--------------------------- 786 ------------------------------------------- Ref. "Photoionization cross sections and oscillator strengths for oxygen ions: O I - O VIII", Sultana N. Nahar, Phys. Rev. A 58, 3766 (1998) -------------------------------------------------------------------------- O I: Oscillator strengths for dipole allowed transitions File contents ------------- Line 1 : Z, Nelc -> nuclear charge, number of core electrons Sets of transtions between two symmetris are given next. Each set of transitions has the following information. Line : (SLP)i - (SLP)j -> (2S+1), total L and pi (0 for even, 1 for odd) Line : ni nj ntrns -> number of states for symmetries i, j and the total number of transitions Lines - ntrns number of lines: i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) Note: i) A negative f-value means first transitional state is lower, and a a positive f-value means the second transitional state is lower (see their energies) ii) There are transitions among positive states (above the ionization threshold) ----------------------------------------------------------------------- 8 7 5 0 1 5 1 0 :isi,li,ipi,isj,lj,ipj 9 8 72 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 7.56590E+03 -3.33037E-01 -2.12593E-01 -9.818E-01 1.223E+02 3.813E+07 1 2 3.87192E+03 -3.33037E-01 -9.76845E-02 -2.730E-03 1.740E-01 4.049E+05 1 3 3.29462E+03 -3.33037E-01 -5.64445E-02 -4.166E-05 2.259E-03 8.533E+03 1 4 3.07613E+03 -3.33037E-01 -3.67988E-02 -3.766E-06 1.907E-04 8.848E+02 1 5 2.96687E+03 -3.33037E-01 -2.58898E-02 -1.488E-05 7.268E-04 3.759E+03 1 6 2.90367E+03 -3.33037E-01 -1.92042E-02 -1.709E-05 8.168E-04 4.507E+03 1 7 2.86359E+03 -3.33037E-01 -1.48112E-02 -1.550E-05 7.305E-04 4.202E+03 1 8 2.83648E+03 -3.33037E-01 -1.17703E-02 -1.305E-05 6.093E-04 3.606E+03 2 1 1.10465E+04 -1.30099E-01 -2.12593E-01 1.647E-01 8.986E+01 2.701E+07 2 2 2.81129E+04 -1.30099E-01 -9.76845E-02 -1.451E+00 6.714E+02 4.081E+06 2 3 1.23722E+04 -1.30099E-01 -5.64445E-02 -1.482E-02 3.019E+00 2.153E+05 2 4 9.76704E+03 -1.30099E-01 -3.67988E-02 -1.750E-03 2.814E-01 4.079E+04 2 5 8.74459E+03 -1.30099E-01 -2.58898E-02 -4.224E-04 6.080E-02 1.228E+04 2 6 8.21740E+03 -1.30099E-01 -1.92042E-02 -1.464E-04 1.981E-02 4.821E+03 2 7 7.90428E+03 -1.30099E-01 -1.48112E-02 -6.348E-05 8.259E-03 2.259E+03 2 8 7.70115E+03 -1.30099E-01 -1.17703E-02 -3.204E-05 4.062E-03 1.201E+03 3 1 6.39117E+03 -7.00108E-02 -2.12593E-01 1.829E-02 5.774E+00 8.961E+06 3 2 3.29290E+04 -7.00108E-02 -9.76845E-02 2.959E-01 4.811E+02 5.460E+06 3 3 6.71714E+04 -7.00108E-02 -5.64445E-02 -1.893E+00 2.093E+03 9.328E+05 3 4 2.74379E+04 -7.00108E-02 -3.67988E-02 -2.860E-02 1.292E+01 8.446E+04 3 5 2.06538E+04 -7.00108E-02 -2.58898E-02 -4.450E-03 1.513E+00 2.319E+04 3 6 1.79360E+04 -7.00108E-02 -1.92042E-02 -1.342E-03 3.963E-01 9.276E+03 3 7 1.65086E+04 -7.00108E-02 -1.48112E-02 -5.598E-04 1.521E-01 4.567E+03 3 8 1.56466E+04 -7.00108E-02 -1.17703E-02 -2.832E-04 7.294E-02 2.572E+03 4 1 5.39649E+03 -4.37301E-02 -2.12593E-01 6.146E-03 1.638E+00 4.223E+06 4 2 1.68896E+04 -4.37301E-02 -9.76845E-02 2.837E-02 2.366E+01 1.990E+06 4 3 7.16720E+04 -4.37301E-02 -5.64445E-02 4.272E-01 1.512E+03 1.664E+06 4 4 1.31471E+05 -4.37301E-02 -3.67988E-02 -2.322E+00 5.025E+03 2.987E+05 4 5 5.10791E+04 -4.37301E-02 -2.58898E-02 -4.222E-02 3.550E+01 3.598E+04 4 6 3.71553E+04 -4.37301E-02 -1.92042E-02 -7.386E-03 4.517E+00 1.189E+04 4 7 3.15111E+04 -4.37301E-02 -1.48112E-02 -2.424E-03 1.257E+00 5.427E+03 4 8 2.85129E+04 -4.37301E-02 -1.17703E-02 -1.077E-03 5.056E-01 2.946E+03 5 1 4.98791E+03 -2.98980E-02 -2.12593E-01 2.904E-03 7.153E-01 2.336E+06 5 2 1.34432E+04 -2.98980E-02 -9.76845E-02 9.373E-03 6.222E+00 1.038E+06 5 3 3.43272E+04 -2.98980E-02 -5.64445E-02 3.879E-02 6.576E+01 6.587E+05 5 4 1.32052E+05 -2.98980E-02 -3.67988E-02 5.577E-01 3.637E+03 6.399E+05 5 5 2.27351E+05 -2.98980E-02 -2.58898E-02 -2.746E+00 1.028E+04 1.181E+05 5 6 8.52145E+04 -2.98980E-02 -1.92042E-02 -5.568E-02 7.810E+01 1.705E+04 5 7 6.04016E+04 -2.98980E-02 -1.48112E-02 -1.043E-02 1.037E+01 6.355E+03 5 8 5.02693E+04 -2.98980E-02 -1.17703E-02 -3.588E-03 2.969E+00 3.157E+03 6 1 4.77440E+03 -2.17277E-02 -2.12593E-01 1.629E-03 3.840E-01 1.430E+06 6 2 1.19972E+04 -2.17277E-02 -9.76845E-02 4.457E-03 2.641E+00 6.197E+05 6 3 2.62486E+04 -2.17277E-02 -5.64445E-02 1.269E-02 1.645E+01 3.686E+05 6 4 6.04645E+04 -2.17277E-02 -3.67988E-02 4.905E-02 1.464E+02 2.684E+05 6 5 2.18944E+05 -2.17277E-02 -2.58898E-02 6.873E-01 7.431E+03 2.869E+05 6 6 3.61112E+05 -2.17277E-02 -1.92042E-02 -3.168E+00 1.883E+04 5.401E+04 6 7 1.31753E+05 -2.17277E-02 -1.48112E-02 -6.900E-02 1.496E+02 8.837E+03 6 8 9.15166E+04 -2.17277E-02 -1.17703E-02 -1.351E-02 2.035E+01 3.586E+03 7 1 4.64715E+03 -1.65016E-02 -2.12593E-01 1.013E-03 2.325E-01 9.389E+05 7 2 1.12249E+04 -1.65016E-02 -9.76845E-02 2.529E-03 1.402E+00 4.017E+05 7 3 2.28142E+04 -1.65016E-02 -5.64445E-02 6.045E-03 6.810E+00 2.324E+05 7 4 4.48962E+04 -1.65016E-02 -3.67988E-02 1.593E-02 3.531E+01 1.581E+05 7 5 9.70651E+04 -1.65016E-02 -2.58898E-02 5.913E-02 2.834E+02 1.256E+05 7 6 3.37182E+05 -1.65016E-02 -1.92042E-02 8.167E-01 1.360E+04 1.437E+05 7 7 5.39084E+05 -1.65016E-02 -1.48112E-02 -3.586E+00 3.182E+04 2.743E+04 7 8 1.92604E+05 -1.65016E-02 -1.17703E-02 -8.218E-02 2.605E+02 4.925E+03 8 1 4.56465E+03 -1.29575E-02 -2.12593E-01 6.767E-04 1.525E-01 6.498E+05 8 2 1.07553E+04 -1.29575E-02 -9.76845E-02 1.595E-03 8.470E-01 2.758E+05 8 3 2.09549E+04 -1.29575E-02 -5.64445E-02 3.449E-03 3.569E+00 1.572E+05 8 4 3.82222E+04 -1.29575E-02 -3.67988E-02 7.580E-03 1.431E+01 1.038E+05 8 5 7.04644E+04 -1.29575E-02 -2.58898E-02 1.907E-02 6.635E+01 7.684E+04 8 6 1.45880E+05 -1.29575E-02 -1.92042E-02 6.907E-02 4.975E+02 6.494E+04 8 7 4.91594E+05 -1.29575E-02 -1.48112E-02 9.460E-01 2.296E+04 7.833E+04 8 8 7.67576E+05 -1.29575E-02 -1.17703E-02 -4.006E+00 5.061E+04 1.512E+04 9 1 4.50790E+03 -1.04439E-02 -2.12593E-01 4.761E-04 1.060E-01 4.688E+05 9 2 1.04454E+04 -1.04439E-02 -9.76845E-02 1.079E-03 5.564E-01 1.978E+05 9 3 1.98099E+04 -1.04439E-02 -5.64445E-02 2.189E-03 2.142E+00 1.116E+05 9 4 3.45768E+04 -1.04439E-02 -3.67988E-02 4.335E-03 7.401E+00 7.255E+04 9 5 5.89973E+04 -1.04439E-02 -2.58898E-02 9.060E-03 2.640E+01 5.208E+04 9 6 1.04022E+05 -1.04439E-02 -1.92042E-02 2.215E-02 1.138E+02 4.095E+04 9 7 2.08657E+05 -1.04439E-02 -1.48112E-02 7.893E-02 8.133E+02 3.628E+04 9 8 6.87023E+05 -1.04439E-02 -1.17703E-02 1.075E+00 3.646E+04 4.556E+04 5 1 0 5 1 1 :isi,li,ipi,isj,lj,ipj 8 8 64 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 8.46386E+02 -2.12593E-01 8.64063E-01 -9.087E-02 3.798E+00 8.460E+08 1 2 7.56090E+02 -2.12593E-01 9.92643E-01 -8.467E-05 3.161E-03 9.878E+05 1 3 7.30133E+02 -2.12593E-01 1.03549E+00 -8.867E-06 3.197E-04 1.109E+05 1 4 7.18544E+02 -2.12593E-01 1.05562E+00 -2.332E-06 8.275E-05 3.013E+04 1 5 7.12299E+02 -2.12593E-01 1.06674E+00 -9.140E-07 3.215E-05 1.202E+04 1 6 7.08544E+02 -2.12593E-01 1.07352E+00 -4.485E-07 1.569E-05 5.958E+03 1 7 7.06095E+02 -2.12593E-01 1.07798E+00 -2.535E-07 8.838E-06 3.391E+03 1 8 7.04419E+02 -2.12593E-01 1.08105E+00 -1.577E-07 5.487E-06 2.120E+03 2 1 9.47512E+02 -9.76845E-02 8.64063E-01 -4.037E-04 1.889E-02 2.999E+06 2 2 8.35774E+02 -9.76845E-02 9.92643E-01 -8.573E-02 3.538E+00 8.186E+08 2 3 8.04172E+02 -9.76845E-02 1.03549E+00 -8.453E-05 3.357E-03 8.719E+05 2 4 7.90136E+02 -9.76845E-02 1.05562E+00 -1.442E-05 5.626E-04 1.541E+05 2 5 7.82590E+02 -9.76845E-02 1.06674E+00 -5.031E-06 1.944E-04 5.479E+04 2 6 7.78060E+02 -9.76845E-02 1.07352E+00 -2.377E-06 9.134E-05 2.619E+04 2 7 7.75108E+02 -9.76845E-02 1.07798E+00 -1.329E-06 5.088E-05 1.476E+04 2 8 7.73089E+02 -9.76845E-02 1.08105E+00 -8.260E-07 3.153E-05 9.218E+03 3 1 9.89962E+02 -5.64445E-02 8.64063E-01 -1.125E-04 5.498E-03 7.654E+05 3 2 8.68628E+02 -5.64445E-02 9.92643E-01 -1.593E-04 6.832E-03 1.408E+06 3 3 8.34544E+02 -5.64445E-02 1.03549E+00 -8.473E-02 3.492E+00 8.115E+08 3 4 8.19437E+02 -5.64445E-02 1.05562E+00 -8.907E-05 3.604E-03 8.847E+05 3 5 8.11324E+02 -5.64445E-02 1.06674E+00 -1.801E-05 7.217E-04 1.825E+05 3 6 8.06456E+02 -5.64445E-02 1.07352E+00 -6.953E-06 2.769E-04 7.131E+04 3 7 8.03286E+02 -5.64445E-02 1.07798E+00 -3.513E-06 1.394E-04 3.632E+04 3 8 8.01118E+02 -5.64445E-02 1.08105E+00 -2.058E-06 8.142E-05 2.139E+04 4 1 1.01155E+03 -3.67988E-02 8.64063E-01 -5.051E-05 2.523E-03 3.293E+05 4 2 8.85205E+02 -3.67988E-02 9.92643E-01 -4.406E-05 1.926E-03 3.750E+05 4 3 8.49834E+02 -3.67988E-02 1.03549E+00 -1.147E-04 4.815E-03 1.060E+06 4 4 8.34174E+02 -3.67988E-02 1.05562E+00 -8.440E-02 3.477E+00 8.090E+08 4 5 8.25768E+02 -3.67988E-02 1.06674E+00 -9.127E-05 3.722E-03 8.927E+05 4 6 8.20726E+02 -3.67988E-02 1.07352E+00 -1.983E-05 8.038E-04 1.964E+05 4 7 8.17442E+02 -3.67988E-02 1.07798E+00 -8.020E-06 3.237E-04 8.005E+04 4 8 8.15197E+02 -3.67988E-02 1.08105E+00 -4.181E-06 1.683E-04 4.197E+04 5 1 1.02395E+03 -2.58898E-02 8.64063E-01 -2.764E-05 1.398E-03 1.758E+05 5 2 8.94686E+02 -2.58898E-02 9.92643E-01 -2.000E-05 8.836E-04 1.666E+05 5 3 8.58568E+02 -2.58898E-02 1.03549E+00 -3.122E-05 1.324E-03 2.825E+05 5 4 8.42588E+02 -2.58898E-02 1.05562E+00 -9.973E-05 4.150E-03 9.370E+05 5 5 8.34013E+02 -2.58898E-02 1.06674E+00 -8.420E-02 3.468E+00 8.074E+08 