qmcpack/tests/solids/LiH_solid_1x1x1_pp/H.xml

<?xml version="1.0" encoding="UTF-8"?>
<pseudo version="0.5">
  <header symbol="H" atomic-number="1" zval="1" relativistic="no" 
   polarized="no" creator="ppconvert" flavor="Troullier-Martins" 
   core-corrections="no" xc-functional-type="GGA" 
   xc-functional-parametrization="Perdew-Burke-Ernzerhof"/>
  <grid type="linear" units="bohr" ri="0" rf="1.00000000000000e+01" 
   npts="10001"/>
  <semilocal units="hartree" format="r*V" npots-down="1" npots-up="0" 
   l-local="0">
    <vps principal-n="-1" l="s" spin="-1" cutoff="0.000101308" occupation="0">
      <radfunc>
        <grid type="linear" units="bohr" ri="0" rf="10" npts="10001"/>
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         -9.99999989953809e-01 -9.99999989957451e-01
        </data>
      </radfunc>
    </vps>
  </semilocal>
  <pseudowave-functions units="electrons/bohr^(-3/2)" 
   format="u_n,l (r) = 1/r R_n,l (r)" n-pseudowave-functions-down="1" 
   n-pseudowave-functions-up="0">
    <pswf principal-n="-1" l="s" spin="-1">
      <radfunc>
        <grid type="linear" units="bohr" ri="0" rf="10" npts="10001"/>
        <data>
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          5.33107603189956e-03  5.32746157932112e-03  5.32384956348983e-03
          5.32023998275635e-03  5.31663283547134e-03  5.31302811998549e-03
          5.30942583464945e-03  5.30582597781389e-03  5.30222854782950e-03
          5.29863354304693e-03  5.29504096181684e-03  5.29145080248992e-03
          5.28786306341684e-03  5.28427774294826e-03  5.28069483943484e-03
          5.27711435122727e-03  5.27353627667620e-03  5.26996061413231e-03
          5.26638736194627e-03  5.26281651846875e-03  5.25924808205040e-03
          5.25568205104191e-03  5.25211842379395e-03  5.24855719865718e-03
          5.24499837398227e-03  5.24144194811990e-03  5.23788791942072e-03
          5.23433628623541e-03  5.23078704691465e-03  5.22724019980909e-03
          5.22369574326940e-03  5.22015367564626e-03  5.21661399529034e-03
          5.21307670055230e-03  5.20954178978282e-03  5.20600926133256e-03
          5.20247911355218e-03  5.19895134479238e-03  5.19542595340380e-03
          5.19190293773712e-03  5.18838229614301e-03  5.18486402697368e-03
          5.18134812863599e-03  5.17783459960515e-03  5.17432343836066e-03
          5.17081464338201e-03  5.16730821314868e-03  5.16380414614019e-03
          5.16030244083602e-03  5.15680309571566e-03  5.15330610925862e-03
          5.14981147994439e-03  5.14631920625245e-03  5.14282928666232e-03
          5.13934171965349e-03  5.13585650370543e-03  5.13237363729767e-03
          5.12889311890968e-03  5.12541494702096e-03  5.12193912011102e-03
          5.11846563665933e-03  5.11499449514541e-03  5.11152569404874e-03
          5.10805923184881e-03  5.10459510702513e-03  5.10113331805719e-03
          5.09767386342448e-03  5.09421674160651e-03  5.09076195108275e-03
          5.08730949033271e-03  5.08385935783589e-03  5.08041155207177e-03
          5.07696607151986e-03  5.07352291465965e-03  5.07008207997063e-03
          5.06664356593230e-03  5.06320737102416e-03  5.05977349372569e-03
          5.05634193251639e-03  5.05291268587577e-03  5.04948575228331e-03
          5.04606113021851e-03  5.04263881816086e-03  5.03921881458987e-03
          5.03580111798501e-03  5.03238572682579e-03  5.02897263959171e-03
          5.02556185476226e-03  5.02215337081693e-03  5.01874718623523e-03
