Stage_1/0.005_+e1 OSZICAR.out output for 744: XXX MT amorphous(poly(oxydiphenylene_pyromellitide)) from job 738 (test-3)

Status: finished
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1     0.397179398472E+04    0.39718E+04   -0.28903E+05   890   0.112E+03 
DAV:   2    -0.104808021516E+04   -0.50199E+04   -0.48388E+04  1132   0.299E+02 
DAV:   3    -0.152522969605E+04   -0.47715E+03   -0.47190E+03  1036   0.977E+01 
DAV:   4    -0.153748570010E+04   -0.12256E+02   -0.12203E+02  1092   0.168E+01 
DAV:   5    -0.153786738635E+04   -0.38169E+00   -0.38103E+00  1108   0.279E+00    0.624E+01
DAV:   6    -0.144818517705E+04    0.89682E+02   -0.17374E+02   996   0.197E+01    0.340E+01
DAV:   7    -0.143045214567E+04    0.17733E+02   -0.47876E+01  1060   0.114E+01    0.159E+01
DAV:   8    -0.142861310622E+04    0.18390E+01   -0.10629E+01  1036   0.498E+00    0.578E+00
DAV:   9    -0.142856182312E+04    0.51283E-01   -0.12661E+00  1044   0.235E+00    0.195E+00
DAV:  10    -0.142856013454E+04    0.16886E-02   -0.33656E-01   980   0.113E+00    0.618E-01
DAV:  11    -0.142856679792E+04   -0.66634E-02   -0.61152E-02  1028   0.455E-01    0.340E-01
DAV:  12    -0.142856803126E+04   -0.12333E-02   -0.96672E-03   988   0.237E-01    0.192E-01
DAV:  13    -0.142856673807E+04    0.12932E-02   -0.39362E-03  1004   0.179E-01    0.117E-01
DAV:  14    -0.142856519039E+04    0.15477E-02   -0.22486E-03  1028   0.128E-01    0.630E-02
DAV:  15    -0.142856461080E+04    0.57959E-03   -0.10000E-03  1044   0.788E-02    0.376E-02
DAV:  16    -0.142856445451E+04    0.15629E-03   -0.25072E-04  1132   0.415E-02    0.243E-02
DAV:  17    -0.142856439876E+04    0.55748E-04   -0.38589E-05   956   0.238E-02    0.123E-02
DAV:  18    -0.142856436847E+04    0.30290E-04   -0.84549E-06   820   0.225E-02    0.678E-03
DAV:  19    -0.142856435983E+04    0.86381E-05   -0.39264E-05   988   0.168E-02 
   1 F= -.14285644E+04 E0= -.14285813E+04  d E =-.142856E+04
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142839127999E+04    0.17309E+00   -0.20829E+01   916   0.763E+00    0.137E+00
DAV:   2    -0.142844335611E+04   -0.52076E-01   -0.76491E-01  1068   0.128E+00    0.815E-01
DAV:   3    -0.142843343366E+04    0.99224E-02   -0.24000E-02  1028   0.300E-01    0.486E-01
DAV:   4    -0.142843097254E+04    0.24611E-02   -0.13966E-02  1020   0.222E-01    0.172E-01
DAV:   5    -0.142843095297E+04    0.19570E-04   -0.27889E-03  1076   0.102E-01    0.866E-02
DAV:   6    -0.142843092183E+04    0.31147E-04   -0.55259E-04  1012   0.461E-02    0.399E-02
DAV:   7    -0.142843089125E+04    0.30579E-04   -0.11021E-04  1028   0.216E-02    0.211E-02
DAV:   8    -0.142843087869E+04    0.12557E-04   -0.30154E-05   868   0.139E-02    0.812E-03
DAV:   9    -0.142843087211E+04    0.65863E-05   -0.81626E-06   652   0.963E-03 
   2 F= -.14284309E+04 E0= -.14284468E+04  d E =0.133488E+00
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142855551430E+04   -0.12464E+00   -0.11863E+01   908   0.578E+00    0.103E+00
DAV:   2    -0.142858684884E+04   -0.31335E-01   -0.45847E-01  1068   0.977E-01    0.629E-01
DAV:   3    -0.142858110768E+04    0.57412E-02   -0.13306E-02  1036   0.224E-01    0.390E-01
DAV:   4    -0.142857952334E+04    0.15843E-02   -0.90583E-03  1012   0.175E-01    0.137E-01