5 6 8.28869E+02 -2.58898E-02 1.07352E+00 -9.227E-05 3.777E-03 8.958E+05 5 7 8.25520E+02 -2.58898E-02 1.07798E+00 -2.079E-05 8.474E-04 2.034E+05 5 8 8.23231E+02 -2.58898E-02 1.08105E+00 -8.620E-06 3.504E-04 8.484E+04 6 1 1.03170E+03 -1.92042E-02 8.64063E-01 -1.693E-05 8.624E-04 1.061E+05 6 2 9.00598E+02 -1.92042E-02 9.92643E-01 -1.113E-05 4.948E-04 9.150E+04 6 3 8.64011E+02 -1.92042E-02 1.03549E+00 -1.421E-05 6.061E-04 1.269E+05 6 4 8.47829E+02 -1.92042E-02 1.05562E+00 -2.665E-05 1.116E-03 2.473E+05 6 5 8.39147E+02 -1.92042E-02 1.06674E+00 -9.280E-05 3.846E-03 8.790E+05 6 6 8.33941E+02 -1.92042E-02 1.07352E+00 -8.413E-02 3.465E+00 8.069E+08 6 7 8.30551E+02 -1.92042E-02 1.07798E+00 -9.267E-05 3.801E-03 8.960E+05 6 8 8.28233E+02 -1.92042E-02 1.08105E+00 -2.133E-05 8.723E-04 2.074E+05 7 1 1.03686E+03 -1.48112E-02 8.64063E-01 -1.117E-05 5.718E-04 6.928E+04 7 2 9.04525E+02 -1.48112E-02 9.92643E-01 -6.933E-06 3.097E-04 5.652E+04 7 3 8.67625E+02 -1.48112E-02 1.03549E+00 -7.973E-06 3.416E-04 7.065E+04 7 4 8.51308E+02 -1.48112E-02 1.05562E+00 -1.208E-05 5.078E-04 1.112E+05 7 5 8.42556E+02 -1.48112E-02 1.06674E+00 -2.449E-05 1.019E-03 2.301E+05 7 6 8.37307E+02 -1.48112E-02 1.07352E+00 -8.900E-05 3.680E-03 8.467E+05 7 7 8.33889E+02 -1.48112E-02 1.07798E+00 -8.407E-02 3.462E+00 8.063E+08 7 8 8.31553E+02 -1.48112E-02 1.08105E+00 -9.280E-05 3.811E-03 8.951E+05 8 1 1.04046E+03 -1.17703E-02 8.64063E-01 -7.773E-06 3.994E-04 4.789E+04 8 2 9.07263E+02 -1.17703E-02 9.92643E-01 -4.651E-06 2.084E-04 3.768E+04 8 3 8.70144E+02 -1.17703E-02 1.03549E+00 -5.024E-06 2.159E-04 4.426E+04 8 4 8.53734E+02 -1.17703E-02 1.05562E+00 -6.793E-06 2.864E-04 6.217E+04 8 5 8.44931E+02 -1.17703E-02 1.06674E+00 -1.107E-05 4.617E-04 1.034E+05 8 6 8.39653E+02 -1.17703E-02 1.07352E+00 -2.333E-05 9.672E-04 2.207E+05 8 7 8.36216E+02 -1.17703E-02 1.07798E+00 -8.673E-05 3.582E-03 8.273E+05 8 8 8.33867E+02 -1.17703E-02 1.08105E+00 -8.407E-02 3.462E+00 8.064E+08 5 1 0 5 2 1 :isi,li,ipi,isj,lj,ipj 8 8 64 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 9.20956E+03 -2.12593E-01 -1.13645E-01 -9.213E-01 4.190E+02 4.347E+07 1 2 6.12013E+03 -2.12593E-01 -6.36964E-02 -7.053E-02 2.132E+01 7.536E+06 1 3 5.29944E+03 -2.12593E-01 -4.06376E-02 -1.791E-02 4.686E+00 2.552E+06 1 4 4.94075E+03 -2.12593E-01 -2.81540E-02 -7.147E-03 1.744E+00 1.172E+06 1 5 4.74754E+03 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1.07728E+00 -2.558E-01 2.837E+03 2.490E+05 2 4 5.89817E+04 1.06511E+00 1.08056E+00 -8.980E-02 7.847E+02 1.409E+05 2 5 5.12233E+04 1.06511E+00 1.08290E+00 -4.256E-02 3.229E+02 8.851E+04 3 1 1.23982E+05 1.07248E+00 1.06513E+00 6.258E-03 1.405E+02 3.319E+03 3 2 4.55016E+07 1.07248E+00 1.07250E+00 -6.162E-03 4.154E+04 1.624E-02 3 3 1.89844E+05 1.07248E+00 1.07728E+00 -1.328E+00 3.734E+04 2.010E+05 3 4 1.12780E+05 1.07248E+00 1.08056E+00 -2.793E-01 4.667E+03 1.198E+05 3 5 8.74530E+04 1.07248E+00 1.08290E+00 -1.069E-01 1.385E+03 7.625E+04 4 1 7.50630E+04 1.07727E+00 1.06513E+00 8.975E-04 1.220E+01 1.298E+03 4 2 1.91040E+05 1.07727E+00 1.07250E+00 1.704E-02 5.893E+02 3.805E+03 4 3 9.10031E+07 1.07727E+00 1.07728E+00 -8.996E-03 1.213E+05 5.928E-03 4 4 2.76986E+05 1.07727E+00 1.08056E+00 -1.273E+00 5.224E+04 9.056E+04 4 5 1.61859E+05 1.07727E+00 1.08290E+00 -2.907E-01 6.970E+03 6.055E+04 5 1 5.90966E+04 1.08055E+00 1.06513E+00 2.776E-04 2.971E+00 6.481E+02 5 2 1.13201E+05 1.08055E+00 1.07250E+00 2.707E-03 5.549E+01 1.722E+03 5 3 2.78683E+05 1.08055E+00 1.07728E+00 3.122E-02 1.575E+03 3.277E+03 5 4 9.10031E+07 1.08055E+00 1.08056E+00 -1.160E-02 1.563E+05 7.641E-03 5 5 3.87758E+05 1.08055E+00 1.08290E+00 -1.244E+00 7.147E+04 4.516E+04 6 1 5.12811E+04 1.08290E+00 1.06513E+00 1.213E-04 1.126E+00 3.759E+02 6 2 8.76214E+04 1.08290E+00 1.07250E+00 8.827E-04 1.400E+01 9.373E+02 6 3 1.62147E+05 1.08290E+00 1.07728E+00 5.305E-03 1.558E+02 1.645E+03 6 4 3.89417E+05 1.08290E+00 1.08056E+00 4.802E-02 3.386E+03 2.581E+03 6 5 Infinity 1.08290E+00 1.08290E+00 NaN Infinity NaN 5 4 1 5 5 0 :isi,li,ipi,isj,lj,ipj 6 5 30 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 7.45425E+04 -4.00027E-02 -2.77779E-02 -1.676E+00 1.851E+04 1.646E+06 1 2 4.65065E+04 -4.00027E-02 -2.04083E-02 -2.019E-01 1.391E+03 5.093E+05 1 3 3.73813E+04 -4.00027E-02 -1.56251E-02 -5.996E-02 3.320E+02 2.341E+05 1 4 3.29490E+04 -4.00027E-02 -1.23458E-02 -2.596E-02 1.267E+02 1.305E+05 1 5 3.03729E+04 -4.00027E-02 -1.00001E-02 -1.376E-02 6.193E+01 8.142E+04 2 1 4.14253E+08 -2.77801E-02 -2.77779E-02 -3.551E-04 2.179E+04 1.129E-05 2 2 1.23615E+05 -2.77801E-02 -2.04083E-02 -1.491E+00 2.731E+04 5.326E+05 2 3 7.49706E+04 -2.77801E-02 -1.56251E-02 -2.658E-01 2.952E+03 2.580E+05 2 4 5.90417E+04 -2.77801E-02 -1.23458E-02 -9.309E-02 8.142E+02 1.457E+05 2 5 5.12524E+04 -2.77801E-02 -1.00001E-02 -4.404E-02 3.344E+02 9.150E+04 3 1 1.23677E+05 -2.04098E-02 -2.77779E-02 6.320E-03 1.415E+02 3.368E+03 3 2 6.07743E+08 -2.04098E-02 -2.04083E-02 -7.507E-04 6.759E+04 1.109E-05 3 3 1.90454E+05 -2.04098E-02 -1.56251E-02 -1.391E+00 3.924E+04 2.093E+05 3 4 1.13004E+05 -2.04098E-02 -1.23458E-02 -2.909E-01 4.870E+03 1.243E+05 3 5 8.75402E+04 -2.04098E-02 -1.00001E-02 -1.110E-01 1.440E+03 7.904E+04 4 1 7.49909E+04 -1.56262E-02 -2.77779E-02 9.047E-04 1.228E+01 1.311E+03 4 2 1.90558E+05 -1.56262E-02 -2.04083E-02 1.724E-02 5.950E+02 3.871E+03 4 3 8.29208E+08 -1.56262E-02 -1.56251E-02 -1.133E-03 1.392E+05 8.991E-06 4 4 2.77792E+05 -1.56262E-02 -1.23458E-02 -1.335E+00 5.495E+04 9.443E+04 4 5 1.61971E+05 -1.56262E-02 -1.00001E-02 -3.031E-01 7.273E+03 6.305E+04 5 1 5.90532E+04 -1.23466E-02 -2.77779E-02 2.793E-04 2.986E+00 6.528E+02 5 2 1.13037E+05 -1.23466E-02 -2.04083E-02 2.740E-03 5.608E+01 1.748E+03 5 3 2.77952E+05 -1.23466E-02 -1.56251E-02 3.165E-02 1.593E+03 3.340E+03 5 4 1.13908E+09 -1.23466E-02 -1.23458E-02 -1.496E-03 2.524E+05 6.291E-06 5 5 3.88352E+05 -1.23466E-02 -1.00001E-02 -1.306E+00 7.516E+04 4.727E+04 6 1 5.12604E+04 -1.00007E-02 -2.77779E-02 1.218E-04 1.130E+00 3.778E+02 6 2 8.75578E+04 -1.00007E-02 -2.04083E-02 8.925E-04 1.415E+01 9.491E+02 6 3 1.62020E+05 -1.00007E-02 -1.56251E-02 5.385E-03 1.580E+02 1.672E+03 6 4 3.88583E+05 -1.00007E-02 -1.23458E-02 4.876E-02 3.431E+03 2.633E+03 6 5 1.51936E+09 -1.00007E-02 -1.00001E-02 -1.841E-03 4.145E+05 4.353E-06 5 5 0 5 5 1 :isi,li,ipi,isj,lj,ipj 5 5 25 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 8.33800E+02 -2.77779E-02 1.06513E+00 -8.427E-02 1.272E+01 8.085E+08 1 2 8.28215E+02 -2.77779E-02 1.07250E+00 -3.338E-09 5.006E-07 3.246E+01 1 3 8.24633E+02 -2.77779E-02 1.07728E+00 -1.055E-09 1.575E-07 1.035E+01 1 4 8.22193E+02 -2.77779E-02 1.08056E+00 -5.278E-10 7.858E-08 5.208E+00 1 5 8.20460E+02 -2.77779E-02 1.08290E+00 -3.160E-10 4.694E-08 3.131E+00 2 1 8.39461E+02 -2.04083E-02 1.06513E+00 -3.729E-09 5.668E-07 3.530E+01 2 2 8.33800E+02 -2.04083E-02 1.07250E+00 -8.427E-02 1.272E+01 8.085E+08 2 3 8.30169E+02 -2.04083E-02 1.07728E+00 -8.365E-09 1.257E-06 8.096E+01 2 4 8.27696E+02 -2.04083E-02 1.08056E+00 -2.376E-09 3.561E-07 2.314E+01 2 5 8.25941E+02 -2.04083E-02 1.08290E+00 -1.133E-09 1.695E-07 1.108E+01 3 1 8.43176E+02 -1.56251E-02 1.06513E+00 -1.269E-09 1.937E-07 1.190E+01 3 2 8.37465E+02 -1.56251E-02 1.07250E+00 -8.991E-09 1.363E-06 8.550E+01 3 3 8.33803E+02 -1.56251E-02 1.07728E+00 -8.427E-02 1.272E+01 8.085E+08 3 4 8.31308E+02 -1.56251E-02 1.08056E+00 -1.331E-08 2.003E-06 1.285E+02 3 5 8.29537E+02 -1.56251E-02 1.08290E+00 -3.596E-09 5.402E-07 3.486E+01 4 1 8.45742E+02 -1.23458E-02 1.06513E+00 -6.678E-10 1.023E-07 6.227E+00 4 2 8.39997E+02 -1.23458E-02 1.07250E+00 -2.687E-09 4.087E-07 2.540E+01 4 3 8.36312E+02 -1.23458E-02 1.07728E+00 -1.398E-08 2.117E-06 1.333E+02 4 4 8.33802E+02 -1.23458E-02 1.08056E+00 -8.427E-02 1.272E+01 8.085E+08 4 5 8.32021E+02 -1.23458E-02 1.08290E+00 -1.759E-08 2.650E-06 1.695E+02 5 1 8.47588E+02 -1.00001E-02 1.06513E+00 -4.149E-10 6.368E-08 3.852E+00 5 2 8.41817E+02 -1.00001E-02 1.07250E+00 -1.331E-09 2.028E-07 1.252E+01 5 3 8.38116E+02 -1.00001E-02 1.07728E+00 -3.922E-09 5.952E-07 3.724E+01 5 4 8.35596E+02 -1.00001E-02 1.08056E+00 -1.820E-08 2.754E-06 1.739E+02 5 5 8.33806E+02 -1.00001E-02 1.08290E+00 -8.427E-02 1.272E+01 8.085E+08 5 5 0 5 6 1 :isi,li,ipi,isj,lj,ipj 5 4 20 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.23650E+05 -2.77779E-02 -2.04082E-02 -2.007E+00 4.494E+04 7.409E+05 1 2 7.49835E+04 -2.77779E-02 -1.56250E-02 -2.169E-01 2.945E+03 2.177E+05 1 3 5.90497E+04 -2.77779E-02 -1.23457E-02 -5.980E-02 6.394E+02 9.679E+04 1 4 5.12584E+04 -2.77779E-02 -1.00000E-02 -2.455E-02 2.278E+02 5.272E+04 2 1 9.05987E+09 -2.04083E-02 -2.04082E-02 -3.935E-05 6.454E+04 2.705E-09 2 2 1.90510E+05 -2.04083E-02 -1.56250E-02 -1.805E+00 6.228E+04 2.807E+05 2 3 1.13024E+05 -2.04083E-02 -1.23457E-02 -2.976E-01 6.091E+03 1.315E+05 2 4 8.75520E+04 -2.04083E-02 -1.00000E-02 -9.867E-02 1.564E+03 7.265E+04 3 1 1.90518E+05 -1.56251E-02 -2.04082E-02 5.485E-03 2.236E+02 1.191E+03 3 2 9.05987E+09 -1.56251E-02 -1.56250E-02 -9.864E-05 1.618E+05 6.782E-09 3 3 2.77876E+05 -1.56251E-02 -1.23457E-02 -1.685E+00 8.477E+04 1.232E+05 3 4 1.62000E+05 -1.56251E-02 -1.00000E-02 -3.327E-01 9.760E+03 7.155E+04 4 1 1.13027E+05 -1.23458E-02 -2.04082E-02 7.122E-04 1.722E+01 4.394E+02 4 2 