mirror of https://github.com/abinit/abinit.git
1017 lines
78 KiB
Plaintext
1017 lines
78 KiB
Plaintext
#Conducti output file:
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#Contains all results produced by conducti utility
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#
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# npts,omin,omax,width = 1000 0.00000 5.00000 0.07312 Ha
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# rprimd(bohr) = 7.38796 0.00000 0.00000
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# 0.00000 7.38796 0.00000
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# 0.00000 0.00000 7.38796
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# natom = 4
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# nkpt,mband,nsppol = 1 20 1
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# ecut = 10.00000 Ha
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# fermie = 0.23742 Ha 6.46057 eV
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# Temp = 0.00367 Ha 1160.44026 Kelvin
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# sumrule = 1.21951 12.00000
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# Emax-Efermi = 0.25925 Ha 7.05444 eV
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#
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# omega(ua) cond(ua) thermal cond(ua) thermopower(ua)
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0.00000 6.104280385858E-01 2.718327335146E-10 9.308774577626E+00
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0.00501 6.088956042635E-01 2.714123746713E-10 9.308774560072E+00
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0.01001 6.043146467593E-01 2.701838119554E-10 9.308774507493E+00
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0.01502 5.967339352259E-01 2.682468455261E-10 9.308774420117E+00
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0.02002 5.862350462979E-01 2.657757511250E-10 9.308774298255E+00
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0.02503 5.729326631946E-01 2.630315921667E-10 9.308774142199E+00
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0.03003 5.569747257219E-01 2.603801554793E-10 9.308773952065E+00
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0.03504 5.385422030556E-01 2.583163275297E-10 9.308773727564E+00
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0.04004 5.178482487789E-01 2.574957103010E-10 9.308773467691E+00
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0.04505 4.951365161817E-01 2.587746305216E-10 9.308773170279E+00
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0.05005 4.706784599006E-01 2.632596029194E-10 9.308772831376E+00
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0.05506 4.447695228661E-01 2.723673931792E-10 9.308772444362E+00
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0.06006 4.177241977129E-01 2.878966203889E-10 9.308771998691E+00
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0.06507 3.898700499271E-01 3.121115362144E-10 9.308771478069E+00
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0.07007 3.615408858931E-01 3.478380133839E-10 9.308770857831E+00
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0.07508 3.330693328334E-01 3.985709752150E-10 9.308770101135E+00
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0.08008 3.047791610059E-01 4.685913505094E-10 9.308769153420E+00
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0.08509 2.769777153143E-01 5.630891667654E-10 9.308767934344E+00
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0.09009 2.499488304031E-01 6.882876895384E-10 9.308766326032E+00
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0.09510 2.239465801687E-01 8.515614931953E-10 9.308764155934E+00
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0.10010 1.991901621586E-01 1.061539217612E-09 9.308761171820E+00
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0.10511 1.758601448340E-01 1.328179661332E-09 9.308757005283E+00
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0.11011 1.540962182173E-01 1.662807891947E-09 9.308751118454E+00
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0.11512 1.339964941218E-01 2.078096617122E-09 9.308742726191E+00
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0.12012 1.156183091605E-01 2.587977256596E-09 9.308730682411E+00
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0.12513 9.898039951111E-02 3.207465479183E-09 9.308713313976E+00
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0.13013 8.406624708394E-02 3.952387480911E-09 9.308688177852E+00
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0.13514 7.082834651744E-02 4.838996407432E-09 9.308651705943E+00
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0.14014 5.919311347592E-02 5.883473072407E-09 9.308598685382E+00
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0.14515 4.906614714222E-02 7.101311557994E-09 9.308521497665E+00
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0.15015 4.033757183381E-02 8.506598228540E-09 9.308409004034E+00
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0.15516 3.288721112651E-02 1.011120180710E-08 9.308244911600E+00
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0.16016 2.658938857147E-02 1.192390186357E-08 9.308005376568E+00
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0.16517 2.131719740525E-02 1.394949263674E-08 9.307655485580E+00
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0.17017 1.694613298127E-02 1.618790761002E-08 9.307144085648E+00
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0.17518 1.335703183272E-02 1.863341670072E-08 9.306396180619E+00
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0.18018 1.043830690160E-02 2.127395126441E-08 9.305301737716E+00
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0.18519 8.087507053364E-03 2.409061141860E-08 9.303699192060E+00