          5.01534329949663e-03  5.01194170908065e-03  5.00854241346677e-03
          5.00514541113449e-03  5.00175070056330e-03  4.99835828023270e-03
          4.99496814862219e-03  4.99158030421125e-03  4.98819474547940e-03
          4.98481147090611e-03  4.98143047897088e-03  4.97805176815322e-03
          4.97467533693261e-03  4.97130118378854e-03  4.96792930720053e-03
          4.96455970564806e-03  4.96119237761062e-03  4.95782732156770e-03
          4.95446453599881e-03  4.95110401938345e-03  4.94774577020109e-03
          4.94438978693125e-03  4.94103606805342e-03  4.93768461204707e-03
          4.93433541739173e-03  4.93098848256688e-03  4.92764380605201e-03
          4.92430138632663e-03  4.92096122187022e-03  4.91762331116227e-03
          4.91428765268230e-03  4.91095424490978e-03  4.90762308632422e-03
          4.90429417540511e-03  4.90096751063194e-03  4.89764309048422e-03
          4.89432091344142e-03  4.89100097798306e-03  4.88768328258863e-03
          4.88436782573762e-03  4.88105460590952e-03  4.87774362158383e-03
          4.87443487124005e-03  4.87112835335767e-03  4.86782406641618e-03
          4.86452200889508e-03  4.86122217927387e-03  4.85792457603205e-03
          4.85462919764910e-03  4.85133604260451e-03  4.84804510937779e-03
          4.84475639644844e-03  4.84146990229593e-03  4.83818562539979e-03
          4.83490356423948e-03  4.83162371729452e-03  4.82834608304439e-03
          4.82507065996860e-03  4.82179744654662e-03  4.81852644125798e-03
          4.81525764258215e-03  4.81199104899862e-03  4.80872665898691e-03
          4.80546447102650e-03  4.80220448359688e-03  4.79894669517755e-03
          4.79569110424801e-03  4.79243770928775e-03  4.78918650877627e-03
          4.78593750119306e-03  4.78269068501762e-03  4.77944605872943e-03
          4.77620362080800e-03  4.77296336973283e-03  4.76972530398340e-03
          4.76648942203921e-03  4.76325572238337e-03  4.76002420356148e-03
          4.75679486417194e-03  4.75356770281479e-03  4.75034271809010e-03
          4.74711990859792e-03  4.74389927293830e-03  4.74068080971131e-03
          4.73746451751699e-03  4.73425039495542e-03  4.73103844062663e-03
          4.72782865313068e-03  4.72462103106765e-03  4.72141557303757e-03
          4.71821227764050e-03  4.71501114347650e-03  4.71181216914563e-03
          4.70861535324793e-03  4.70542069438348e-03  4.70222819115232e-03
          4.69903784215451e-03  4.69584964599011e-03  4.69266360125916e-03
          4.68947970656174e-03  4.68629796049788e-03  4.68311836166766e-03
          4.67994090867112e-03  4.67676560010831e-03  4.67359243457931e-03
          4.67042141068416e-03  4.66725252702291e-03  4.66408578219564e-03
          4.66092117480238e-03  4.65775870344319e-03  4.65459836671814e-03
          4.65144016322728e-03  4.64828409157067e-03  4.64513015034834e-03
          4.64197833816038e-03  4.63882865360683e-03  4.63568109528774e-03
          4.63253566180318e-03  4.62939235175320e-03  4.62625116373784e-03
          4.62311209635719e-03  4.61997514821128e-03  4.61684031790017e-03
          4.61370760402392e-03  4.61057700518259e-03  4.60744851997622e-03
          4.60432214700488e-03  4.60119788486863e-03  4.59807573216751e-03
          4.59495568750158e-03  4.59183774947091e-03  4.58872191667554e-03
          4.58560818771553e-03  4.58249656119094e-03  4.57938703570183e-03
          4.57627960984824e-03  4.57317428223023e-03  4.57007105144787e-03