2.77893E+05 -1.23458E-02 -1.56250E-02 1.515E-02 9.009E+02 1.546E+03 4 3 9.05987E+09 -1.23458E-02 -1.23457E-02 -1.661E-04 2.724E+05 1.142E-08 4 4 3.88467E+05 -1.23458E-02 -1.00000E-02 -1.611E+00 1.133E+05 6.025E+04 5 1 8.75536E+04 -1.00001E-02 -2.04082E-02 2.049E-04 3.839E+00 2.107E+02 5 2 1.62006E+05 -1.00001E-02 -1.56250E-02 2.218E-03 7.691E+01 6.663E+02 5 3 3.88501E+05 -1.00001E-02 -1.23457E-02 2.809E-02 2.335E+03 1.467E+03 5 4 9.05987E+09 -1.00001E-02 -1.00000E-02 -2.360E-04 3.871E+05 1.623E-08 5 5 1 5 6 0 :isi,li,ipi,isj,lj,ipj 5 4 20 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.23646E+05 1.06513E+00 1.07250E+00 -1.951E+00 4.368E+04 7.202E+05 1 2 7.50011E+04 1.06513E+00 1.07728E+00 -2.109E-01 2.864E+03 2.116E+05 1 3 5.90582E+04 1.06513E+00 1.08056E+00 -5.820E-02 6.224E+02 9.417E+04 1 4 5.12525E+04 1.06513E+00 1.08291E+00 -2.391E-02 2.219E+02 5.137E+04 2 1 Infinity 1.07250E+00 1.07250E+00 NaN Infinity NaN 2 2 1.90640E+05 1.07250E+00 1.07728E+00 -1.754E+00 6.056E+04 2.724E+05 2 3 1.13061E+05 1.07250E+00 1.08056E+00 -2.896E-01 5.929E+03 1.279E+05 2 4 8.75381E+04 1.07250E+00 1.08291E+00 -9.602E-02 1.522E+03 7.072E+04 3 1 1.90640E+05 1.07728E+00 1.07250E+00 5.363E-03 2.188E+02 1.163E+03 3 2 Infinity 1.07728E+00 1.07728E+00 NaN Infinity NaN 3 3 2.77832E+05 1.07728E+00 1.08056E+00 -1.637E+00 8.233E+04 1.197E+05 3 4 1.61862E+05 1.07728E+00 1.08291E+00 -3.236E-01 9.485E+03 6.972E+04 4 1 1.13061E+05 1.08056E+00 1.07250E+00 6.971E-04 1.686E+01 4.299E+02 4 2 2.77832E+05 1.08056E+00 1.07728E+00 1.482E-02 8.809E+02 1.513E+03 4 3 Infinity 1.08056E+00 1.08056E+00 NaN Infinity NaN 4 4 3.87778E+05 1.08056E+00 1.08291E+00 -1.564E+00 1.098E+05 5.871E+04 5 1 8.76214E+04 1.08290E+00 1.07250E+00 2.008E-04 3.764E+00 2.061E+02 5 2 1.62147E+05 1.08290E+00 1.07728E+00 2.171E-03 7.532E+01 6.508E+02 5 3 3.89417E+05 1.08290E+00 1.08056E+00 2.749E-02 2.291E+03 1.429E+03 5 4 9.20995E+07 1.08290E+00 1.08291E+00 -2.547E-03 4.248E+04 1.695E-03 5 6 0 5 6 1 :isi,li,ipi,isj,lj,ipj 4 4 16 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 8.33800E+02 1.07250E+00 -2.04082E-02 8.428E-02 1.504E+01 8.085E+08 1 2 8.37465E+02 1.07250E+00 -1.56250E-02 1.007E-11 1.805E-09 9.580E-02 1 3 8.39997E+02 1.07250E+00 -1.23457E-02 3.851E-12 6.922E-10 3.640E-02 1 4 8.41817E+02 1.07250E+00 -1.00000E-02 2.206E-12 3.974E-10 2.076E-02 2 1 8.30169E+02 1.07728E+00 -2.04082E-02 9.478E-12 1.684E-09 9.173E-02 2 2 8.33803E+02 1.07728E+00 -1.56250E-02 8.428E-02 1.504E+01 8.085E+08 2 3 8.36312E+02 1.07728E+00 -1.23457E-02 3.371E-11 6.032E-09 3.214E-01 2 4 8.38116E+02 1.07728E+00 -1.00000E-02 1.094E-11 1.963E-09 1.039E-01 3 1 8.27696E+02 1.08056E+00 -2.04082E-02 3.471E-12 6.147E-10 3.379E-02 3 2 8.31308E+02 1.08056E+00 -1.56250E-02 3.231E-11 5.747E-09 3.118E-01 3 3 8.33802E+02 1.08056E+00 -1.23457E-02 8.428E-02 1.504E+01 8.085E+08 3 4 8.35596E+02 1.08056E+00 -1.00000E-02 6.546E-11 1.170E-08 6.253E-01 4 1 8.25933E+02 1.08291E+00 -2.04082E-02 1.928E-12 3.407E-10 1.885E-02 4 2 8.29529E+02 1.08291E+00 -1.56250E-02 1.016E-11 1.804E-09 9.851E-02 4 3 8.32013E+02 1.08291E+00 -1.23457E-02 6.345E-11 1.130E-08 6.113E-01 4 4 8.33799E+02 1.08291E+00 -1.00000E-02 8.428E-02 1.504E+01 8.085E+08 5 6 0 5 7 1 :isi,li,ipi,isj,lj,ipj 4 3 12 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.90640E+05 1.07250E+00 1.07728E+00 -2.292E+00 9.351E+04 3.646E+05 1 2 1.13061E+05 1.07250E+00 1.08056E+00 -2.242E-01 5.423E+03 1.014E+05 1 3 8.75381E+04 1.07250E+00 1.08291E+00 -5.757E-02 1.078E+03 4.343E+04 2 1 Infinity 1.07728E+00 1.07728E+00 NaN Infinity NaN 2 2 2.77832E+05 1.07728E+00 1.08056E+00 -2.080E+00 1.237E+05 1.558E+05 2 3 1.61862E+05 1.07728E+00 1.08291E+00 -3.186E-01 1.104E+04 7.030E+04 3 1 2.77832E+05 1.08056E+00 1.07728E+00 4.756E-03 3.263E+02 4.742E+02 3 2 Infinity 1.08056E+00 1.08056E+00 NaN Infinity NaN 3 3 3.87778E+05 1.08056E+00 1.08291E+00 -1.945E+00 1.614E+05 7.475E+04 4 1 1.61862E+05 1.08291E+00 1.07728E+00 5.644E-04 2.256E+01 1.658E+02 4 2 3.87778E+05 1.08291E+00 1.08056E+00 1.326E-02 1.269E+03 6.785E+02 4 3 Infinity 1.08291E+00 1.08291E+00 NaN Infinity NaN 5 6 1 5 7 0 :isi,li,ipi,isj,lj,ipj 4 3 12 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.90514E+05 -2.04082E-02 -1.56250E-02 -2.340E+00 9.540E+04 3.727E+05 1 2 1.13025E+05 -2.04082E-02 -1.23457E-02 -2.289E-01 5.537E+03 1.036E+05 1 3 8.75528E+04 -2.04082E-02 -1.00000E-02 -5.875E-02 1.101E+03 4.431E+04 2 1 Infinity -1.56250E-02 -1.56250E-02 NaN Infinity NaN 2 2 2.77885E+05 -1.56250E-02 -1.23457E-02 -2.123E+00 1.262E+05 1.589E+05 2 3 1.62003E+05 -1.56250E-02 -1.00000E-02 -3.254E-01 1.128E+04 7.167E+04 3 1 2.77885E+05 -1.23457E-02 -1.56250E-02 4.853E-03 3.330E+02 4.837E+02 3 2 Infinity -1.23457E-02 -1.23457E-02 NaN Infinity NaN 3 3 3.88484E+05 -1.23457E-02 -1.00000E-02 -1.986E+00 1.651E+05 7.607E+04 4 1 1.62003E+05 -1.00000E-02 -1.56250E-02 5.759E-04 2.303E+01 1.689E+02 4 2 3.88484E+05 -1.00000E-02 -1.23457E-02 1.353E-02 1.298E+03 6.901E+02 4 3 Infinity -1.00000E-02 -1.00000E-02 NaN Infinity NaN 5 7 0 5 7 1 :isi,li,ipi,isj,lj,ipj 3 3 9 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 8.33803E+02 -1.56250E-02 1.07728E+00 -8.428E-02 1.735E+01 8.086E+08 1 2 8.31308E+02 -1.56250E-02 1.08056E+00 -6.367E-15 1.307E-12 6.145E-05 1 3 8.29529E+02 -1.56250E-02 1.08291E+00 -2.611E-15 5.347E-13 2.530E-05 2 1 8.36312E+02 -1.23457E-02 1.07728E+00 -6.504E-15 1.343E-12 6.202E-05 2 2 8.33802E+02 -1.23457E-02 1.08056E+00 -8.428E-02 1.735E+01 8.086E+08 2 3 8.32013E+02 -1.23457E-02 1.08291E+00 -2.741E-14 5.632E-12 2.641E-04 3 1 8.38116E+02 -1.00000E-02 1.07728E+00 -2.729E-15 5.648E-13 2.592E-05 3 2 8.35596E+02 -1.00000E-02 1.08056E+00 -2.804E-14 5.785E-12 2.679E-04 3 3 8.33799E+02 -1.00000E-02 1.08291E+00 -8.428E-02 1.735E+01 8.086E+08 5 7 0 5 8 1 :isi,li,ipi,isj,lj,ipj 3 1 3 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 2.77885E+05 -1.56250E-02 -1.23457E-02 -2.672E+00 1.833E+05 2.036E+05 2 1 Infinity -1.23457E-02 -1.23457E-02 NaN Infinity NaN 3 1 3.88484E+05 -1.00000E-02 -1.23457E-02 4.351E-03 4.730E+02 2.179E+02 5 7 1 5 8 0 :isi,li,ipi,isj,lj,ipj 3 2 6 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 2.77832E+05 1.07728E+00 1.08056E+00 -2.631E+00 1.805E+05 2.006E+05 1 2 1.61862E+05 1.07728E+00 1.08291E+00 -2.349E-01 9.389E+03 5.277E+04 2 1 Infinity 1.08056E+00 1.08056E+00 NaN Infinity NaN 2 2 3.87778E+05 1.08056E+00 1.08291E+00 -2.407E+00 2.304E+05 9.419E+04 3 1 3.87778E+05 1.08291E+00 1.08056E+00 4.284E-03 4.648E+02 2.153E+02 3 2 Infinity 1.08291E+00 1.08291E+00 NaN Infinity NaN 5 8 0 5 8 1 :isi,li,ipi,isj,lj,ipj 2 1 2 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 8.33802E+02 1.08056E+00 -1.23457E-02 8.428E-02 1.967E+01 8.086E+08 2 1 8.32013E+02 1.08291E+00 -1.23457E-02 3.818E-19 8.888E-17 3.678E-09 5 8 0 5 9 1 :isi,li,ipi,isj,lj,ipj 2 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 5 8 1 5 9 0 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 5 9 0 5 9 1 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 5 9 0 5 10 1 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 3 0 0 3 1 1 :isi,li,ipi,isj,lj,ipj 8 9 72 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 7.89767E+03 1.68748E-01 5.33637E-02 1.084E-01 2.536E+01 3.477E+07 1 2 2.51724E+04 1.68748E-01 1.32547E-01 1.626E-05 1.212E-02 5.133E+02 1 3 1.68753E+05 1.68748E-01 1.63348E-01 1.411E-04 7.056E-01 9.915E+01 1 4 5.29437E+04 1.68748E-01 1.85960E-01 -8.577E-04 4.485E-01 6.803E+02 1 5 2.45764E+04 1.68748E-01 2.05827E-01 -1.106E-03 2.684E-01 4.070E+03 1 6 1.87654E+04 1.68748E-01 2.17309E-01 -1.257E-03 2.329E-01 7.934E+03 1 7 1.63850E+04 1.68748E-01 2.24364E-01 -1.422E-03 2.301E-01 1.178E+04 1 8 1.51275E+04 1.68748E-01 2.28987E-01 -1.620E-03 2.420E-01 1.574E+04 1 9 1.43670E+04 1.68748E-01 2.32176E-01 -1.861E-03 2.641E-01 2.005E+04 2 1 4.16645E+03 2.72079E-01 5.33637E-02 6.038E-04 7.454E-02 6.960E+05 2 2 6.53088E+03 2.72079E-01 1.32547E-01 1.203E-04 2.328E-02 5.645E+04 2 3 8.38093E+03 2.72079E-01 1.63348E-01 2.688E-03 6.674E-01 7.657E+05 2 4 1.05815E+04 2.72079E-01 1.85960E-01 1.339E-03 4.198E-01 2.393E+05 2 5 1.37546E+04 2.72079E-01 2.05827E-01 9.611E-04 3.917E-01 1.017E+05 2 6 1.66381E+04 2.72079E-01 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5.42347E+03 3.53983E-01 1.85960E-01 1.899E-05 3.051E-03 1.292E+04 7 5 6.15073E+03 3.53983E-01 2.05827E-01 6.798E-06 1.239E-03 3.595E+03 7 6 6.66745E+03 3.53983E-01 2.17309E-01 3.774E-06 7.456E-04 1.699E+03 7 7 7.03035E+03 3.53983E-01 2.24364E-01 2.392E-06 4.983E-04 9.685E+02 7 8 7.29037E+03 3.53983E-01 2.28987E-01 1.611E-06 3.480E-04 6.065E+02 7 9 7.48124E+03 3.53983E-01 2.32176E-01 1.124E-06 2.492E-04 4.020E+02 8 1 3.00099E+03 3.57019E-01 5.33637E-02 2.260E-07 2.010E-05 5.021E+02 8 2 4.05960E+03 3.57019E-01 1.32547E-01 2.918E-06 3.510E-04 3.543E+03 8 3 4.70523E+03 3.57019E-01 1.63348E-01 4.503E-05 6.278E-03 4.070E+04 8 4 5.32721E+03 3.57019E-01 1.85960E-01 1.297E-05 2.047E-03 9.143E+03 8 5 6.02722E+03 3.57019E-01 2.05827E-01 4.569E-06 8.159E-04 2.517E+03 8 6 6.52256E+03 3.57019E-01 2.17309E-01 2.501E-06 4.834E-04 1.176E+03 8 7 6.86945E+03 3.57019E-01 2.24364E-01 1.563E-06 3.182E-04 6.629E+02 8 8 7.11749E+03 3.57019E-01 2.28987E-01 1.037E-06 2.186E-04 4.095E+02 8 9 7.29930E+03 