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0.19019 6.212259046755E-03 2.705740468223E-08 9.301351111422E+00
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0.19520 4.730671095539E-03 3.014125410923E-08 9.297908255875E+00
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0.20020 3.571289308712E-03 3.330229779643E-08 9.292856441575E+00
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0.20521 2.672702530543E-03 3.649448005433E-08 9.285437905405E+00
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0.21021 1.982888753806E-03 3.966640816389E-08 9.274534845542E+00
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0.21522 1.458388907598E-03 4.276241828680E-08 9.258496876606E+00
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0.22022 1.063383029657E-03 4.572376071757E-08 9.234885445380E+00
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0.22523 7.687311261172E-04 4.848977937897E-08 9.200095699632E+00
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0.23023 5.510276994389E-04 5.099892473923E-08 9.148798599286E+00
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0.23524 3.917060237334E-04 5.318940576126E-08 9.073122114955E+00
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0.24024 2.762165157050E-04 5.499926086957E-08 8.961460429668E+00
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0.24525 1.932934621618E-04 5.636562396109E-08 8.796768669080E+00
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0.25025 1.343161504116E-04 5.722301063799E-08 8.554183329691E+00
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0.25526 9.276413606824E-05 5.750061939074E-08 8.197845703085E+00
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0.26026 6.376185674798E-05 5.711906334804E-08 7.676988158022E+00
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0.26527 4.370484566034E-05 5.598784020145E-08 6.921848562079E+00
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0.27027 2.995814979398E-05 5.400648091908E-08 5.841086256011E+00
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0.27528 2.061693109557E-05 5.107472888650E-08 4.324341357666E+00
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0.28028 1.431935498585E-05 4.711923252762E-08 2.256086302031E+00
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0.28529 1.010250740146E-05 4.214241643383E-08 -4.522294729409E-01
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0.29029 7.293027275623E-06 3.628686739034E-08 -3.810787905866E+00
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0.29530 5.425236707023E-06 2.988311611038E-08 -7.697803928196E+00
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0.30030 4.180678149462E-06 2.342808059738E-08 -1.184287602454E+01
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0.30531 3.344045866881E-06 1.746582985393E-08 -1.588289950055E+01
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0.31031 2.771477554334E-06 1.242006517705E-08 -1.947634887941E+01
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0.31532 2.368025502051E-06 8.482398380926E-09 -2.240709018478E+01
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0.32032 2.071846809111E-06 5.616306262584E-09 -2.461740497096E+01
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0.32533 1.843242865025E-06 3.643678578824E-09 -2.617174855511E+01
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0.33033 1.657150985571E-06 2.341973761275E-09 -2.719484203255E+01
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0.33534 1.498060944952E-06 1.507835092030E-09 -2.782126656224E+01
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0.34034 1.356612692876E-06 9.827210727796E-10 -2.816823429997E+01
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0.34535 1.227344834865E-06 6.544025818351E-10 -2.832677047357E+01
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0.35035 1.107221059094E-06 4.483032426281E-10 -2.836284076376E+01
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0.35536 9.946761953473E-07 3.169664534597E-10 -2.832218679813E+01
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0.36036 8.890054365509E-07 2.311004376221E-10 -2.823560604461E+01
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0.36537 7.899778361451E-07 1.730117650616E-10 -2.812340381502E+01
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0.37037 6.975950788097E-07 1.321658042369E-10 -2.799874500362E+01
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0.37538 6.119437168348E-07 1.023348367869E-10 -2.787002830274E+01
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0.38038 5.331073112535E-07 7.983026448739E-11 -2.774250911452E+01
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0.38539 4.611169570617E-07 6.243642469635E-11 -2.761938532396E+01
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0.39039 3.959264788493E-07 4.878225205223E-11 -2.750251448558E+01
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0.39540 3.374035544443E-07 3.797873259929E-11 -2.739288424531E+01
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0.40040 2.853311337056E-07 2.941394349349E-11 -2.729092001630E+01
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0.40541 2.394154352805E-07 2.263943912926E-11 -2.719668624806E+01
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0.41041 1.992979757280E-07 1.730834242260E-11 -2.711001840306E+01
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0.41542 1.645698092255E-07 1.314192394957E-11 -2.703060980823E+01
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0.42042 1.347866218762E-07 9.911382725771E-12 -2.695806899334E+01
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0.42543 1.094836491323E-07 7.427432411337E-12 -2.689195752974E+01
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0.43043 8.818963571387E-08 5.533719437444E-12 -2.683181471901E+01
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0.43544 7.043927021901E-08 4.102040810149E-12 -2.677717303549E+01
