816E+00
 -3.33318260449E+00 -3.11721972628E+00 -2.91981450742E+00 -2.73816754273E+00
 -2.56989350774E+00 -2.41313003425E+00 -2.26650901749E+00 -2.12904646842E+00
 -2.00001310323E+00 -1.87882857167E+00 -1.76499416977E+00 -1.65805827847E+00
 -1.55760156978E+00 -1.46323125812E+00 -1.37457855759E+00 -1.29129705286E+00
 -1.21306131943E+00 -1.13956564946E+00 -1.07052285704E+00 -1.00566315594E+00
 -9.44733105482E-01 -8.87494620162E-01 -8.33724039357E-01 -7.83211253354E-01
 -7.35758882343E-01 -6.91181505154E-01 -6.49304934717E-01 -6.09965537422E-01
 -5.73009593720E-01 -5.38292697458E-01 -5.05679191609E-01 -4.75041638191E-01
 -4.46260320297E-01 -4.19222774302E-01 -3.93823350408E-01 -3.69962799815E-01
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 -2.70670566473E-01 -2.54271465864E-01 -2.38865936533E-01 -2.24393781041E-01
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 -1.27855722413E-01 -1.20109335791E-01 -1.12832279008E-01 -1.05996116807E-01
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 -7.75484156634E-02 -7.28499946747E-02 -6.84362366233E-02 -6.42898946538E-02
 -6.03947668446E-02 -5.67356328994E-02 -5.32981946727E-02 -5.00690202999E-02
 -4.70354917120E-02 -4.41857553301E-02 -4.15086757474E-02 -3.89937922172E-02
 -3.66312777775E-02 -3.44119008517E-02 -3.23269891763E-02
</PP_LOCAL>


<PP_NONLOCAL>
  <PP_DIJ>
    0                  Number of nonzero Dij
  </PP_DIJ>
</PP_NONLOCAL>


<PP_PSWFC>
1S    0  1.00          Wavefunction
  2.88417980000E-02  3.06992250000E-02  3.26758880000E-02  3.47793630000E-02
  3.70176890000E-02  3.93993980000E-02  4.19335360000E-02  4.46296930000E-02
  4.74980260000E-02  5.05492900000E-02  5.37948600000E-02  5.72467610000E-02
  6.09176880000E-02  6.48210330000E-02  6.89709010000E-02  7.33821290000E-02
  7.80702990000E-02  8.30517390000E-02  8.83435240000E-02  9.39634680000E-02
  9.99300930000E-02  1.06262600000E-01  1.12980800000E-01  1.20105060000E-01
  1.27656180000E-01  1.35655270000E-01  1.44123610000E-01  1.53082380000E-01
  1.62552520000E-01  1.72554300000E-01  1.83107100000E-01  1.94228900000E-01
  2.05935850000E-01  2.18241720000E-01  2.31157310000E-01  2.44689750000E-01
  2.58841850000E-01  2.73611310000E-01  2.88989960000E-01  3.04963070000E-01
  3.21508570000E-01  3.38596550000E-01  3.56188710000E-01  3.74238100000E-01
  3.92689030000E-01  4.11477200000E-01  4.30530040000E-01  4.49767230000E-01
  4.69101320000E-01  4.88438290000E-01  5.07678040000E-01  5.26714510000E-01
  5.45435510000E-01  5.63722120000E-01  5.81447800000E-01  5.98477370000E-01
  6.14666190000E-01  6.29859740000E-01  6.43894030000E-01  6.56596810000E-01
  6.67789700000E-01  6.77290980000E-01  6.84919040000E-01  6.90496050000E-01
  6.93851860000E-01  6.94828030000E-01  6.93282060000E-01  6.89091610000E-01
  6.82158800000E-01  6.72414560000E-01  6.59822730000E-01  6.44383970000E-01
  6.26139280000E-01  6.05172840000E-01  5.81614290000E-01  5.55639920000E-01
  5.27472870000E-01  4.97381950000E-01  4.65679080000E-01  4.32715040000E-01
  3.98873460000E-01  3.64563110000E-01  3.30208380000E-01  2.96238340000E-01
  2.63074440000E-01  2.31117590000E-01  2.00735080000E-01  1.72248160000E-01
  1.45921080000E-01  1.21952430000E-01  1.00469460000E-01  8.15259110000E-02
  6.51037310000E-02  5.11184740000E-02  3.94280920000E-02  2.98443810000E-02
  2.21461340000E-02  1.60929310000E-02  1.14384770000E-02  7.94251530000E-03
  5.38057890000E-03  3.55111180000E-03  2.27982720000E-03  1.42143930000E-03
  8.59150620000E-04  5.02420710000E-04  2.83624610000E-04  1.54298730000E-04
  8.07158740000E-05  4.05091800000E-05  1.94783590000E-05  9.00917540000E-06
  4.14767900000E-06  1.81282520000E-06  7.49686700000E-07  2.92297650000E-07
  1.07038760000E-07  3.66664760000E-08  1.16987270000E-08  3.46064980000E-09
  9.44509430000E-10  2.36607150000E-10  5.41028540000E-11  1.12260320000E-11
  2.10050760000E-12  3.52060130000E-13  5.24831520000E-14  6.90637980000E-15
  7.95818150000E-16  7.96141140000E-17  6.85203010000E-18
</PP_PSWFC>