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-1.23458E-02 -2.04082E-02 7.123E-04 1.034E+01 4.395E+02 4 2 2.77893E+05 -1.23458E-02 -1.56250E-02 1.515E-02 5.405E+02 1.546E+03 4 3 9.05987E+09 -1.23458E-02 -1.23457E-02 -1.655E-04 1.629E+05 1.138E-08 4 4 3.88467E+05 -1.23458E-02 -1.00000E-02 -1.611E+00 6.800E+04 6.026E+04 5 1 8.75536E+04 -1.00001E-02 -2.04082E-02 2.049E-04 2.304E+00 2.107E+02 5 2 1.62006E+05 -1.00001E-02 -1.56250E-02 2.218E-03 4.613E+01 6.661E+02 5 3 3.88501E+05 -1.00001E-02 -1.23457E-02 2.810E-02 1.402E+03 1.468E+03 5 4 9.05987E+09 -1.00001E-02 -1.00000E-02 -2.352E-04 2.315E+05 1.617E-08 3 5 1 3 6 0 :isi,li,ipi,isj,lj,ipj 8 4 32 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 7.45413E+04 2.04386E-01 2.16611E-01 -1.512E+00 1.225E+04 1.536E+06 1 2 4.65051E+04 2.04386E-01 2.23981E-01 -1.822E-01 9.204E+02 4.754E+05 1 3 3.73807E+04 2.04386E-01 2.28764E-01 -1.212E-02 4.920E+01 4.893E+04 1 4 3.29489E+04 2.04386E-01 2.32043E-01 -7.088E-03 2.537E+01 3.685E+04 2 1 4.56374E+08 2.16609E-01 2.16611E-01 -3.218E-04 1.596E+04 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ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 3.84470E+03 2.16611E-01 -2.04082E-02 5.436E-22 2.683E-19 2.453E-13 1 2 3.92388E+03 2.16611E-01 -1.56250E-02 8.497E-22 4.281E-19 3.681E-13 1 3 3.98008E+03 2.16611E-01 -1.23457E-02 9.336E-22 4.771E-19 3.931E-13 1 4 4.02128E+03 2.16611E-01 -1.00000E-02 9.000E-22 4.647E-19 3.712E-13 2 1 3.72875E+03 2.23981E-01 -2.04082E-02 5.303E-22 2.539E-19 2.544E-13 2 2 3.80319E+03 2.23981E-01 -1.56250E-02 8.364E-22 4.084E-19 3.857E-13 2 3 3.85596E+03 2.23981E-01 -1.23457E-02 9.249E-22 4.579E-19 4.149E-13 2 4 3.89462E+03 2.23981E-01 -1.00000E-02 8.956E-22 4.479E-19 3.938E-13 3 1 3.65718E+03 2.28764E-01 -2.04082E-02 1.208E-22 5.671E-20 6.023E-14 3 2 3.72876E+03 2.28764E-01 -1.56250E-02 1.895E-22 9.070E-20 9.089E-14 3 3 3.77947E+03 2.28764E-01 -1.23457E-02 2.087E-22 1.013E-19 9.743E-14 3 4 3.81660E+03 2.28764E-01 -1.00000E-02 2.015E-22 9.875E-20 9.227E-14 4 1 3.60968E+03 2.32043E-01 -2.04082E-02 1.315E-22 6.094E-20 6.731E-14 4 2 3.67939E+03 2.32043E-01 -1.56250E-02 2.067E-22 9.765E-20 1.018E-13 4 3 3.72876E+03 2.32043E-01 -1.23457E-02 2.280E-22 1.092E-19 1.094E-13 4 4 3.76490E+03 2.32043E-01 -1.00000E-02 2.204E-22 1.065E-19 1.037E-13 3 6 0 3 7 1 :isi,li,ipi,isj,lj,ipj 4 4 16 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.23646E+05 2.16611E-01 2.23981E-01 -1.867E+00 2.964E+04 7.059E+05 1 2 7.49829E+04 2.16611E-01 2.28764E-01 -2.016E-01 1.941E+03 2.073E+05 1 3 5.90505E+04 2.16611E-01 2.32043E-01 -5.562E-02 4.217E+02 9.220E+04 1 4 5.12581E+04 2.16611E-01 2.34389E-01 -3.382E-06 2.226E-02 7.441E+00 2 1 Infinity 2.23981E-01 2.23981E-01 NaN Infinity NaN 2 2 1.90522E+05 2.23981E-01 2.28764E-01 -1.679E+00 4.106E+04 2.673E+05 2 3 1.13032E+05 2.23981E-01 2.32043E-01 -2.769E-01 4.019E+03 1.253E+05 2 4 8.75544E+04 2.23981E-01 2.34389E-01 -1.359E-05 1.527E-01 1.025E+01 3 1 1.90522E+05 2.28764E-01 2.23981E-01 5.284E-03 1.492E+02 1.120E+03 3 2 Infinity 2.28764E-01 2.28764E-01 NaN Infinity NaN 3 3 2.77910E+05 2.28764E-01 2.32043E-01 -3.482E-01 1.242E+04 2.606E+04 3 4 1.62003E+05 2.28764E-01 2.34389E-01 -1.814E-01 3.772E+03 3.994E+04 4 1 1.13032E+05 2.32043E-01 2.23981E-01 6.624E-04 1.109E+01 3.990E+02 4 2 2.77910E+05 2.32043E-01 2.28764E-01 1.016E-02 4.185E+02 1.013E+03 4 3 Infinity 2.32043E-01 2.32043E-01 NaN Infinity NaN 4 4 3.88433E+05 2.32043E-01 2.34389E-01 -1.665E+00 8.303E+04 6.378E+04 3 6 1 3 7 0 :isi,li,ipi,isj,lj,ipj 4 3 12 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.90514E+05 -2.04082E-02 -1.56250E-02 -2.340E+00 5.724E+04 3.727E+05 1 2 1.13025E+05 -2.04082E-02 -1.23457E-02 -2.289E-01 3.321E+03 1.036E+05 1 3 8.75528E+04 -2.04082E-02 -1.00000E-02 -5.877E-02 6.606E+02 4.432E+04 2 1 Infinity -1.56250E-02 -1.56250E-02 NaN Infinity NaN 2 2 2.77885E+05 -1.56250E-02 -1.23457E-02 -2.124E+00 7.577E+04 1.590E+05 2 3 1.62003E+05 -1.56250E-02 -1.00000E-02 -3.254E-01 6.768E+03 7.167E+04 3 1 2.77885E+05 -1.23457E-02 -1.56250E-02 4.853E-03 1.998E+02 4.837E+02 3 2 Infinity -1.23457E-02 -1.23457E-02 NaN Infinity NaN 3 3 3.88484E+05 -1.23457E-02 -1.00000E-02 -1.986E+00 9.904E+04 7.605E+04 4 1 1.62003E+05 -1.00000E-02 -1.56250E-02 5.758E-04 1.382E+01 1.688E+02 4 2 3.88484E+05 -1.00000E-02 -1.23457E-02 1.353E-02 7.785E+02 6.898E+02 4 3 Infinity -1.00000E-02 -1.00000E-02 NaN Infinity NaN 3 7 0 3 7 1 :isi,li,ipi,isj,lj,ipj 3 4 12 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 3.80319E+03 -1.56250E-02 2.23981E-01 -2.564E-25 1.445E-22 1.183E-16 1 2 3.72876E+03 -1.56250E-02 2.28764E-01 -3.400E-25 1.878E-22 1.631E-16 1 3 3.67939E+03 -1.56250E-02 2.32043E-01 -3.327E-25 1.813E-22 1.639E-16 1 4 3.64486E+03 -1.56250E-02 2.34389E-01 -7.202E-28 3.889E-25 3.616E-19 2 1 3.85596E+03 -1.23457E-02 2.23981E-01 -4.616E-25 2.637E-22 2.070E-16 2 2 3.77947E+03 -1.23457E-02 2.28764E-01 -6.120E-25 3.427E-22 2.858E-16 2 3 3.72876E+03 -1.23457E-02 2.32043E-01 -5.984E-25 3.306E-22 2.871E-16 2 4 3.69331E+03 -1.23457E-02 2.34389E-01 -1.284E-27 7.027E-25 6.279E-19 3 1 3.89462E+03 -1.00000E-02 2.23981E-01 -5.622E-25 3.244E-22 2.472E-16 3 2 3.81660E+03 -1.00000E-02 2.28764E-01 -7.453E-25 4.214E-22 3.413E-16 3 3 3.76490E+03 -1.00000E-02 2.32043E-01 -7.291E-25 4.067E-22 3.431E-16 3 4 3.72876E+03 -1.00000E-02 2.34389E-01 -1.553E-27 8.579E-25 7.451E-19 3 7 0 3 8 1 :isi,li,ipi,isj,lj,ipj 3 1 3 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 2.77885E+05 -1.56250E-02 -1.23457E-02 -2.673E+00 1.101E+05 2.037E+05 2 1 Infinity -1.23457E-02 -1.23457E-02 NaN Infinity NaN 3 1 3.88484E+05 -1.00000E-02 -1.23457E-02 4.351E-03 2.838E+02 2.179E+02 3 7 1 3 8 0 :isi,li,ipi,isj,lj,ipj 4 3 12 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.90522E+05 2.23981E-01 2.28764E-01 -2.216E+00 6.255E+04 3.593E+05 1 2 1.13032E+05 2.23981E-01 2.32043E-01 -2.168E-01 3.630E+03 9.985E+04 1 3 8.75544E+04 2.23981E-01 2.34389E-01 -1.710E-04 2.219E+00 1.313E+02 2 1 Infinity 2.28764E-01 2.28764E-01 NaN Infinity NaN 2 2 2.77910E+05 2.28764E-01 2.32043E-01 -2.011E+00 8.281E+04 1.533E+05 2 3 1.62003E+05 2.28764E-01 2.34389E-01 -9.469E-04 2.273E+01 2.123E+02 3 1 2.77910E+05 2.32043E-01 2.28764E-01 4.665E-03 2.177E+02 4.566E+02 3 2 Infinity 2.32043E-01 2.32043E-01 NaN Infinity NaN 3 3 3.88433E+05 2.32043E-01 2.34389E-01 -5.033E-03 2.896E+02 1.963E+02 4 1 1.62003E+05 2.34389E-01 2.28764E-01 1.224E-04 3.329E+00 3.525E+01 4 2 3.88433E+05 2.34389E-01 2.32043E-01 1.287E-03 8.394E+01 6.448E+01 4 3 Infinity 2.34389E-01 2.34389E-01 NaN Infinity NaN 3 8 0 3 8 1 :isi,li,ipi,isj,lj,ipj 3 1 3 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 3.77947E+03 2.28764E-01 -1.23457E-02 3.700E-29 2.348E-26 1.728E-20 2 1 3.72876E+03 2.32043E-01 -1.23457E-02 6.251E-29 3.913E-26 2.999E-20 3 1 3.69331E+03 2.34389E-01 -1.23457E-02 3.053E-31 1.893E-28 1.493E-22 3 8 0 3 9 1 :isi,li,ipi,isj,lj,ipj 3 1 3 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 2.77910E+05 2.28764E-01 2.32043E-01 -2.563E+00 1.196E+05 1.980E+05 2 1 Infinity 2.32043E-01 2.32043E-01 NaN Infinity NaN 3 1 3.88433E+05 2.34389E-01 2.32043E-01 1.154E-03 8.412E+01 5.702E+01 3 8 1 3 9 0 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 3 9 0 3 9 1 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 3 9 0 3 10 1 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 3 9 1 3 10 0 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 3 10 0 3 10 1 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 3 10 0 3 11 1 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 3 10 1 3 11 0 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 3 11 0 3 11 1 :isi,li,ipi,isj,lj,ipj 1 1 0 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 0 0 1 1 1 :isi,li,ipi,isj,lj,ipj 9 8 72 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.24158E+03 -6.63442E-01 7.05148E-02 -1.362E-01 5.567E-01 1.964E+08 1 2 1.14001E+03 -6.63442E-01 1.35906E-01 -1.700E-03 6.380E-03 2.908E+06 1 3 1.07699E+03 -6.63442E-01 1.82681E-01 -4.402E-04 1.561E-03 8.438E+05 1 4 1.04968E+03 -6.63442E-01 2.04700E-01 -2.012E-04 6.953E-04 4.060E+05 1 5 1.03530E+03 -6.63442E-01 2.16755E-01 -1.059E-04 3.609E-04 2.197E+05 1 6 1.02678E+03 -6.63442E-01 2.24054E-01 -5.774E-05 1.952E-04 1.218E+05 1 7 1.02132E+03 -6.63442E-01 2.28803E-01 -3.084E-05 1.037E-04 6.573E+04 1 8 1.01760E+03 -6.63442E-01 2.32064E-01 -1.524E-05 5.105E-05 3.272E+04 2 1 6.92488E+03 2.02108E-01 7.05148E-02 1.191E-01 8.146E+00 4.970E+07 2 2 1.37649E+04 2.02108E-01 1.35906E-01 1.276E-03 1.735E-01 1.348E+05 2 3 4.69072E+04 2.02108E-01 1.82681E-01 2.060E-04 9.543E-02 1.873E+03 2 4 3.51569E+05 2.02108E-01 2.04700E-01 -7.268E-05 8.412E-02 1.307E+00 2 5 6.22152E+04 2.02108E-01 2.16755E-01 -3.938E-04 8.066E-02 2.262E+02 2 6 4.15232E+04 2.02108E-01 2.24054E-01 -5.792E-04 7.918E-02 7.469E+02 2 7 3.41362E+04 2.02108E-01 2.28803E-01 -6.978E-04 7.842E-02 1.331E+03 2 8 3.04202E+04 2.02108E-01 2.32064E-01 -7.803E-04 7.814E-02 1.875E+03 3 1 4.24678E+03 2.85093E-01 7.05148E-02 7.950E-03 3.334E-01 8.820E+06 3 2 6.10822E+03 2.85093E-01 1.35906E-01 2.304E-05 1.390E-03 1.236E+04 3 3 8.89805E+03 2.85093E-01 1.82681E-01 1.570E-05 1.379E-03 3.967E+03 3 4 1.13352E+04 2.85093E-01 2.04700E-01 6.740E-05 7.545E-03 1.050E+04 3 5 1.33347E+04 2.85093E-01 