          4.56696991610121e-03  4.56387087479030e-03  4.56077392611520e-03
          4.55767906867596e-03  4.55458630107264e-03  4.55149562190530e-03
          4.54840702977399e-03  4.54532052327877e-03  4.54223610101970e-03
          4.53915376159682e-03  4.53607350361020e-03  4.53299532565989e-03
          4.52991922634595e-03  4.52684520426843e-03  4.52377325802740e-03
          4.52070338622290e-03  4.51763558745499e-03  4.51456986032372e-03
          4.51150620342917e-03  4.50844461537137e-03  4.50538509475038e-03
          4.50232764016626e-03  4.49927225021908e-03  4.49621892350887e-03
          4.49316765863570e-03  4.49011845419963e-03  4.48707130880070e-03
          4.48402622103899e-03  4.48098318951454e-03  4.47794221282739e-03
          4.47490328957764e-03  4.47186641836530e-03  4.46883159779045e-03
          4.46579882645315e-03  4.46276810295344e-03  4.45973942589139e-03
          4.45671279386704e-03  4.45368820548046e-03  4.45066565933170e-03
          4.44764515402082e-03  4.44462668814787e-03  4.44161026031291e-03
          4.43859586911599e-03  4.43558351315718e-03  4.43257319103652e-03
          4.42956490135407e-03  4.42655864270989e-03  4.42355441370404e-03
          4.42055221293656e-03  4.41755203900753e-03  4.41455389051698e-03
          4.41155776606498e-03  4.40856366425159e-03  4.40557158367685e-03
          4.40258152294083e-03  4.39959348064358e-03  4.39660745538516e-03
          4.39362344576562e-03  4.39064145038502e-03  4.38766146784342e-03
          4.38468349674086e-03  4.38170753567741e-03  4.37873358325313e-03
          4.37576163806806e-03  4.37279169872228e-03  4.36982376383949e-03
          4.36685783211782e-03  4.36389390226999e-03  4.36093197300871e-03
          4.35797204304672e-03  4.35501411109672e-03  4.35205817587144e-03
          4.34910423608361e-03  4.34615229044593e-03  4.34320233767113e-03
          4.34025437647194e-03  4.33730840556108e-03  4.33436442365125e-03
          4.33142242945519e-03  4.32848242168562e-03  4.32554439905524e-03
          4.32260836027680e-03  4.31967430406300e-03  4.31674222912658e-03
          4.31381213418023e-03  4.31088401793670e-03  4.30795787910870e-03
          4.30503371640894e-03  4.30211152855016e-03  4.29919131424508e-03
          4.29627307220639e-03  4.29335680114685e-03  4.29044249977916e-03
          4.28753016681604e-03  4.28461980097022e-03  4.28171140095441e-03
          4.27880496548134e-03  4.27590049326372e-03  4.27299798301429e-03
          4.27009743344575e-03  4.26719884327082e-03  4.26430221120224e-03
          4.26140753595272e-03  4.25851481623498e-03  4.25562405076174e-03
          4.25273523824572e-03  4.24984837739964e-03  4.24696346693623e-03
          4.24408050556820e-03  4.24119949200828e-03  4.23832042496918e-03
          4.23544330316363e-03  4.23256812530433e-03  4.22969489010404e-03
          4.22682359627544e-03  4.22395424253128e-03  4.22108682758426e-03
          4.21822135014712e-03  4.21535780893256e-03  4.21249620265331e-03
          4.20963653002210e-03  4.20677878975164e-03  4.20392298055465e-03
          4.20106910114386e-03  4.19821715023198e-03  4.19536712653173e-03
          4.19251902875584e-03  4.18967285561703e-03  4.18682860582801e-03
          4.18398627810151e-03  4.18114587115025e-03  4.17830738368694e-03
          4.17547081442432e-03  4.17263616207509e-03  4.16980342535199e-03
          4.16697260296772e-03  4.16414369363503e-03  4.16131669606661e-03