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0.44044 5.578371696462E-08 3.028395869870E-12 -2.672756649099E+01
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0.44545 4.379903946181E-08 2.229466197797E-12 -2.668253266954E+01
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0.45045 3.409246154340E-08 1.639391630754E-12 -2.664160770766E+01
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0.45546 2.630653980010E-08 1.206828156044E-12 -2.660431153170E+01
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0.46046 2.012142133794E-08 8.923108233515E-13 -2.657011755794E+01
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0.46547 1.525543227225E-08 6.659444473925E-13 -2.653839572806E+01
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0.47047 1.146428524351E-08 5.054300227130E-13 -2.650830829431E+01
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0.47548 8.539210977056E-09 3.944172662586E-13 -2.647862081124E+01
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0.48048 6.304313461126E-09 3.211588217228E-13 -2.644736033875E+01
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0.48549 4.613425595559E-09 2.774309741451E-13 -2.641119838736E+01
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0.49049 3.346707430777E-09 2.576786712019E-13 -2.636433961461E+01
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0.49550 2.407187453254E-09 2.583372019521E-13 -2.629652946202E+01
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0.50050 1.717403268919E-09 2.772754711939E-13 -2.618951277404E+01
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0.50551 1.216255125083E-09 3.132905541655E-13 -2.601083957092E+01
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0.51051 8.561466600758E-10 3.655510795601E-13 -2.570335531806E+01
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0.51552 6.004537793360E-10 4.328279678553E-13 -2.516839745113E+01
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0.52052 4.213354617906E-10 5.122721029337E-13 -2.424209860080E+01
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0.52553 2.978797244833E-10 5.974931556596E-13 -2.267136812188E+01
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0.53053 2.145635095161E-10 6.761118987401E-13 -2.011666928069E+01
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0.53554 1.599961494903E-10 7.284985463533E-13 -1.624330743133E+01
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0.54054 1.259113732650E-10 7.319516440854E-13 -1.096214806256E+01
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0.54555 1.063715366699E-10 6.735125005630E-13 -4.720090041315E+00
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0.55055 9.714895101689E-11 5.632645390356E-13 1.522162427218E+00
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0.55556 9.525199296092E-11 4.309780198826E-13 6.802969267276E+00
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0.56056 9.856741320928E-11 3.068163151762E-13 1.067379525752E+01
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0.56557 1.055943741258E-10 2.071566887544E-13 1.322302046075E+01
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0.57057 1.152498412291E-10 1.347833031663E-13 1.478556744248E+01
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0.57558 1.267287662441E-10 8.545225056458E-14 1.570154023806E+01
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0.58058 1.394058739475E-10 5.316312889460E-14 1.622450366024E+01
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0.58559 1.527687305763E-10 3.259197931143E-14 1.651859470075E+01
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0.59059 1.663741190009E-10 1.973635805594E-14 1.668257155932E+01
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0.59560 1.798216080468E-10 1.182136921522E-14 1.677356545702E+01
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0.60060 1.927396385002E-10 7.008764312148E-15 1.682392618522E+01
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0.60561 2.047805272782E-10 4.115003739801E-15 1.685175755378E+01
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0.61061 2.156215878493E-10 2.393067086235E-15 1.686712577550E+01
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0.61562 2.249701495654E-10 1.378640584773E-15 1.687560810611E+01
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0.62062 2.325706935086E-10 7.868458635369E-16 1.688028863036E+01
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0.62563 2.382126596534E-10 4.449262312985E-16 1.688287093503E+01
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0.63063 2.417377598766E-10 2.492620187543E-16 1.688429548706E+01
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0.63564 2.430458820999E-10 1.383566950671E-16 1.688508129968E+01
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0.64064 2.420989101088E-10 7.608949333210E-17 1.688551474527E+01
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0.64565 2.389220191329E-10 4.146041604578E-17 1.688575381576E+01
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0.65065 2.336022390412E-10 2.238368831912E-17 1.688588566909E+01
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0.65566 2.262842991918E-10 1.197360560052E-17 1.688595838429E+01
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0.66066 2.171639723198E-10 6.346337220448E-18 1.688599848209E+01
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0.66567 2.064793088215E-10 3.333050168978E-18 1.688602059082E+01
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0.67067 1.945002876318E-10 1.734632341918E-18 1.688603277888E+01
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0.67568 1.815174981815E-10 8.946754545675E-19 1.688603949619E+01
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0.68068 1.678305057817E-10 4.573999929567E-19 1.688604319690E+01
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0.68569 1.537365403906E-10 2.318681452784E-19 1.688604523437E+01