2.16755E-01 1.215E-04 1.600E-02 1.367E+04 3 6 1.49293E+04 2.85093E-01 2.24054E-01 1.711E-04 2.523E-02 1.536E+04 3 7 1.61888E+04 2.85093E-01 2.28803E-01 2.158E-04 3.450E-02 1.648E+04 3 8 1.71843E+04 2.85093E-01 2.32064E-01 2.568E-04 4.359E-02 1.740E+04 4 1 3.67354E+03 3.18577E-01 7.05148E-02 2.244E-03 8.140E-02 3.327E+06 4 2 4.98857E+03 3.18577E-01 1.35906E-01 5.217E-06 2.570E-04 4.194E+03 4 3 6.70562E+03 3.18577E-01 1.82681E-01 3.983E-06 2.638E-04 1.773E+03 4 4 8.00221E+03 3.18577E-01 2.04700E-01 1.345E-05 1.063E-03 4.204E+03 4 5 8.94961E+03 3.18577E-01 2.16755E-01 2.071E-05 1.831E-03 5.174E+03 4 6 9.64069E+03 3.18577E-01 2.24054E-01 2.579E-05 2.455E-03 5.552E+03 4 7 1.01507E+04 3.18577E-01 2.28803E-01 2.949E-05 2.956E-03 5.726E+03 4 8 1.05333E+04 3.18577E-01 2.32064E-01 3.242E-05 3.373E-03 5.847E+03 5 1 3.44138E+03 3.35312E-01 7.05148E-02 9.760E-04 3.317E-02 1.649E+06 5 2 4.56991E+03 3.35312E-01 1.35906E-01 2.099E-06 9.474E-05 2.011E+03 5 3 5.97039E+03 3.35312E-01 1.82681E-01 1.627E-06 9.594E-05 9.133E+02 5 4 6.97690E+03 3.35312E-01 2.04700E-01 5.127E-06 3.533E-04 2.107E+03 5 5 7.68632E+03 3.35312E-01 2.16755E-01 7.547E-06 5.729E-04 2.556E+03 5 6 8.19057E+03 3.35312E-01 2.24054E-01 9.087E-06 7.350E-04 2.710E+03 5 7 8.55577E+03 3.35312E-01 2.28803E-01 1.012E-05 8.554E-04 2.767E+03 5 8 8.82600E+03 3.35312E-01 2.32064E-01 1.091E-05 9.507E-04 2.802E+03 6 1 3.32141E+03 3.44876E-01 7.05148E-02 5.217E-04 1.711E-02 9.462E+05 6 2 4.36076E+03 3.44876E-01 1.35906E-01 1.081E-06 4.654E-05 1.137E+03 6 3 5.61834E+03 3.44876E-01 1.82681E-01 8.380E-07 4.650E-05 5.312E+02 6 4 6.50088E+03 3.44876E-01 2.04700E-01 2.562E-06 1.645E-04 1.213E+03 6 5 7.11255E+03 3.44876E-01 2.16755E-01 3.697E-06 2.597E-04 1.462E+03 6 6 7.54223E+03 3.44876E-01 2.24054E-01 4.387E-06 3.268E-04 1.543E+03 6 7 7.85081E+03 3.44876E-01 2.28803E-01 4.830E-06 3.745E-04 1.568E+03 6 8 8.07775E+03 3.44876E-01 2.32064E-01 5.157E-06 4.114E-04 1.581E+03 7 1 3.25059E+03 3.50854E-01 7.05148E-02 3.147E-04 1.010E-02 5.959E+05 7 2 4.23948E+03 3.50854E-01 1.35906E-01 6.383E-07 2.673E-05 7.107E+02 7 3 5.41863E+03 3.50854E-01 1.82681E-01 4.937E-07 2.642E-05 3.364E+02 7 4 6.23498E+03 3.50854E-01 2.04700E-01 1.485E-06 9.144E-05 7.644E+02 7 5 6.79548E+03 3.50854E-01 2.16755E-01 2.119E-06 1.422E-04 9.183E+02 7 6 7.18665E+03 3.50854E-01 2.24054E-01 2.495E-06 1.771E-04 9.665E+02 7 7 7.46628E+03 3.50854E-01 2.28803E-01 2.731E-06 2.014E-04 9.804E+02 7 8 7.67124E+03 3.50854E-01 2.32064E-01 2.902E-06 2.198E-04 9.866E+02 8 1 3.20503E+03 3.54839E-01 7.05148E-02 2.056E-04 6.508E-03 4.005E+05 8 2 4.16231E+03 3.54839E-01 1.35906E-01 4.117E-07 1.692E-05 4.755E+02 8 3 5.29320E+03 3.54839E-01 1.82681E-01 3.175E-07 1.660E-05 2.268E+02 8 4 6.06949E+03 3.54839E-01 2.04700E-01 9.457E-07 5.669E-05 5.137E+02 8 5 6.59937E+03 3.54839E-01 2.16755E-01 1.341E-06 8.740E-05 6.161E+02 8 6 6.96767E+03 3.54839E-01 2.24054E-01 1.571E-06 1.081E-04 6.474E+02 8 7 7.23021E+03 3.54839E-01 2.28803E-01 1.713E-06 1.223E-04 6.558E+02 8 8 7.42225E+03 3.54839E-01 2.32064E-01 1.815E-06 1.330E-04 6.592E+02 9 1 3.17388E+03 3.57629E-01 7.05148E-02 1.422E-04 4.459E-03 2.825E+05 9 2 4.10993E+03 3.57629E-01 1.35906E-01 2.824E-07 1.146E-05 3.346E+02 9 3 5.20879E+03 3.57629E-01 1.82681E-01 2.173E-07 1.118E-05 1.602E+02 9 4 5.95876E+03 3.57629E-01 2.04700E-01 6.430E-07 3.784E-05 3.624E+02 9 5 6.46867E+03 3.57629E-01 2.16755E-01 9.077E-07 5.799E-05 4.340E+02 9 6 6.82214E+03 3.57629E-01 2.24054E-01 1.060E-06 7.140E-05 4.556E+02 9 7 7.07363E+03 3.57629E-01 2.28803E-01 1.153E-06 8.057E-05 4.612E+02 9 8 7.25733E+03 3.57629E-01 2.32064E-01 1.219E-06 8.740E-05 4.632E+02 1 0 1 1 1 0 :isi,li,ipi,isj,lj,ipj 7 15 105 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.10968E+04 1.34966E-01 5.28464E-02 1.713E-01 1.878E+01 2.784E+07 1 2 7.52802E+04 1.34966E-01 1.47071E-01 -1.336E-01 3.311E+01 5.241E+04 1 3 2.35982E+04 1.34966E-01 1.73582E-01 -4.740E-05 3.682E-03 1.892E+02 1 4 1.93874E+04 1.34966E-01 1.81969E-01 -1.040E+00 6.638E+01 6.152E+06 1 5 1.65824E+04 1.34966E-01 1.89920E-01 -3.786E-03 2.067E-01 3.061E+04 1 6 1.31235E+04 1.34966E-01 2.04404E-01 -1.495E-01 6.459E+00 1.930E+06 1 7 1.24476E+04 1.34966E-01 2.08174E-01 -3.925E-04 1.608E-02 5.632E+03 1 8 1.11605E+04 1.34966E-01 2.16617E-01 -4.984E-02 1.831E+00 8.896E+05 1 9 1.08738E+04 1.34966E-01 2.18770E-01 -1.139E-04 4.077E-03 2.142E+03 1 10 1.02369E+04 1.34966E-01 2.23984E-01 -2.325E-02 7.835E-01 4.933E+05 1 11 1.00838E+04 1.34966E-01 2.25335E-01 -4.899E-05 1.626E-03 1.071E+03 1 12 9.71500E+03 1.34966E-01 2.28766E-01 -1.296E-02 4.145E-01 3.053E+05 1 13 9.62227E+03 1.34966E-01 2.29670E-01 -2.582E-05 8.179E-04 6.200E+02 1 14 9.38696E+03 1.34966E-01 2.32044E-01 -8.064E-03 2.492E-01 2.035E+05 1 15 9.32596E+03 1.34966E-01 2.32679E-01 -1.539E-05 4.725E-04 3.934E+02 2 1 7.03390E+03 1.82400E-01 5.28464E-02 1.201E-02 8.346E-01 4.859E+06 2 2 2.57937E+04 1.82400E-01 1.47071E-01 1.927E-01 4.909E+01 5.795E+06 2 3 1.03342E+05 1.82400E-01 1.73582E-01 2.161E-02 2.206E+01 4.049E+04 2 4 2.11430E+06 1.82400E-01 1.81969E-01 8.117E-03 1.695E+02 3.633E+01 2 5 1.21179E+05 1.82400E-01 1.89920E-01 -2.754E-01 1.099E+02 4.170E+04 2 6 4.14137E+04 1.82400E-01 2.04404E-01 -9.336E-01 1.273E+02 1.210E+06 2 7 3.53561E+04 1.82400E-01 2.08174E-01 -2.049E-03 2.385E-01 3.644E+03 2 8 2.66320E+04 1.82400E-01 2.16617E-01 -1.867E-01 1.637E+01 5.852E+05 2 9 2.50555E+04 1.82400E-01 2.18770E-01 -3.767E-04 3.107E-02 1.334E+03 2 10 2.19139E+04 1.82400E-01 2.23984E-01 -7.113E-02 5.132E+00 3.293E+05 2 11 2.12243E+04 1.82400E-01 2.25335E-01 -1.386E-04 9.684E-03 6.841E+02 2 12 1.96538E+04 1.82400E-01 2.28766E-01 -3.566E-02 2.307E+00 2.052E+05 2 13 1.92779E+04 1.82400E-01 2.29670E-01 -6.806E-05 4.319E-03 4.072E+02 2 14 1.83560E+04 1.82400E-01 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5.23988E+04 2.34388E-01 2.16997E-01 9.410E-04 1.136E+00 3.200E+03 17 7 8.75461E+04 2.34388E-01 2.23979E-01 1.810E-03 3.652E+00 2.205E+03 17 8 8.96211E+04 2.34388E-01 2.24220E-01 1.923E-03 3.971E+00 2.235E+03 17 9 1.62003E+05 2.34388E-01 2.28763E-01 8.034E-03 2.999E+01 2.859E+03 17 10 1.66716E+05 2.34388E-01 2.28922E-01 4.846E-03 1.862E+01 1.628E+03 17 11 3.88435E+05 2.34388E-01 2.32042E-01 5.807E-02 5.198E+02 3.594E+03 17 12 4.07909E+05 2.34388E-01 2.32154E-01 2.169E-02 2.038E+02 1.217E+03 17 13 Infinity 2.34388E-01 2.34388E-01 NaN Infinity NaN 1 2 1 1 3 0 :isi,li,ipi,isj,lj,ipj 22 19 418 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 8.80200E+03 -4.45482E-02 5.89814E-02 -4.790E-01 6.940E+01 2.946E+07 1 2 4.65680E+03 -4.45482E-02 1.51137E-01 -2.278E-03 1.746E-01 5.005E+05 1 3 4.02496E+03 -4.45482E-02 1.81856E-01 -1.685E-05 1.116E-03 4.954E+03 1 4 3.89224E+03 -4.45482E-02 1.89576E-01 -3.628E-05 2.324E-03 1.141E+04 1 5 3.66092E+03 -4.45482E-02 2.04369E-01 -1.018E-05 6.136E-04 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10 2 1.39180E+04 2.16611E-01 1.51137E-01 4.173E-07 1.338E-04 2.012E+01 10 3 2.62197E+04 2.16611E-01 1.81856E-01 1.409E-03 8.514E-01 1.914E+04 10 4 3.37069E+04 2.16611E-01 1.89576E-01 2.211E-06 1.718E-03 1.818E+01 10 5 7.44377E+04 2.16611E-01 2.04369E-01 8.980E-03 1.540E+01 1.513E+04 10 6 1.10887E+05 2.16611E-01 2.08393E-01 2.416E-05 6.173E-02 1.835E+01 10 7 7.59678E+07 2.16611E-01 2.16599E-01 1.382E-05 2.420E+01 2.237E-05 10 8 Infinity 2.16611E-01 2.16611E-01 NaN Infinity NaN 10 9 3.88433E+05 2.16611E-01 2.18957E-01 -3.018E-05 1.930E-01 9.530E-01 10 10 1.23780E+05 2.16611E-01 2.23973E-01 -9.868E-04 2.011E+00 3.068E+02 10 11 1.23646E+05 2.16611E-01 2.23981E-01 -1.490E+00 3.033E+03 4.644E+05 10 12 1.02840E+05 2.16611E-01 2.25472E-01 -2.372E-08 4.015E-05 1.069E-02 10 13 7.50199E+04 2.16611E-01 2.28758E-01 -2.378E-04 2.937E-01 2.013E+02 10 14 7.49829E+04 2.16611E-01 2.28764E-01 -2.654E-01 3.276E+02 2.249E+05 10 15 6.92504E+04 2.16611E-01 2.29770E-01 -3.214E-10 3.664E-07 3.193E-04 10 16 5.90658E+04 2.16611E-01 2.32039E-01 -9.752E-05 9.481E-02 1.332E+02 10 17 5.90505E+04 2.16611E-01 2.32043E-01 -9.292E-02 9.032E+01 1.270E+05 10 18 5.64496E+04 2.16611E-01 2.32754E-01 -2.200E-11 2.044E-08 3.289E-05 10 19 5.12581E+04 2.16611E-01 2.34389E-01 -4.394E-02 3.707E+01 7.967E+04 11 1 5.77608E+03 2.16747E-01 5.89814E-02 1.793E-04 2.386E-02 5.018E+04 11 2 1.38891E+04 2.16747E-01 1.51137E-01 1.341E-03 4.291E-01 6.490E+04 11 3 2.61175E+04 2.16747E-01 1.81856E-01 9.269E-04 5.579E-01 1.269E+04 11 4 3.35382E+04 2.16747E-01 1.89576E-01 6.029E-03 4.659E+00 5.005E+04 11 5 7.36199E+04 2.16747E-01 2.04369E-01 1.332E-02 2.261E+01 2.296E+04 11 6 1.09081E+05 2.16747E-01 2.08393E-01 5.876E-02 1.477E+02 4.611E+04 11 7 6.15728E+06 2.16747E-01 2.16599E-01 3.196E-02 4.535E+03 7.871E+00 11 8 6.70035E+06 2.16747E-01 2.16611E-01 3.840E-05 5.929E+00 7.987E-03 11 9 4.12337E+05 2.16747E-01 2.18957E-01 -6.746E-02 4.579E+02 1.890E+03 11 10 1.26109E+05 2.16747E-01 2.23973E-01 -6.092E-01 1.265E+03 1.825E+05 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3.422E-02 1.196E+02 12 6 6.21389E+04 2.23058E-01 2.08393E-01 4.847E-02 6.941E+01 1.172E+05 12 7 1.41085E+05 2.23058E-01 2.16599E-01 3.259E-04 1.059E+00 1.529E+02 12 8 1.41347E+05 2.23058E-01 2.16611E-01 5.834E-08 1.900E-04 2.727E-02 12 9 2.22206E+05 2.23058E-01 2.18957E-01 6.589E-01 3.374E+03 1.246E+05 12 10 