DAV:   5    -0.142857951892E+04    0.44119E-05   -0.17045E-03  1036   0.795E-02    0.681E-02
DAV:   6    -0.142857950206E+04    0.16866E-04   -0.37081E-04  1028   0.369E-02    0.314E-02
DAV:   7    -0.142857948383E+04    0.18232E-04   -0.63562E-05  1004   0.165E-02    0.169E-02
DAV:   8    -0.142857947809E+04    0.57379E-05   -0.21155E-05   724   0.906E-03 
   3 F= -.14285795E+04 E0= -.14285959E+04  d E =-.151183E-01
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142859018396E+04   -0.10700E-01   -0.48325E+00   890   0.379E+00    0.625E-01
DAV:   2    -0.142859857657E+04   -0.83926E-02   -0.12890E-01  1028   0.568E-01    0.435E-01
DAV:   3    -0.142859664888E+04    0.19277E-02   -0.56749E-03  1028   0.164E-01    0.272E-01
DAV:   4    -0.142859635814E+04    0.29074E-03   -0.50029E-03  1004   0.121E-01    0.991E-02
DAV:   5    -0.142859631881E+04    0.39323E-04   -0.53909E-04  1116   0.515E-02    0.492E-02
DAV:   6    -0.142859631312E+04    0.56919E-05   -0.16816E-04  1036   0.254E-02    0.246E-02
DAV:   7    -0.142859630825E+04    0.48730E-05   -0.32859E-05   788   0.128E-02 
   4 F= -.14285963E+04 E0= -.14286125E+04  d E =-.168302E-01
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142859809154E+04   -0.17784E-02   -0.30523E-01   900   0.952E-01    0.157E-01
DAV:   2    -0.142859859610E+04   -0.50456E-03   -0.81052E-03  1028   0.142E-01    0.109E-01
DAV:   3    -0.142859847086E+04    0.12524E-03   -0.35003E-04  1028   0.409E-02    0.685E-02
DAV:   4    -0.142859845106E+04    0.19804E-04   -0.31293E-04  1004   0.302E-02    0.249E-02
DAV:   5    -0.142859844757E+04    0.34912E-05   -0.31532E-05   788   0.127E-02 
   5 F= -.14285984E+04 E0= -.14286147E+04  d E =-.189695E-01
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142857623577E+04    0.22215E-01   -0.53234E+00   890   0.395E+00    0.616E-01
DAV:   2    -0.142858569137E+04   -0.94556E-02   -0.14904E-01  1052   0.581E-01    0.367E-01
DAV:   3    -0.142858401132E+04    0.16800E-02   -0.54983E-03  1044   0.147E-01    0.220E-01
DAV:   4    -0.142858375844E+04    0.25288E-03   -0.29772E-03  1020   0.997E-02    0.848E-02
DAV:   5    -0.142858376454E+04   -0.60963E-05   -0.47330E-04  1044   0.452E-02    0.360E-02
DAV:   6    -0.142858375944E+04    0.50997E-05   -0.73827E-05  1004   0.173E-02 
   6 F= -.14285838E+04 E0= -.14286004E+04  d E =0.146881E-01
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860121086E+04   -0.17446E-01   -0.22437E+00   890   0.257E+00    0.400E-01
DAV:   2    -0.142860518940E+04   -0.39785E-02   -0.63938E-02  1052   0.378E-01    0.240E-01
DAV:   3    -0.142860446289E+04    0.72651E-03   -0.22884E-03  1044   0.955E-02    0.146E-01
DAV:   4    -0.142860435355E+04    0.10934E-03   -0.12925E-03  1036   0.642E-02    0.565E-02
DAV:   5    -0.142860435930E+04   -0.57527E-05   -0.19664E-04  1036   0.288E-02    0.232E-02
DAV:   6    -0.142860435749E+04    0.18179E-05   -0.28784E-05   740   0.105E-02 
   7 F= -.14286044E+04 E0= -.14286209E+04  d E =-.590992E-02
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860483811E+04   -0.47881E-03   -0.52366E-01   900   0.126E+00    0.174E-01
DAV:   2    -0.142860599632E+04   -0.11582E-02   -0.15160E-02  1052   0.189E-01    0.112E-01
DAV:   3    -0.142860588144E+04    0.11488E-03   -0.58682E-04  1068   0.447E-02    0.676E-02