<PP_RHOATOM>
  8.31849311873E-04  9.42442415601E-04  1.06771365659E-03  1.20960409069E-03
  1.37030929890E-03  1.55231256276E-03  1.75842144146E-03  1.99180949727E-03
  2.25606247390E-03  2.55523071950E-03  2.89388696242E-03  3.27719164499E-03
  3.71096471127E-03  4.20176631919E-03  4.75698518475E-03  5.38493685657E-03
  6.09497158595E-03  6.89759135092E-03  7.80457823274E-03  8.82913331859E-03
  9.98602348699E-03  1.12917401588E-02  1.27646611686E-02  1.44252254376E-02
  1.62961002922E-02  1.84023522788E-02  2.07716149594E-02  2.34342150665E-02
  2.64233217584E-02  2.97749864485E-02  3.35282100704E-02  3.77248655952E-02
  4.24095743152E-02  4.76294483486E-02  5.34337019664E-02  5.98730737551E-02
  6.69991033114E-02  7.48631489599E-02  8.35151969808E-02  9.30024740638E-02
  1.03367760583E-01  1.14647623672E-01  1.26870397131E-01  1.40054155492E-01
  1.54204674282E-01  1.69313486120E-01  1.85356115342E-01  2.02290561182E-01
  2.20056048426E-01  2.38571963138E-01  2.57736992298E-01  2.77428175045E-01
  2.97499895569E-01  3.17782628577E-01  3.38081544125E-01  3.58175162402E-01
  3.77814525129E-01  3.96723292073E-01  4.14599521870E-01  4.31119370902E-01
  4.45943083426E-01  4.58723071589E-01  4.69114091355E-01  4.76784795066E-01
  4.81430403625E-01  4.82785991274E-01  4.80640014718E-01  4.74847246972E-01
  4.65340628417E-01  4.52141340500E-01  4.35366035025E-01  4.15230700793E-01
  3.92050397959E-01  3.66234166274E-01  3.38275182332E-01  3.08735720698E-01
  2.78227628586E-01  2.47388804186E-01  2.16857005550E-01  1.87242305842E-01
  1.59100037092E-01  1.32906261173E-01  1.09037574222E-01  8.77571540860E-02
  6.92081609813E-02  5.34153404074E-02  4.02945723426E-02  2.96694286234E-02
  2.12929615884E-02  1.48723951829E-02  1.00941123927E-02  6.64647416438E-03
  4.23849579012E-03  2.61309838409E-03  1.55457443876E-03  8.90687077273E-04
  4.90451251146E-04  2.58982428171E-04  1.30838756080E-04  6.30835492907E-05
  2.89506292991E-05  1.26103950161E-05  5.19761206186E-06  2.02048968358E-06
  7.38139787846E-07  2.52426569837E-07  8.04429193977E-08  2.38080980796E-08
  6.51505231558E-09  1.64099366427E-09  3.79406469333E-10  8.11652413880E-11
  1.72032410870E-11  3.28633520576E-12  5.62030148157E-13  8.54379161955E-14
  1.14572961423E-14  1.34443046226E-15  1.36860213421E-16  1.19760970382E-17
  8.92098063359E-19  5.59829434311E-20  2.92711881095E-21  1.26023794465E-22
  4.41213217766E-24  1.23946335136E-25  2.75448124386E-27  4.76980819418E-29
  6.33326527869E-31  6.33840714800E-33  4.69503164913E-35
</PP_RHOATOM>
quantum-espresso-data 4.3.2-1 / usr / share / espresso / pseudo / H.pz-vbc.UPF