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0.69069 1.395200903700E-10 1.166144500491E-19 1.688604635489E+01
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0.69570 1.254438864243E-10 0.000000000000E+00 1.688604696994E+01
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0.70070 1.117416370207E-10 0.000000000000E+00 1.688604730638E+01
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0.70571 9.861273735082E-11 0.000000000000E+00 1.688604748928E+01
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0.71071 8.621903173225E-11 0.000000000000E+00 1.688604758757E+01
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0.71572 7.468357575156E-11 0.000000000000E+00 1.688604763925E+01
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0.72072 6.409122902941E-11 0.000000000000E+00 1.688604766526E+01
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0.72573 5.449081918936E-11 0.000000000000E+00 1.688604767712E+01
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0.73073 4.589855643271E-11 0.000000000000E+00 1.688604768120E+01
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0.73574 3.830234703992E-11 0.000000000000E+00 1.688604768100E+01
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0.74074 3.166665141562E-11 0.000000000000E+00 1.688604767843E+01
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0.74575 2.593755407440E-11 0.000000000000E+00 1.688604767457E+01
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0.75075 2.104775383649E-11 0.000000000000E+00 1.688604766999E+01
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0.75576 1.692123630788E-11 0.000000000000E+00 1.688604766503E+01
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0.76076 1.347745122168E-11 0.000000000000E+00 1.688604765985E+01
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0.76577 1.063487869482E-11 0.000000000000E+00 1.688604765454E+01
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0.77077 8.313926125127E-12 0.000000000000E+00 1.688604764918E+01
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0.77578 6.439147751077E-12 0.000000000000E+00 1.688604764378E+01
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0.78078 4.940819549545E-12 0.000000000000E+00 1.688604763836E+01
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0.78579 3.755932139704E-12 0.000000000000E+00 1.688604763293E+01
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0.79079 2.828683758110E-12 0.000000000000E+00 1.688604762749E+01
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0.79580 2.110565086519E-12 0.000000000000E+00 1.688604762205E+01
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0.80080 1.560129243444E-12 0.000000000000E+00 1.688604761661E+01
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0.80581 1.142535402906E-12 0.000000000000E+00 1.688604761117E+01
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0.81081 8.289451703089E-13 0.000000000000E+00 1.688604760572E+01
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0.81582 5.958388126898E-13 0.000000000000E+00 1.688604760028E+01
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0.82082 4.243052600594E-13 0.000000000000E+00 1.688604759484E+01
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0.82583 2.993467071518E-13 0.000000000000E+00 1.688604758939E+01
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0.83083 2.092265543824E-13 0.000000000000E+00 1.688604758395E+01
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0.83584 1.448789125057E-13 0.000000000000E+00 1.688604757851E+01
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0.84084 9.938925157113E-14 0.000000000000E+00 1.688604757306E+01
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0.84585 6.754906573454E-14 0.000000000000E+00 1.688604756762E+01
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0.85085 4.548254681440E-14 0.000000000000E+00 1.688604756218E+01
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0.85586 3.033999657004E-14 0.000000000000E+00 1.688604755673E+01
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0.86086 2.005078720437E-14 0.000000000000E+00 1.688604755129E+01
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0.86587 1.312781067062E-14 0.000000000000E+00 1.688604754585E+01
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0.87087 8.515261479344E-15 0.000000000000E+00 1.688604754041E+01
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0.87588 5.472028023806E-15 0.000000000000E+00 1.688604753496E+01
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0.88088 3.483718978469E-15 0.000000000000E+00 1.688604752952E+01
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0.88589 2.197263960954E-15 0.000000000000E+00 1.688604752408E+01
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0.89089 1.372984104155E-15 0.000000000000E+00 1.688604751864E+01
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0.89590 8.499488468057E-16 0.000000000000E+00 1.688604751319E+01
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0.90090 5.212714259353E-16 0.000000000000E+00 1.688604750775E+01
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0.90591 3.167223782053E-16 0.000000000000E+00 1.688604750231E+01
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0.91091 1.906501419148E-16 0.000000000000E+00 1.688604749687E+01
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0.91592 1.136943605123E-16 0.000000000000E+00 1.688604749143E+01
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0.92092 6.717133472823E-17 0.000000000000E+00 1.688604748598E+01
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0.92593 3.931625621459E-17 0.000000000000E+00 1.688604748054E+01
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0.93093 2.279834496026E-17 0.000000000000E+00 1.688604747510E+01
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