DAV:   4    -0.142860584180E+04    0.39644E-04   -0.21612E-04  1020   0.302E-02    0.230E-02
DAV:   5    -0.142860583996E+04    0.18373E-05   -0.44164E-05   892   0.142E-02 
   8 F= -.14286058E+04 E0= -.14286222E+04  d E =-.148247E-02
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860611531E+04   -0.27352E-03   -0.49778E-02   900   0.387E-01    0.532E-02
DAV:   2    -0.142860621759E+04   -0.10227E-03   -0.14169E-03  1052   0.582E-02    0.348E-02
DAV:   3    -0.142860620621E+04    0.11377E-04   -0.60638E-05  1044   0.141E-02    0.210E-02
DAV:   4    -0.142860620206E+04    0.41515E-05   -0.18377E-05   604   0.914E-03 
   9 F= -.14286062E+04 E0= -.14286226E+04  d E =-.184457E-02
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860664297E+04   -0.43676E-03   -0.46923E-01   900   0.118E+00    0.156E-01
DAV:   2    -0.142860753736E+04   -0.89440E-03   -0.11571E-02  1036   0.161E-01    0.103E-01
DAV:   3    -0.142860746006E+04    0.77299E-04   -0.42182E-04  1060   0.389E-02    0.632E-02
DAV:   4    -0.142860743912E+04    0.20944E-04   -0.16028E-04  1020   0.256E-02    0.229E-02
DAV:   5    -0.142860743939E+04   -0.26762E-06   -0.35827E-05   812   0.126E-02 
  10 F= -.14286074E+04 E0= -.14286238E+04  d E =-.123733E-02
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860751907E+04   -0.79949E-04   -0.24498E-02   900   0.270E-01    0.351E-02
DAV:   2    -0.142860756209E+04   -0.43020E-04   -0.59399E-04  1036   0.368E-02    0.240E-02
DAV:   3    -0.142860755705E+04    0.50374E-05   -0.22075E-05   668   0.915E-03 
  11 F= -.14286076E+04 E0= -.14286239E+04  d E =-.135499E-02
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860753179E+04    0.30297E-04   -0.42401E-01   890   0.112E+00    0.149E-01
DAV:   2    -0.142860844592E+04   -0.91413E-03   -0.11185E-02  1028   0.158E-01    0.886E-02
DAV:   3    -0.142860839488E+04    0.51044E-04   -0.34651E-04  1052   0.346E-02    0.543E-02
DAV:   4    -0.142860838931E+04    0.55711E-05   -0.12058E-04  1012   0.222E-02    0.203E-02
DAV:   5    -0.142860839087E+04   -0.15657E-05   -0.26036E-05   724   0.112E-02 
  12 F= -.14286084E+04 E0= -.14286247E+04  d E =-.833822E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860843601E+04   -0.46702E-04   -0.24800E-02   900   0.270E-01    0.351E-02
DAV:   2    -0.142860848637E+04   -0.50357E-04   -0.64339E-04  1028   0.382E-02    0.221E-02
DAV:   3    -0.142860848250E+04    0.38645E-05   -0.20454E-05   692   0.861E-03 
  13 F= -.14286085E+04 E0= -.14286248E+04  d E =-.925451E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860879904E+04   -0.31267E-03   -0.19372E-01   900   0.741E-01    0.959E-02
DAV:   2    -0.142860918335E+04   -0.38432E-03   -0.47422E-03  1036   0.104E-01    0.575E-02
DAV:   3    -0.142860915791E+04    0.25442E-04   -0.13117E-04  1060   0.219E-02    0.349E-02
DAV:   4    -0.142860915417E+04    0.37423E-05   -0.58123E-05   988   0.155E-02 
  14 F= -.14286092E+04 E0= -.14286254E+04  d E =-.671663E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860915600E+04    0.19053E-05   -0.74335E-05   892   0.153E-02    0.648E-03
DAV:   2    -0.142860915581E+04    0.19006E-06   -0.42383E-06   508   0.419E-03 
  15 F= -.14286092E+04 E0= -.14286254E+04  d E =-.673310E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860943682E+04   -0.28082E-03   -0.15389E-01   890   0.655E-01    0.844E-02