9.95914E+05 2.23058E-01 2.23973E-01 -1.854E-03 3.039E+01 8.905E+00 12 11 9.87296E+05 2.23058E-01 2.23981E-01 -1.206E-07 1.959E-03 5.892E-04 12 12 3.77492E+05 2.23058E-01 2.25472E-01 -1.442E+00 8.960E+03 4.821E+04 12 13 1.59871E+05 2.23058E-01 2.28758E-01 -7.516E-04 1.978E+00 1.401E+02 12 14 1.59703E+05 2.23058E-01 2.28764E-01 -6.468E-08 1.700E-04 1.208E-02 12 15 1.35767E+05 2.23058E-01 2.29770E-01 -2.748E-02 6.141E+01 7.103E+03 12 16 1.01466E+05 2.23058E-01 2.32039E-01 -2.746E-04 4.586E-01 1.271E+02 12 17 1.01421E+05 2.23058E-01 2.32043E-01 -1.054E-08 1.759E-05 4.881E-03 12 18 9.39838E+04 2.23058E-01 2.32754E-01 -5.010E-03 7.751E+00 2.702E+03 12 19 8.04224E+04 2.23058E-01 2.34389E-01 -2.338E-09 3.095E-06 1.722E-03 13 1 5.52288E+03 2.23980E-01 5.89814E-02 6.637E-08 8.447E-06 2.032E+01 13 2 1.25100E+04 2.23980E-01 1.51137E-01 3.763E-07 1.085E-04 2.245E+01 13 3 2.16330E+04 2.23980E-01 1.81856E-01 4.454E-04 2.221E-01 8.888E+03 13 4 2.64872E+04 2.23980E-01 1.89576E-01 1.361E-06 8.306E-04 1.811E+01 13 5 4.64671E+04 2.23980E-01 2.04369E-01 1.710E-03 1.831E+00 7.395E+03 13 6 5.84633E+04 2.23980E-01 2.08393E-01 5.433E-06 7.320E-03 1.484E+01 13 7 1.23461E+05 2.23980E-01 2.16599E-01 7.746E-03 2.204E+01 4.745E+03 13 8 1.23662E+05 2.23980E-01 2.16611E-01 5.834E-03 1.663E+01 3.563E+03 13 9 1.81419E+05 2.23980E-01 2.18957E-01 5.256E-05 2.197E-01 1.491E+01 13 10 1.30393E+08 2.23980E-01 2.23973E-01 1.364E-05 4.100E+01 7.493E-06 13 11 9.12748E+08 2.23980E-01 2.23981E-01 -2.428E-04 3.648E+03 1.388E-06 13 12 6.10765E+05 2.23980E-01 2.25472E-01 -7.014E-05 7.052E-01 8.958E-01 13 13 1.90721E+05 2.23980E-01 2.28758E-01 -1.030E-03 3.232E+00 1.349E+02 13 14 1.90482E+05 2.23980E-01 2.28764E-01 -1.390E+00 4.357E+03 1.825E+05 13 15 1.57386E+05 2.23980E-01 2.29770E-01 -4.870E-08 1.262E-04 9.367E-03 13 16 1.13074E+05 2.23980E-01 2.32039E-01 -2.792E-04 5.197E-01 1.040E+02 13 17 1.13018E+05 2.23980E-01 2.32043E-01 -2.904E-01 5.402E+02 1.083E+05 13 18 1.03860E+05 2.23980E-01 2.32754E-01 -3.868E-10 6.613E-07 1.708E-04 13 19 8.75460E+04 2.23980E-01 2.34389E-01 -1.108E-01 1.597E+02 6.887E+04 14 1 5.52010E+03 2.24063E-01 5.89814E-02 9.137E-05 1.162E-02 2.800E+04 14 2 1.24958E+04 2.24063E-01 1.51137E-01 6.034E-04 1.738E-01 3.609E+04 14 3 2.15904E+04 2.24063E-01 1.81856E-01 3.393E-04 1.688E-01 6.797E+03 14 4 2.64235E+04 2.24063E-01 1.89576E-01 1.976E-03 1.203E+00 2.642E+04 14 5 4.62713E+04 2.24063E-01 2.04369E-01 2.629E-03 2.803E+00 1.146E+04 14 6 5.81536E+04 2.24063E-01 2.08393E-01 7.453E-03 9.988E+00 2.058E+04 14 7 1.22088E+05 2.24063E-01 2.16599E-01 2.404E-02 6.764E+01 1.506E+04 14 8 1.22285E+05 2.24063E-01 2.16611E-01 2.984E-05 8.410E-02 1.864E+01 14 9 1.78470E+05 2.24063E-01 2.18957E-01 6.706E-02 2.758E+02 1.966E+04 14 10 1.01265E+07 2.24063E-01 2.23973E-01 3.899E-02 9.098E+03 3.550E+00 14 11 1.11129E+07 2.24063E-01 2.23981E-01 8.786E-05 2.250E+01 6.643E-03 14 12 6.46743E+05 2.24063E-01 2.25472E-01 -8.268E-02 8.802E+02 9.417E+02 14 13 1.94093E+05 2.24063E-01 2.28758E-01 -6.166E-01 1.970E+03 7.798E+04 14 14 1.93845E+05 2.24063E-01 2.28764E-01 -2.854E-03 9.107E+00 3.619E+02 14 15 1.59675E+05 2.24063E-01 2.29770E-01 -4.520E-05 1.188E-01 8.446E+00 14 16 1.14251E+05 2.24063E-01 2.32039E-01 -1.486E-01 2.795E+02 5.425E+04 14 17 1.14194E+05 2.24063E-01 2.32043E-01 -6.344E-04 1.192E+00 2.318E+02 14 18 1.04852E+05 2.24063E-01 2.32754E-01 -8.372E-07 1.445E-03 3.628E-01 14 19 8.82497E+04 2.24063E-01 2.34389E-01 -2.574E-04 3.739E-01 1.575E+02 15 1 5.38677E+03 2.28149E-01 5.89814E-02 6.727E-04 8.351E-02 2.165E+05 15 2 1.18328E+04 2.28149E-01 1.51137E-01 2.409E-03 6.568E-01 1.606E+05 15 3 1.96848E+04 2.28149E-01 1.81856E-01 2.017E-06 9.150E-04 4.861E+01 15 4 2.36245E+04 2.28149E-01 1.89576E-01 5.964E-03 3.247E+00 9.979E+04 15 5 3.83207E+04 2.28149E-01 2.04369E-01 1.115E-05 9.844E-03 7.088E+01 15 6 4.61261E+04 2.28149E-01 2.08393E-01 1.583E-02 1.683E+01 6.947E+04 15 7 7.88976E+04 2.28149E-01 2.16599E-01 5.460E-05 9.927E-02 8.190E+01 15 8 7.89796E+04 2.28149E-01 2.16611E-01 8.339E-09 1.518E-05 1.248E-02 15 9 9.91371E+04 2.28149E-01 2.18957E-01 5.857E-02 1.338E+02 5.565E+04 15 10 2.18216E+05 2.28149E-01 2.23973E-01 4.849E-04 2.438E+00 9.508E+01 15 11 2.18634E+05 2.28149E-01 2.23981E-01 5.131E-08 2.585E-04 1.002E-02 15 12 3.40407E+05 2.28149E-01 2.25472E-01 7.813E-01 6.129E+03 6.296E+04 15 13 1.49631E+06 2.28149E-01 2.28758E-01 -2.288E-03 5.635E+01 4.869E+00 15 14 1.48173E+06 2.28149E-01 2.28764E-01 -4.402E-08 1.074E-03 9.552E-05 15 15 5.62161E+05 2.28149E-01 2.29770E-01 -1.630E+00 1.508E+04 2.457E+04 15 16 2.34258E+05 2.28149E-01 2.32039E-01 -7.382E-04 2.847E+00 6.409E+01 15 17 2.34018E+05 2.28149E-01 2.32043E-01 -1.965E-07 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5.911E-01 1.129E+01 16 13 1.52125E+08 2.28764E-01 2.28758E-01 1.286E-05 4.509E+01 5.190E-06 16 14 Infinity 2.28764E-01 2.28764E-01 NaN Infinity NaN 16 15 9.05826E+05 2.28764E-01 2.29770E-01 -1.291E-04 1.925E+00 7.496E-01 16 16 2.78249E+05 2.28764E-01 2.32039E-01 -1.035E-03 4.742E+00 6.371E+01 16 17 2.77910E+05 2.28764E-01 2.32043E-01 -1.334E+00 6.102E+03 8.228E+04 16 18 2.28387E+05 2.28764E-01 2.32754E-01 -7.794E-08 2.930E-04 7.119E-03 16 19 1.62003E+05 2.28764E-01 2.34389E-01 -3.026E-01 8.069E+02 5.493E+04 17 1 5.36555E+03 2.28818E-01 5.89814E-02 5.356E-05 6.622E-03 1.737E+04 17 2 1.17309E+04 2.28818E-01 1.51137E-01 3.299E-04 8.917E-02 2.238E+04 17 3 1.94044E+04 2.28818E-01 1.81856E-01 1.666E-04 7.449E-02 4.131E+03 17 4 2.32217E+04 2.28818E-01 1.89576E-01 9.236E-04 4.942E-01 1.599E+04 17 5 3.72722E+04 2.28818E-01 2.04369E-01 9.847E-04 8.458E-01 6.619E+03 17 6 4.46153E+04 2.28818E-01 2.08393E-01 2.520E-03 2.591E+00 1.182E+04 17 7 7.45779E+04 2.28818E-01 2.16599E-01 4.926E-03 8.466E+00 8.270E+03 17 8 7.46512E+04 2.28818E-01 2.16611E-01 6.300E-06 1.084E-02 1.056E+01 17 9 9.24113E+04 2.28818E-01 2.18957E-01 8.766E-03 1.867E+01 9.585E+03 17 10 1.88084E+05 2.28818E-01 2.23973E-01 3.644E-02 1.580E+02 9.619E+03 17 11 1.88395E+05 2.28818E-01 2.23981E-01 7.871E-05 3.417E-01 2.071E+01 17 12 2.72346E+05 2.28818E-01 2.25472E-01 7.530E-02 4.726E+02 9.480E+03 17 13 1.51898E+07 2.28818E-01 2.28758E-01 4.424E-02 1.549E+04 1.791E+00 17 14 1.68748E+07 2.28818E-01 2.28764E-01 1.463E-04 5.689E+01 4.797E-03 17 15 9.57208E+05 2.28818E-01 2.29770E-01 -9.772E-02 1.540E+03 5.081E+02 17 16 2.82914E+05 2.28818E-01 2.32039E-01 -6.308E-01 2.938E+03 3.755E+04 17 17 2.82564E+05 2.28818E-01 2.32043E-01 -3.672E-03 1.708E+01 2.191E+02 17 18 2.31521E+05 2.28818E-01 2.32754E-01 -3.834E-05 1.461E-01 3.408E+00 17 19 1.63573E+05 2.28818E-01 2.34389E-01 -8.550E-04 2.302E+00 1.522E+02 18 1 5.27868E+03 2.31613E-01 5.89814E-02 4.483E-04 5.453E-02 1.502E+05 18 2 1.13235E+04 2.31613E-01 1.51137E-01 1.519E-03 3.963E-01 1.106E+05 18 3 1.83144E+04 2.31613E-01 1.81856E-01 1.179E-06 4.975E-04 3.281E+01 18 4 2.16777E+04 2.31613E-01 1.89576E-01 3.406E-03 1.701E+00 6.767E+04 18 5 3.34484E+04 2.31613E-01 2.04369E-01 5.547E-06 4.276E-03 4.630E+01 18 6 3.92449E+04 2.31613E-01 2.08393E-01 7.554E-03 6.832E+00 4.580E+04 18 7 6.06945E+04 2.31613E-01 2.16599E-01 2.011E-05 2.813E-02 5.099E+01 18 8 6.07431E+04 2.31613E-01 2.16611E-01 2.596E-09 3.634E-06 6.569E-03 18 9 7.20028E+04 2.31613E-01 2.18957E-01 1.903E-02 3.157E+01 3.427E+04 18 10 1.19276E+05 2.31613E-01 2.23973E-01 8.214E-05 2.258E-01 5.391E+01 18 11 1.19401E+05 2.31613E-01 2.23981E-01 6.900E-09 1.899E-05 4.519E-03 18 12 1.48391E+05 2.31613E-01 2.25472E-01 6.851E-02 2.343E+02 2.905E+04 18 13 3.19184E+05 2.31613E-01 2.28758E-01 6.569E-04 4.832E+00 6.020E+01 18 14 3.19855E+05 2.31613E-01 2.28764E-01 3.664E-08 2.701E-04 3.344E-03 18 15 4.94450E+05 2.31613E-01 2.29770E-01 9.034E-01 1.029E+04 3.451E+04 18 16 2.13908E+06 2.31613E-01 2.32039E-01 -2.714E-03 9.556E+01 2.826E+00 18 17 2.11921E+06 2.31613E-01 2.32043E-01 -4.236E-09 1.478E-04 4.494E-06 18 18 7.98648E+05 2.31613E-01 2.32754E-01 -1.817E+00 2.389E+04 1.357E+04 18 19 3.28265E+05 2.31613E-01 2.34389E-01 -3.456E-07 1.867E-03 1.528E-02 19 1 5.26556E+03 2.32043E-01 5.89814E-02 5.691E-08 6.906E-06 1.917E+01 19 2 1.12633E+04 2.32043E-01 1.51137E-01 2.893E-07 7.509E-05 2.129E+01 19 3 1.81574E+04 2.32043E-01 1.81856E-01 1.086E-04 4.546E-02 3.077E+03 19 4 2.14582E+04 2.32043E-01 1.89576E-01 7.809E-07 3.861E-04 1.584E+01 19 5 3.29286E+04 2.32043E-01 2.04369E-01 3.014E-04 2.287E-01 2.596E+03 19 6 3.85314E+04 2.32043E-01 2.08393E-01 1.866E-06 1.657E-03 1.173E+01 19 7 5.90046E+04 2.32043E-01 2.16599E-01 6.681E-04 9.085E-01 1.792E+03 19 8 5.90505E+04 2.32043E-01 2.16611E-01 2.639E-04 3.591E-01 7.066E+02 19 9 6.96368E+04 2.32043E-01 2.18957E-01 4.800E-06 7.703E-03 9.243E+00 19 10 1.12920E+05 2.32043E-01 2.23973E-01 1.619E-03 4.212E+00 1.185E+03 19 11 1.13032E+05 2.32043E-01 2.23981E-01 2.504E-03 6.523E+00 1.830E+03 19 12 1.38680E+05 2.32043E-01 2.25472E-01 1.637E-05 5.232E-02 7.949E+00 19 13 2.77403E+05 2.32043E-01 2.28758E-01 6.106E-03 3.903E+01 7.409E+02 19 14 2.77910E+05 2.32043E-01 2.28764E-01 2.843E-02 1.821E+02 3.437E+03 19 15 4.00911E+05 2.32043E-01 2.29770E-01 1.434E-04 1.325E+00 8.333E+00 19 16 2.28187E+08 2.32043E-01 2.32039E-01 1.182E-05 6.216E+01 2.120E-06 19 17 Infinity 2.32043E-01 2.32043E-01 NaN Infinity NaN 19 18 1.28165E+06 2.32043E-01 2.32754E-01 -2.062E-04 4.350E+00 5.980E-01 19 19 3.88433E+05 2.32043E-01 2.34389E-01 -1.304E+00 8.340E+03 4.119E+04 20 1 5.26441E+03 2.32081E-01 5.89814E-02 3.439E-05 4.172E-03 1.159E+04 20 2 1.12580E+04 2.32081E-01 1.51137E-01 2.027E-04 5.259E-02 1.494E+04 20 3 1.81437E+04 2.32081E-01 1.81856E-01 9.619E-05 4.022E-02 2.728E+03 20 4 2.14391E+04 2.32081E-01 1.89576E-01 5.180E-04 2.559E-01 1.052E+04 20 5 3.28835E+04 2.32081E-01 2.04369E-01 4.889E-04 3.705E-01 4.222E+03 20 6 3.84696E+04 2.32081E-01 2.08393E-01 1.202E-03 1.065E+00 7.582E+03 20 7 5.88598E+04 2.32081E-01 2.16599E-01 1.877E-03 2.546E+00 5.059E+03 20 8 5.89054E+04 2.32081E-01 2.16611E-01 2.491E-06 3.382E-03 6.705E+00 20 9 6.94352E+04 2.32081E-01 2.18957E-01 3.016E-03 4.826E+00 5.841E+03 20 10 1.12391E+05 2.32081E-01 2.23973E-01 7.666E-03 1.985E+01 5.667E+03 20 11 1.12502E+05 2.32081E-01 2.23981E-01 1.696E-05 4.396E-02 1.251E+01 20 12 1.37883E+05 2.32081E-01 2.25472E-01 1.002E-02 3.183E+01 4.921E+03 20 13 2.74231E+05 2.32081E-01 2.28758E-01 5.004E-02 3.163E+02 6.214E+03 20 14 2.74726E+05 2.32081E-01 2.28764E-01 1.586E-04 1.004E+00 1.962E+01 20 15 3.94319E+05 2.32081E-01 2.29770E-01 8.353E-02 7.590E+02 5.016E+03 20 16 2.17012E+07 2.32081E-01 2.32039E-01 5.257E-02 2.629E+04 1.042E+00 20 17 2.39820E+07 2.32081E-01 2.32043E-01 2.276E-04 1.258E+02 3.695E-03 20 18 1.35402E+06 2.32081E-01 2.32754E-01 -1.126E-01 2.510E+03 2.927E+02 20 19 3.94828E+05 2.32081E-01 2.34389E-01 -4.538E-03 2.949E+01 1.387E+02 21 1 5.20443E+03 2.34076E-01 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2.29770E-01 7.833E-02 3.820E+02 1.633E+04 21 16 4.47360E+05 2.34076E-01 2.32039E-01 8.386E-04 8.645E+00 3.913E+01 21 17 4.48239E+05 2.34076E-01 2.32043E-01 5.203E-09 5.374E-05 2.418E-04 21 18 6.89317E+05 2.34076E-01 2.32754E-01 1.026E+00 1.629E+04 2.015E+04 21 19 2.91127E+06 2.34076E-01 2.34389E-01 -1.070E-07 5.126E-03 6.012E-05 22 1 5.19514E+03 2.34389E-01 5.89814E-02 5.071E-08 6.072E-06 1.755E+01 22 2 1.09459E+04 2.34389E-01 1.51137E-01 2.507E-07 6.324E-05 1.954E+01 22 3 1.73466E+04 2.34389E-01 1.81856E-01 6.624E-05 2.648E-02 2.056E+03 22 4 2.03349E+04 2.34389E-01 1.89576E-01 6.320E-07 2.962E-04 1.427E+01 22 5 3.03553E+04 2.34389E-01 2.04369E-01 1.713E-04 1.198E-01 1.736E+03 22 6 3.50541E+04 2.34389E-01 2.08393E-01 1.365E-06 1.103E-03 1.037E+01 22 7 5.12235E+04 2.34389E-01 2.16599E-01 3.386E-04 3.997E-01 1.205E+03 22 8 5.12581E+04 2.34389E-01 2.16611E-01 1.157E-04 1.367E-01 4.113E+02 22 9 5.90505E+04 2.34389E-01 2.18957E-01 2.963E-06 4.032E-03 7.934E+00 22 10 8.74872E+04 2.34389E-01 2.23973E-01 6.643E-04 1.339E+00 8.104E+02 22 11 8.75544E+04 2.34389E-01 2.23981E-01 8.203E-04 1.655E+00 9.992E+02 22 12 1.02194E+05 2.34389E-01 2.25472E-01 7.220E-06 1.700E-02 6.455E+00 22 13 1.61830E+05 2.34389E-01 2.28758E-01 1.516E-03 5.653E+00 5.404E+02 22 14 1.62003E+05 2.34389E-01 2.28764E-01 4.869E-03 1.818E+01 1.732E+03 22 15 1.97287E+05 2.34389E-01 2.29770E-01 2.380E-05 1.082E-01 5.710E+00 22 16 3.87773E+05 2.34389E-01 2.32039E-01 5.524E-03 4.937E+01 3.431E+02 22 17 3.88433E+05 2.34389E-01 2.32043E-01 4.351E-02 3.895E+02 2.693E+03 22 18 5.57350E+05 2.34389E-01 2.32754E-01 2.033E-04 2.611E+00 6.111E+00 22 19 Infinity 2.34389E-01 2.34389E-01 NaN Infinity NaN 1 3 0 1 3 1 :isi,li,ipi,isj,lj,ipj 19 13 247 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.17254E+04 5.89814E-02 1.36699E-01 -1.804E-01 4.875E+01 8.753E+06 1 2 7.33139E+03 5.89814E-02 1.83278E-01 -1.209E-02 2.043E+00 1.501E+06 1 3 6.26707E+03 5.89814E-02 2.04387E-01 -1.760E-08 2.542E-06 2.989E+00 1 4 6.23764E+03 5.89814E-02 2.05073E-01 -3.074E-03 4.419E-01 5.270E+05 1 5 5.78114E+03 5.89814E-02 2.16609E-01 -1.569E-08 2.090E-06 3.130E+00 1 6 5.76694E+03 5.89814E-02 2.16997E-01 -1.241E-03 1.649E-01 2.488E+05 1 7 5.52291E+03 5.89814E-02 2.23979E-01 -1.234E-08 1.571E-06 2.699E+00 1 8 5.51486E+03 5.89814E-02 2.24220E-01 -6.316E-04 8.027E-02 1.385E+05 1 9 5.36729E+03 5.89814E-02 2.28763E-01 -9.699E-09 1.200E-06 2.245E+00 1 10 5.36227E+03 5.89814E-02 2.28922E-01 -3.690E-04 4.560E-02 8.559E+04 1 11 5.26560E+03 5.89814E-02 2.32042E-01 -7.727E-09 9.376E-07 1.859E+00 1 12 5.26219E+03 5.89814E-02 2.32154E-01 -2.361E-04 2.864E-02 5.688E+04 1 13 5.19517E+03 5.89814E-02 2.34388E-01 -6.244E-09 7.476E-07 1.543E+00 2 1 6.31159E+04 1.51137E-01 1.36699E-01 5.446E-02 7.921E+01 9.118E+04 2 2 2.83522E+04 1.51137E-01 1.83278E-01 -2.231E-01 1.458E+02 1.852E+06 2 3 1.71130E+04 1.51137E-01 2.04387E-01 -3.250E-07 1.282E-04 7.402E+00 2 4 1.68953E+04 1.51137E-01 2.05073E-01 -2.490E-02 9.695E+00 5.818E+05 2 5 1.39184E+04 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1.81856E-01 2.16997E-01 -2.639E-04 1.577E-01 2.617E+03 3 7 2.16335E+04 1.81856E-01 2.23979E-01 -1.016E-02 5.064E+00 1.448E+05 3 8 2.15104E+04 1.81856E-01 2.24220E-01 -9.840E-05 4.878E-02 1.418E+03 3 9 1.94271E+04 1.81856E-01 2.28763E-01 -4.620E-03 2.068E+00 8.165E+04 3 10 1.93615E+04 1.81856E-01 2.28922E-01 -4.887E-05 2.181E-02 8.695E+02 3 11 1.81578E+04 1.81856E-01 2.32042E-01 -2.536E-03 1.061E+00 5.130E+04 3 12 1.81174E+04 1.81856E-01 2.32154E-01 -2.846E-05 1.188E-02 5.783E+02 3 13 1.73469E+04 1.81856E-01 2.34388E-01 -1.563E-03 6.248E-01 3.464E+04 4 1 1.72337E+04 1.89576E-01 1.36699E-01 1.367E-04 5.430E-02 3.070E+03 4 2 1.44691E+05 1.89576E-01 1.83278E-01 1.042E-01 3.474E+02 3.319E+04 4 3 6.15264E+04 1.89576E-01 2.04387E-01 -6.537E-10 9.269E-07 1.152E-03 4 4 5.88028E+04 1.89576E-01 2.05073E-01 -2.551E-01 3.457E+02 4.922E+05 4 5 3.37094E+04 1.89576E-01 2.16609E-01 -2.366E-07 1.838E-04 1.389E+00 4 6 3.32325E+04 1.89576E-01 2.16997E-01 -3.253E-02 2.491E+01 1.965E+05 4 7 2.64880E+04 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2.32059E-01 4.846E-06 5.615E-02 2.717E-01 19 10 Infinity 2.34389E-01 2.34389E-01 NaN Infinity NaN 1 3 1 1 4 0 :isi,li,ipi,isj,lj,ipj 13 10 130 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 2.01813E+04 1.36699E-01 1.81853E-01 -8.221E-01 3.824E+02 1.047E+07 1 2 1.34665E+04 1.36699E-01 2.04368E-01 -1.067E-01 3.311E+01 3.052E+06 1 3 1.14052E+04 1.36699E-01 2.16598E-01 -3.411E-02 8.966E+00 1.360E+06 1 4 1.14034E+04 1.36699E-01 2.16611E-01 -1.941E-05 5.102E-03 7.745E+02 1 5 1.04416E+04 1.36699E-01 2.23972E-01 -1.556E-02 3.743E+00 7.402E+05 1 6 1.04405E+04 1.36699E-01 2.23981E-01 -1.094E-05 2.633E-03 5.208E+02 1 7 9.89873E+03 1.36699E-01 2.28758E-01 -8.551E-03 1.951E+00 4.527E+05 1 8 9.89808E+03 1.36699E-01 2.28764E-01 -5.893E-06 1.344E-03 3.120E+02 1 9 9.55808E+03 1.36699E-01 2.32039E-01 -5.269E-03 1.160E+00 2.992E+05 1 10 9.55768E+03 1.36699E-01 2.32043E-01 -3.571E-06 7.866E-04 2.028E+02 2 1 6.39487E+05 1.83278E-01 1.81853E-01 4.049E-02 7.672E+02 8.490E+02 2 2 4.32085E+04 1.83278E-01 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5.497E+03 1.791E+05 7 9 1.13060E+05 2.23979E-01 2.32039E-01 -6.694E-06 1.744E-02 2.717E+00 7 10 1.13004E+05 2.23979E-01 2.32043E-01 -2.619E-01 6.819E+02 1.064E+05 8 1 2.15089E+04 2.24220E-01 1.81853E-01 2.531E-04 1.613E-01 4.692E+03 8 2 4.59030E+04 2.24220E-01 2.04368E-01 2.086E-03 2.836E+00 8.488E+03 8 3 1.19558E+05 2.24220E-01 2.16598E-01 1.940E-02 6.872E+01 1.164E+04 8 4 1.19762E+05 2.24220E-01 2.16611E-01 9.667E-06 3.430E-02 5.780E+00 8 5 3.67446E+06 2.24220E-01 2.23972E-01 1.264E-01 1.377E+04 8.031E+01 8 6 3.81284E+06 2.24220E-01 2.23981E-01 6.163E-05 6.963E+00 3.636E-02 8 7 2.00807E+05 2.24220E-01 2.28758E-01 -7.796E-01 3.608E+03 1.003E+05 8 8 2.00543E+05 2.24220E-01 2.28764E-01 -2.967E-04 1.371E+00 3.827E+01 8 9 1.16545E+05 2.24220E-01 2.32039E-01 -1.757E-01 4.719E+02 6.711E+04 8 10 1.16486E+05 2.24220E-01 2.32043E-01 -7.027E-05 1.886E-01 2.687E+01 9 1 1.94259E+04 2.28763E-01 1.81853E-01 1.881E-04 1.083E-01 4.275E+03 9 2 3.73547E+04 2.28763E-01 2.04368E-01 5.991E-04 6.631E-01 3.682E+03 9 3 7.49090E+04 2.28763E-01 2.16598E-01 1.691E-03 3.753E+00 2.584E+03 9 4 7.49891E+04 2.28763E-01 2.16611E-01 8.301E-04 1.844E+00 1.266E+03 9 5 1.90204E+05 2.28763E-01 2.23972E-01 7.131E-03 4.019E+01 1.690E+03 9 6 1.90562E+05 2.28763E-01 2.23981E-01 1.531E-02 8.645E+01 3.616E+03 9 7 1.82550E+08 2.28763E-01 2.28758E-01 2.942E-05 1.591E+02 7.571E-06 9 8 9.12748E+08 2.28763E-01 2.28764E-01 -1.056E-03 2.222E+04 6.578E-06 9 9 2.78164E+05 2.28763E-01 2.32039E-01 -2.164E-06 1.387E-02 1.451E-01 9 10 2.77825E+05 2.28763E-01 2.32043E-01 -1.203E+00 7.699E+03 8.082E+04 10 1 1.93602E+04 2.28922E-01 1.81853E-01 1.232E-04 7.068E-02 2.819E+03 10 2 3.71128E+04 2.28922E-01 2.04368E-01 7.769E-04 8.543E-01 4.837E+03 10 3 7.39425E+04 2.28922E-01 2.16598E-01 4.067E-03 8.909E+00 6.378E+03 10 4 7.40206E+04 2.28922E-01 2.16611E-01 2.019E-06 4.428E-03 3.160E+00 10 5 1.84094E+05 2.28922E-01 2.23972E-01 3.017E-02 1.645E+02 7.633E+03 10 6 1.84430E+05 2.28922E-01 2.23981E-01 1.704E-05 9.314E-02 4.297E+00 10 7 5.55694E+06 2.28922E-01 2.28758E-01 1.510E-01 2.486E+04 4.193E+01 10 8 5.76762E+06 2.28922E-01 2.28764E-01 6.426E-05 1.098E+01 1.656E-02 10 9 2.92353E+05 2.28922E-01 2.32039E-01 -8.040E-01 5.417E+03 4.880E+04 10 10 2.91979E+05 2.28922E-01 2.32043E-01 -2.617E-04 1.761E+00 1.593E+01 11 1 1.81567E+04 2.32042E-01 1.81853E-01 1.036E-04 5.573E-02 2.695E+03 11 2 3.29286E+04 2.32042E-01 2.04368E-01 2.952E-04 2.880E-01 2.335E+03 11 3 5.90046E+04 2.32042E-01 2.16598E-01 6.764E-04 1.183E+00 