          4.15849160897519e-03  4.15566843107350e-03  4.15284716107426e-03
          4.15002779769017e-03  4.14721033963398e-03  4.14439478561839e-03
          4.14158113435613e-03  4.13876938455991e-03  4.13595953494247e-03
          4.13315158421651e-03  4.13034553109476e-03  4.12754137428994e-03
          4.12473911251478e-03  4.12193874448198e-03  4.11914026890428e-03
          4.11634368449439e-03  4.11354898996503e-03  4.11075618402893e-03
          4.10796526539881e-03  4.10517623278737e-03  4.10238908490736e-03
          4.09960382047148e-03  4.09682043819246e-03  4.09403893678301e-03
          4.09125931495587e-03  4.08848157142375e-03  4.08570570489936e-03
          4.08293171409544e-03  4.08015959772470e-03  4.07738935449985e-03
          4.07462098313363e-03  4.07185448233876e-03  4.06908985082795e-03
          4.06632708731392e-03  4.06356619050940e-03  4.06080715912710e-03
          4.05804999187976e-03  4.05529468748007e-03  4.05254124464078e-03
          4.04978966207459e-03  4.04703993849424e-03  4.04429207261243e-03
          4.04154606314189e-03  4.03880190879535e-03  4.03605960828552e-03
          4.03331916032511e-03  4.03058056362686e-03  4.02784381690349e-03
          4.02510891886771e-03  4.02237586823224e-03  4.01964466370981e-03
          4.01691530401314e-03  4.01418778785494e-03  4.01146211394794e-03
          4.00873828100486e-03  4.00601628775304e-03  4.00329613298955e-03
          4.00057781553226e-03  3.99786133419901e-03  3.99514668780766e-03
          3.99243387517608e-03  3.98972289512210e-03  3.98701374646360e-03
          3.98430642801842e-03  3.98160093860441e-03  3.97889727703945e-03
          3.97619544214138e-03  3.97349543272805e-03  3.97079724761733e-03
          3.96810088562707e-03  3.96540634557512e-03  3.96271362627934e-03
          3.96002272655758e-03  3.95733364522771e-03  3.95464638110758e-03
          3.95196093301504e-03  3.94927729976795e-03  3.94659548018415e-03
          3.94391547308153e-03  3.94123727727791e-03  3.93856089159117e-03
          3.93588631483916e-03  3.93321354583973e-03  3.93054258341073e-03
          3.92787342637003e-03  3.92520607353548e-03  3.92254052372494e-03
          3.91987677575626e-03  3.91721482844729e-03  3.91455468061590e-03
          3.91189633107993e-03  3.90923977865725e-03  3.90658502216571e-03
          3.90393206042316e-03  3.90128089224746e-03  3.89863151645648e-03
          3.89598393186804e-03  3.89333813730004e-03  3.89069413157030e-03
          3.88805191349669e-03  3.88541148189707e-03  3.88277283558930e-03
          3.88013597339121e-03  3.87750089412068e-03  3.87486759659555e-03
          3.87223607963370e-03  3.86960634205295e-03  3.86697838267119e-03
          3.86435220030625e-03  3.86172779377600e-03  3.85910516189829e-03
          3.85648430349098e-03  3.85386521737192e-03  3.85124790235897e-03
          3.84863235726999e-03  3.84601858092282e-03  3.84340657213534e-03
          3.84079632972538e-03  3.83818785251082e-03  3.83558113930949e-03
          3.83297618893926e-03  3.83037300021799e-03  3.82777157196353e-03
          3.82517190299373e-03  3.82257399212646e-03  3.81997783817956e-03
          3.81738343997089e-03  3.81479079631832e-03  3.81219990603968e-03
          3.80961076795285e-03  3.80702338087567e-03  3.80443774362601e-03
          3.80185385502171e-03  3.79927171388063e-03
        </data>
      </radfunc>
    </pswf>
  </pseudowave-functions>
</pseudo>