DAV:   2    -0.142860973524E+04   -0.29842E-03   -0.36589E-03  1020   0.887E-02    0.514E-02
DAV:   3    -0.142860971891E+04    0.16334E-04   -0.10258E-04  1068   0.181E-02    0.305E-02
DAV:   4    -0.142860971604E+04    0.28687E-05   -0.31485E-05   788   0.126E-02 
  16 F= -.14286097E+04 E0= -.14286259E+04  d E =-.560225E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142860972531E+04   -0.64040E-05   -0.29513E-03   900   0.904E-02    0.142E-02
DAV:   2    -0.142860973047E+04   -0.51598E-05   -0.68628E-05   924   0.125E-02 
  17 F= -.14286097E+04 E0= -.14286260E+04  d E =-.574658E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861005439E+04   -0.32908E-03   -0.66873E-02   900   0.433E-01    0.570E-02
DAV:   2    -0.142861018304E+04   -0.12865E-03   -0.15739E-03  1028   0.583E-02    0.347E-02
DAV:   3    -0.142861017675E+04    0.62906E-05   -0.37436E-05   892   0.116E-02 
  18 F= -.14286102E+04 E0= -.14286264E+04  d E =-.446275E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861016645E+04    0.16589E-04   -0.15103E-01   890   0.650E-01    0.855E-02
DAV:   2    -0.142861044555E+04   -0.27910E-03   -0.34597E-03  1028   0.867E-02    0.514E-02
DAV:   3    -0.142861043323E+04    0.12319E-04   -0.91033E-05  1068   0.175E-02    0.303E-02
DAV:   4    -0.142861043206E+04    0.11680E-05   -0.34917E-05   828   0.131E-02 
  19 F= -.14286104E+04 E0= -.14286267E+04  d E =-.701589E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861065861E+04   -0.22538E-03   -0.10232E-01   900   0.537E-01    0.705E-02
DAV:   2    -0.142861085730E+04   -0.19869E-03   -0.24277E-03  1012   0.732E-02    0.421E-02
DAV:   3    -0.142861084757E+04    0.97351E-05   -0.66157E-05  1036   0.153E-02 
  20 F= -.14286108E+04 E0= -.14286271E+04  d E =-.415509E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861083465E+04    0.22651E-04   -0.70790E-02   890   0.446E-01    0.623E-02
DAV:   2    -0.142861095886E+04   -0.12420E-03   -0.15884E-03  1012   0.593E-02    0.379E-02
DAV:   3    -0.142861095264E+04    0.62178E-05   -0.51019E-05   988   0.132E-02 
  21 F= -.14286110E+04 E0= -.14286272E+04  d E =-.520580E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861119295E+04   -0.23409E-03   -0.10387E-01   890   0.543E-01    0.708E-02
DAV:   2    -0.142861137742E+04   -0.18448E-03   -0.22786E-03  1012   0.713E-02    0.448E-02
DAV:   3    -0.142861136753E+04    0.98903E-05   -0.62642E-05  1036   0.151E-02 
  22 F= -.14286114E+04 E0= -.14286276E+04  d E =-.414893E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861134912E+04    0.28304E-04   -0.90725E-02   890   0.507E-01    0.673E-02
DAV:   2    -0.142861150623E+04   -0.15711E-03   -0.19565E-03  1012   0.661E-02    0.425E-02
DAV:   3    -0.142861149810E+04    0.81230E-05   -0.55117E-05   996   0.141E-02 
  23 F= -.14286115E+04 E0= -.14286278E+04  d E =-.545463E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861171634E+04   -0.21012E-03   -0.13961E-01   890   0.627E-01    0.811E-02
DAV:   2    -0.142861196075E+04   -0.24440E-03   -0.30180E-03  1028   0.815E-02    0.514E-02
DAV:   3    -0.142861194714E+04    0.13602E-04   -0.77496E-05  1052   0.165E-02    0.296E-02
DAV:   4    -0.142861194792E+04   -0.77764E-06   -0.32826E-05   836   0.118E-02 