1.666E+03 11 4 5.90543E+04 2.32042E-01 2.16611E-01 2.588E-04 4.528E-01 6.363E+02 11 5 1.12920E+05 2.32042E-01 2.23972E-01 1.716E-03 5.740E+00 1.154E+03 11 6 1.13046E+05 2.32042E-01 2.23981E-01 2.454E-03 8.221E+00 1.647E+03 11 7 2.77488E+05 2.32042E-01 2.28758E-01 6.927E-03 5.695E+01 7.714E+02 11 8 2.77995E+05 2.32042E-01 2.28764E-01 2.783E-02 2.293E+02 3.089E+03 11 9 3.04249E+08 2.32042E-01 2.32039E-01 3.532E-05 3.184E+02 3.272E-06 11 10 9.12748E+08 2.32042E-01 2.32043E-01 -1.511E-03 3.179E+04 9.411E-06 12 1 1.81163E+04 2.32154E-01 1.81853E-01 7.046E-05 3.782E-02 1.841E+03 12 2 3.27959E+04 2.32154E-01 2.04368E-01 3.824E-04 3.716E-01 3.049E+03 12 3 5.85798E+04 2.32154E-01 2.16598E-01 1.546E-03 2.683E+00 3.862E+03 12 4 5.86288E+04 2.32154E-01 2.16611E-01 7.636E-07 1.326E-03 1.905E+00 12 5 1.11375E+05 2.32154E-01 2.23972E-01 6.512E-03 2.149E+01 4.502E+03 12 6 1.11497E+05 2.32154E-01 2.23981E-01 3.673E-06 1.214E-02 2.534E+00 12 7 2.68336E+05 2.32154E-01 2.28758E-01 4.220E-02 3.355E+02 5.026E+03 12 8 2.68810E+05 2.32154E-01 2.28764E-01 2.119E-05 1.688E-01 2.515E+00 12 9 7.92460E+06 2.32154E-01 2.32039E-01 1.748E-01 4.104E+04 2.387E+01 12 10 8.20971E+06 2.32154E-01 2.32043E-01 6.536E-05 1.590E+01 8.315E-03 13 1 1.73459E+04 2.34388E-01 1.81853E-01 6.401E-05 3.290E-02 1.824E+03 13 2 3.03553E+04 2.34388E-01 2.04368E-01 1.703E-04 1.532E-01 1.585E+03 13 3 5.12236E+04 2.34388E-01 2.16598E-01 3.488E-04 5.293E-01 1.140E+03 13 4 5.12610E+04 2.34388E-01 2.16611E-01 1.137E-04 1.726E-01 3.710E+02 13 5 8.74872E+04 2.34388E-01 2.23972E-01 7.157E-04 1.855E+00 8.018E+02 13 6 8.75629E+04 2.34388E-01 2.23981E-01 8.043E-04 2.087E+00 8.996E+02 13 7 1.61860E+05 2.34388E-01 2.28758E-01 1.731E-03 8.302E+00 5.666E+02 13 8 1.62032E+05 2.34388E-01 2.28764E-01 4.763E-03 2.287E+01 1.556E+03 13 9 3.87940E+05 2.34388E-01 2.32039E-01 6.852E-03 7.876E+01 3.904E+02 13 10 3.88601E+05 2.34388E-01 2.32043E-01 4.266E-02 4.911E+02 2.422E+03 1 4 0 1 4 1 :isi,li,ipi,isj,lj,ipj 10 10 100 : ni,nj,ntrs/i,j,wl(A),Ei(Ry),Ej(Ry),f,S,A(/s) 1 1 1.92462E+04 1.81853E-01 1.34505E-01 1.230E-01 7.014E+01 2.215E+06 1 2 2.24452E+06 1.81853E-01 1.82259E-01 -2.388E-03 1.588E+02 3.161E+00 1 3 4.04397E+04 1.81853E-01 2.04387E-01 -1.848E-01 2.214E+02 7.536E+05 1 4 4.01722E+04 1.81853E-01 2.04537E-01 -1.352E-03 1.610E+00 5.589E+03 1 5 2.62190E+04 1.81853E-01 2.16609E-01 -2.510E-02 1.950E+01 2.435E+05 1 6 2.61633E+04 1.81853E-01 2.16683E-01 -2.618E-04 2.029E-01 2.551E+03 1 7 2.16104E+04 1.81853E-01 2.24021E-01 -9.800E-05 6.275E-02 1.400E+03 1 8 1.94151E+04 1.81853E-01 2.28789E-01 -4.874E-05 2.804E-02 8.625E+02 1 9 1.81506E+04 1.81853E-01 2.32059E-01 -2.836E-05 1.525E-02 5.741E+02 1 10 1.73456E+04 1.81853E-01 2.34389E-01 -2.688E-06 1.381E-03 5.958E+01 2 1 1.30436E+04 2.04368E-01 1.34505E-01 1.783E-02 6.892E+00 6.991E+05 2 2 4.12170E+04 2.04368E-01 1.82259E-01 1.097E-01 1.339E+02 4.306E+05 2 3 4.79640E+07 2.04368E-01 2.04387E-01 -2.468E-04 3.507E+02 7.155E-04 2 4 5.39183E+06 2.04368E-01 2.04537E-01 -3.266E-03 5.217E+02 7.492E-01 2 5 7.44438E+04 2.04368E-01 2.16609E-01 -1.623E-01 3.581E+02 1.954E+05 2 6 7.39965E+04 2.04368E-01 2.16683E-01 -3.686E-03 8.080E+00 4.489E+03 2 7 4.63678E+04 2.04368E-01 2.24021E-01 -7.363E-04 1.012E+00 2.284E+03 2 8 3.73149E+04 2.04368E-01 2.28789E-01 -2.787E-04 3.081E-01 1.335E+03 2 9 3.29084E+04 2.04368E-01 2.32059E-01 -1.393E-04 1.359E-01 8.581E+02 2 10 3.03543E+04 2.04368E-01 2.34389E-01 -7.123E-06 6.407E-03 5.157E+01 3 1 1.11004E+04 2.16598E-01 1.34505E-01 5.976E-03 1.965E+00 3.235E+05 3 2 2.65374E+04 2.16598E-01 1.82259E-01 2.209E-02 1.737E+01 2.092E+05 3 3 7.46267E+04 2.16598E-01 2.04387E-01 2.079E-03 4.597E+00 2.490E+03 3 4 7.55549E+04 2.16598E-01 2.04537E-01 1.045E-01 2.339E+02 1.221E+05 3 5 8.28646E+07 2.16598E-01 2.16609E-01 -4.782E-04 1.174E+03 4.645E-04 3 6 1.07213E+07 2.16598E-01 2.16683E-01 -4.437E-03 1.409E+03 2.574E-01 3 7 1.22763E+05 2.16598E-01 2.24021E-01 -6.654E-03 2.420E+01 2.945E+03 3 8 7.47492E+04 2.16598E-01 2.28789E-01 -1.368E-03 3.029E+00 1.633E+03 3 9 5.89397E+04 2.16598E-01 2.32059E-01 -5.240E-04 9.151E-01 1.006E+03 3 10 5.12207E+04 2.16598E-01 2.34389E-01 -8.652E-06 1.313E-02 2.200E+01 4 1 1.10987E+04 2.16611E-01 1.34505E-01 3.379E-06 1.111E-03 1.830E+02 4 2 2.65273E+04 2.16611E-01 1.82259E-01 1.260E-05 9.903E-03 1.194E+02 4 3 7.45474E+04 2.16611E-01 2.04387E-01 1.911E-01 4.221E+02 2.294E+05 4 4 7.54735E+04 2.16611E-01 2.04537E-01 4.408E-05 9.857E-02 5.161E+01 4 5 4.56374E+08 2.16611E-01 2.16609E-01 3.507E-05 4.742E+02 1.123E-06 4 6 1.26561E+07 2.16611E-01 2.16683E-01 -1.643E-06 6.162E-01 6.843E-05 4 7 1.22978E+05 2.16611E-01 2.24021E-01 -3.187E-06 1.161E-02 1.405E+00 4 8 7.48289E+04 2.16611E-01 2.28789E-01 -6.549E-07 1.452E-03 7.801E-01 4 9 5.89893E+04 2.16611E-01 2.32059E-01 -2.508E-07 4.383E-04 4.807E-01 4 10 5.12581E+04 2.16611E-01 2.34389E-01 -1.624E-03 2.467E+00 4.124E+03 5 1 1.01855E+04 2.23972E-01 1.34505E-01 2.797E-03 8.440E-01 1.798E+05 5 2 2.18461E+04 2.23972E-01 1.82259E-01 8.443E-03 5.465E+00 1.180E+05 5 3 4.65288E+04 2.23972E-01 2.04387E-01 3.263E-04 4.499E-01 1.005E+03 5 4 4.68880E+04 2.23972E-01 2.04537E-01 2.367E-02 3.288E+01 7.180E+04 5 5 1.23763E+05 2.23972E-01 2.16609E-01 4.722E-03 1.732E+01 2.056E+03 5 6 1.25020E+05 2.23972E-01 2.16683E-01 1.033E-01 3.827E+02 4.409E+04 5 7 1.85935E+07 2.23972E-01 2.24021E-01 -5.146E-03 2.835E+03 9.927E-02 5 8 1.89177E+05 2.23972E-01 2.28789E-01 -1.006E-02 5.639E+01 1.875E+03 5 9 1.12683E+05 2.23972E-01 2.32059E-01 -2.112E-03 7.052E+00 1.110E+03 5 10 8.74787E+04 2.23972E-01 2.34389E-01 -1.228E-05 3.182E-02 1.070E+01 6 1 1.01845E+04 2.23981E-01 1.34505E-01 1.951E-06 5.888E-04 1.255E+02 6 2 2.18414E+04 2.23981E-01 1.82259E-01 5.959E-06 3.856E-03 8.331E+01 6 3 4.65075E+04 2.23981E-01 2.04387E-01 2.299E-02 3.168E+01 7.089E+04 6 4 4.68663E+04 2.23981E-01 2.04537E-01 1.386E-05 1.924E-02 4.207E+01 6 5 1.23612E+05 2.23981E-01 2.16609E-01 1.694E-01 6.206E+02 7.396E+04 6 6 1.24865E+05 2.23981E-01 2.16683E-01 4.122E-05 1.525E-01 1.763E+01 6 7 2.27762E+07 2.23981E-01 2.24021E-01 -1.977E-06 1.334E+00 2.541E-05 6 8 1.89531E+05 2.23981E-01 2.28789E-01 -5.376E-06 3.019E-02 9.981E-01 6 9 1.12808E+05 2.23981E-01 2.32059E-01 -1.136E-06 3.795E-03 5.952E-01 6 10 8.75544E+04 2.23981E-01 2.34389E-01 -6.498E-03 1.686E+01 5.654E+03 7 1 9.66831E+03 2.28758E-01 1.34505E-01 1.562E-03 4.475E-01 1.115E+05 7 2 1.95976E+04 2.28758E-01 1.82259E-01 4.241E-03 2.463E+00 7.365E+04 7 3 3.73914E+04 2.28758E-01 2.04387E-01 1.060E-04 1.174E-01 5.057E+02 7 4 3.76230E+04 2.28758E-01 2.04537E-01 9.613E-03 1.072E+01 4.530E+04 7 5 7.50075E+04 2.28758E-01 2.16609E-01 8.192E-04 1.821E+00 9.712E+02 7 6 7.54672E+04 2.28758E-01 2.16683E-01 2.469E-02 5.520E+01 2.891E+04 7 7 1.92372E+05 2.28758E-01 2.24021E-01 1.043E-01 5.945E+02 1.880E+04 7 8 2.94010E+07 2.28758E-01 2.28789E-01 -5.806E-03 5.057E+03 4.480E-02 7 9 2.76058E+05 2.28758E-01 2.32059E-01 -1.378E-02 1.127E+02 1.206E+03 7 10 1.61830E+05 2.28758E-01 2.34389E-01 -2.404E-05 1.153E-01 6.124E+00 8 1 9.66769E+03 2.28764E-01 1.34505E-01 1.066E-06 3.053E-04 7.605E+01 8 2 1.95950E+04 2.28764E-01 1.82259E-01 2.936E-06 1.704E-03 5.099E+01 8 3 3.73822E+04 2.28764E-01 2.04387E-01 6.829E-03 7.564E+00 3.259E+04 8 4 3.76137E+04 2.28764E-01 2.04537E-01 5.677E-06 6.326E-03 2.676E+01 8 5 7.49706E+04 2.28764E-01 2.16609E-01 3.021E-02 6.711E+01 3.585E+04 8 6 7.54298E+04 2.28764E-01 2.16683E-01 1.059E-05 2.367E-02 1.242E+01 8 7 1.92129E+05 2.28764E-01 2.24021E-01 3.221E-05 1.834E-01 5.820E+00 8 8 3.64446E+07 2.28764E-01 2.28789E-01 -1.837E-06 1.983E+00 9.223E-06 8 9 2.76560E+05 2.28764E-01 2.32059E-01 -6.450E-06 5.285E-02 5.625E-01 8 10 1.62003E+05 2.28764E-01 2.34389E-01 -2.181E-02 1.047E+02 5.543E+03 9 1 9.34307E+03 2.32039E-01 1.34505E-01 9.731E-04 2.694E-01 7.435E+04 9 2 1.83059E+04 2.32039E-01 1.82259E-01 2.478E-03 1.344E+00 4.932E+04 9 3 3.29548E+04 2.32039E-01 2.04387E-01 4.772E-05 4.660E-02 2.931E+02 9 4 3.31346E+04 2.32039E-01 2.04537E-01 5.012E-03 4.921E+00 3.045E+04 9 5 5.90581E+04 2.32039E-01 2.16609E-01 2.817E-04 4.929E-01 5.386E+02 9 6 5.93427E+04 2.32039E-01 2.16683E-01 1.035E-02 1.819E+01 1.960E+04 9 7 1.13653E+05 2.32039E-01 2.24021E-01 2.559E-02 8.617E+01 1.321E+04 9 8 2.80390E+05 2.32039E-01 2.28789E-01 1.066E-01 8.852E+02 9.040E+03 9 9 4.55694E+07 2.32039E-01 2.32059E-01 -6.447E-03 8.704E+03 2.071E-02 9 10 3.87773E+05 2.32039E-01 2.34389E-01 -8.664E-05 9.955E-01 3.843E+00 10 1 9.34269E+03 2.32043E-01 1.34505E-01 6.520E-07 1.805E-04 4.982E+01 10 2 1.83044E+04 2.32043E-01 1.82259E-01 1.688E-06 9.154E-04 3.360E+01 10 3 3.29501E+04 2.32043E-01 2.04387E-01 2.954E-03 2.884E+00 1.815E+04 10 4 3.31298E+04 2.32043E-01 2.04537E-01 2.957E-06 2.902E-03 1.797E+01 10 5 5.90428E+04 2.32043E-01 2.16609E-01 1.058E-02 1.851E+01 2.024E+04 10 6 5.93273E+04 2.32043E-01 2.16683E-01 4.574E-06 8.041E-03 8.669E+00 10 7 1.13596E+05 2.32043E-01 2.24021E-01 8.429E-06 2.837E-02 4.357E+00 10 8 2.80046E+05 2.32043E-01 2.28789E-01 2.692E-05 2.234E-01 2.290E+00 10 9 5.69405E+07 2.32043E-01 2.32059E-01 -1.733E-06 2.924E+00 3.566E-06 10 10 3.88433E+05 2.32043E-01 2.34389E-01 -1.049E-01 1.207E+03 4.637E+03 0 0 0 0 0 0 :isi,li,ipi,isj,lj,ipj 4713 : total number of transitions, 632 : total bound-bound