  24 F= -.14286119E+04 E0= -.14286282E+04  d E =-.449819E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861198550E+04   -0.38358E-04   -0.11038E-02   900   0.176E-01    0.235E-02
DAV:   2    -0.142861200692E+04   -0.21417E-04   -0.25022E-04  1028   0.235E-02    0.143E-02
DAV:   3    -0.142861200589E+04    0.10334E-05   -0.49597E-06   532   0.495E-03 
  25 F= -.14286120E+04 E0= -.14286282E+04  d E =-.507782E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861196161E+04    0.45310E-04   -0.43277E-02   890   0.349E-01    0.444E-02
DAV:   2    -0.142861203909E+04   -0.77482E-04   -0.94173E-04  1036   0.454E-02    0.282E-02
DAV:   3    -0.142861203464E+04    0.44487E-05   -0.20843E-05   708   0.908E-03 
  26 F= -.14286120E+04 E0= -.14286282E+04  d E =-.536539E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861219353E+04   -0.15444E-03   -0.99020E-02   890   0.527E-01    0.660E-02
DAV:   2    -0.142861236677E+04   -0.17324E-03   -0.21196E-03   996   0.684E-02    0.432E-02
DAV:   3    -0.142861235727E+04    0.95007E-05   -0.52405E-05   996   0.138E-02 
  27 F= -.14286124E+04 E0= -.14286285E+04  d E =-.322631E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861228796E+04    0.78817E-04   -0.13016E-01   890   0.605E-01    0.775E-02
DAV:   2    -0.142861250872E+04   -0.22076E-03   -0.27471E-03   996   0.781E-02    0.506E-02
DAV:   3    -0.142861249676E+04    0.11959E-04   -0.73105E-05  1044   0.161E-02    0.294E-02
DAV:   4    -0.142861249821E+04   -0.14486E-05   -0.31887E-05   812   0.118E-02 
  28 F= -.14286125E+04 E0= -.14286286E+04  d E =-.463569E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861274161E+04   -0.24485E-03   -0.75150E-02   890   0.461E-01    0.592E-02
DAV:   2    -0.142861288179E+04   -0.14018E-03   -0.17387E-03  1012   0.630E-02    0.388E-02
DAV:   3    -0.142861287229E+04    0.94934E-05   -0.43410E-05   924   0.133E-02 
  29 F= -.14286129E+04 E0= -.14286290E+04  d E =-.374081E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861283997E+04    0.41818E-04   -0.91503E-02   890   0.509E-01    0.680E-02
DAV:   2    -0.142861299455E+04   -0.15458E-03   -0.20108E-03  1020   0.682E-02    0.442E-02
DAV:   3    -0.142861298401E+04    0.10538E-04   -0.58268E-05  1036   0.147E-02    0.259E-02
DAV:   4    -0.142861298452E+04   -0.50456E-06   -0.28439E-05   756   0.109E-02 
  30 F= -.14286130E+04 E0= -.14286292E+04  d E =-.486305E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861314289E+04   -0.15888E-03   -0.60618E-02   900   0.413E-01    0.523E-02
DAV:   2    -0.142861325486E+04   -0.11197E-03   -0.13599E-03  1004   0.548E-02    0.336E-02
DAV:   3    -0.142861324797E+04    0.68925E-05   -0.29537E-05   852   0.112E-02 
  31 F= -.14286132E+04 E0= -.14286295E+04  d E =-.263450E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861294469E+04    0.31017E-03   -0.27763E-01   890   0.884E-01    0.112E-01
DAV:   2    -0.142861343060E+04   -0.48592E-03   -0.60409E-03  1004   0.115E-01    0.728E-02
DAV:   3    -0.142861340018E+04    0.30424E-04   -0.14884E-04  1052   0.236E-02    0.425E-02
DAV:   4    -0.142861340246E+04   -0.22809E-05   -0.74648E-05   996   0.175E-02 
  32 F= -.14286134E+04 E0= -.14286297E+04  d E =-.417943E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861335268E+04    0.47501E-04   -0.37488E-02   890   0.325E-01    0.384E-02
DAV:   2    -0.142861341781E+04   -0.65129E-04   -0.82762E-04   988   0.426E-02    0.263E-02
DAV:   3    -0.142861341216E+04    0.56445E-05   -0.17239E-05   676   0.830E-03 
  33 F= -.14286134E+04 E0= -.14286297E+04  d E =-.427646E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861364969E+04   -0.23189E-03   -0.40510E-02   890   0.338E-01    0.414E-02
DAV:   2    -0.142861372787E+04   -0.78175E-04   -0.96485E-04  1044   0.466E-02    0.280E-02
DAV:   3    -0.142861372066E+04    0.72073E-05   -0.22121E-05   700   0.971E-03 
  34 F= -.14286137E+04 E0= -.14286300E+04  d E =-.308498E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861375352E+04   -0.25648E-04   -0.33446E-02   890   0.307E-01    0.413E-02
DAV:   2    -0.142861380951E+04   -0.55995E-04   -0.72187E-04  1052   0.404E-02    0.271E-02
DAV:   3    -0.142861380446E+04    0.50528E-05   -0.18967E-05   660   0.898E-03 
  35 F= -.14286138E+04 E0= -.14286300E+04  d E =-.392296E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861397454E+04   -0.16502E-03   -0.43414E-02   890   0.348E-01    0.448E-02
DAV:   2    -0.142861404965E+04   -0.75120E-04   -0.92855E-04  1036   0.453E-02    0.290E-02
DAV:   3    -0.142861404433E+04    0.53294E-05   -0.21575E-05   716   0.968E-03 
  36 F= -.14286140E+04 E0= -.14286303E+04  d E =-.239866E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861401909E+04    0.30568E-04   -0.90812E-02   890   0.503E-01    0.647E-02
DAV:   2    -0.142861417534E+04   -0.15626E-03   -0.19366E-03  1036   0.654E-02    0.420E-02
DAV:   3    -0.142861416443E+04    0.10912E-04   -0.48426E-05   940   0.139E-02    0.244E-02
DAV:   4    -0.142861416468E+04   -0.25280E-06   -0.24077E-05   668   0.102E-02 
  37 F= -.14286142E+04 E0= -.14286304E+04  d E =-.360224E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861433118E+04   -0.16675E-03   -0.27473E-02   890   0.276E-01    0.354E-02
DAV:   2    -0.142861437959E+04   -0.48413E-04   -0.59452E-04   996   0.361E-02    0.226E-02
DAV:   3    -0.142861437634E+04    0.32473E-05   -0.12337E-05   620   0.747E-03 
  38 F= -.14286144E+04 E0= -.14286306E+04  d E =-.211661E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861428236E+04    0.97229E-04   -0.24502E-01   890   0.825E-01    0.104E-01
DAV:   2    -0.142861469877E+04   -0.41641E-03   -0.51846E-03   996   0.107E-01    0.676E-02
DAV:   3    -0.142861467056E+04    0.28206E-04   -0.12490E-04  1060   0.216E-02    0.391E-02
DAV:   4    -0.142861467147E+04   -0.90055E-06   -0.63196E-05   988   0.162E-02 
  39 F= -.14286147E+04 E0= -.14286308E+04  d E =-.506782E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861488415E+04   -0.21358E-03   -0.45869E-02   890   0.359E-01    0.466E-02
DAV:   2    -0.142861496725E+04   -0.83097E-04   -0.10233E-03  1028   0.478E-02    0.310E-02
DAV:   3    -0.142861496154E+04    0.57020E-05   -0.24214E-05   724   0.104E-02 
  40 F= -.14286150E+04 E0= -.14286311E+04  d E =-.290079E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861458549E+04    0.38176E-03   -0.31740E-01   890   0.946E-01    0.120E-01
DAV:   2    -0.142861513267E+04   -0.54718E-03   -0.68587E-03  1028   0.124E-01    0.810E-02
DAV:   3    -0.142861509415E+04    0.38525E-04   -0.18412E-04  1068   0.261E-02    0.477E-02
DAV:   4    -0.142861509280E+04    0.13429E-05   -0.89866E-05  1004   0.187E-02 
  41 F= -.14286151E+04 E0= -.14286313E+04  d E =-.421339E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861506090E+04    0.33245E-04   -0.58684E-02   890   0.407E-01    0.491E-02
DAV:   2    -0.142861516065E+04   -0.99748E-04   -0.12790E-03  1020   0.533E-02    0.343E-02
DAV:   3    -0.142861515195E+04    0.86987E-05   -0.32911E-05   868   0.109E-02 
  42 F= -.14286152E+04 E0= -.14286313E+04  d E =-.480486E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861533861E+04   -0.17796E-03   -0.61184E-02   890   0.414E-01    0.502E-02
DAV:   2    -0.142861545428E+04   -0.11567E-03   -0.14041E-03   996   0.553E-02    0.332E-02
DAV:   3    -0.142861544549E+04    0.87900E-05   -0.31566E-05   852   0.110E-02 
  43 F= -.14286154E+04 E0= -.14286316E+04  d E =-.293537E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861540423E+04    0.50044E-04   -0.13271E-01   890   0.609E-01    0.800E-02
DAV:   2    -0.142861562822E+04   -0.22398E-03   -0.28350E-03  1004   0.787E-02    0.515E-02
DAV:   3    -0.142861561227E+04    0.15947E-04   -0.78411E-05  1060   0.167E-02    0.292E-02
DAV:   4    -0.142861561193E+04    0.33883E-06   -0.31650E-05   828   0.120E-02 
  44 F= -.14286156E+04 E0= -.14286319E+04  d E =-.459978E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861578864E+04   -0.17637E-03   -0.68397E-02   890   0.436E-01    0.555E-02
DAV:   2    -0.142861590599E+04   -0.11736E-03   -0.14506E-03   988   0.562E-02    0.366E-02
DAV:   3    -0.142861589791E+04    0.80798E-05   -0.34421E-05   884   0.124E-02 
  45 F= -.14286159E+04 E0= -.14286322E+04  d E =-.285984E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861518408E+04    0.72191E-03   -0.61060E-01   890   0.130E+00    0.166E-01
DAV:   2    -0.142861618945E+04   -0.10054E-02   -0.12655E-02   988   0.166E-01    0.110E-01
DAV:   3    -0.142861611875E+04    0.70699E-04   -0.32483E-04  1076   0.360E-02    0.643E-02
DAV:   4    -0.142861612007E+04   -0.13222E-05   -0.16461E-04  1004   0.262E-02    0.177E-02
DAV:   5    -0.142861612038E+04   -0.31262E-06   -0.28240E-05   716   0.119E-02 
  46 F= -.14286161E+04 E0= -.14286324E+04  d E =-.508451E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861607368E+04    0.46387E-04   -0.55208E-02   890   0.392E-01    0.484E-02
DAV:   2    -0.142861616113E+04   -0.87444E-04   -0.11420E-03   972   0.501E-02    0.330E-02
DAV:   3    -0.142861615335E+04    0.77716E-05   -0.28960E-05   844   0.109E-02 
  47 F= -.14286162E+04 E0= -.14286324E+04  d E =-.541424E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861633173E+04   -0.17061E-03   -0.10412E-01   890   0.537E-01    0.649E-02
DAV:   2    -0.142861651741E+04   -0.18568E-03   -0.22742E-03   996   0.700E-02    0.428E-02
DAV:   3    -0.142861650416E+04    0.13249E-04   -0.50421E-05   948   0.143E-02    0.255E-02
DAV:   4    -0.142861650295E+04    0.12102E-05   -0.25951E-05   700   0.110E-02 
  48 F= -.14286165E+04 E0= -.14286328E+04  d E =-.349596E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861638961E+04    0.11455E-03   -0.24715E-01   890   0.826E-01    0.105E-01
DAV:   2    -0.142861681117E+04   -0.42156E-03   -0.52453E-03   996   0.106E-01    0.679E-02
DAV:   3    -0.142861678378E+04    0.27384E-04   -0.12650E-04  1068   0.222E-02    0.397E-02
DAV:   4    -0.142861678458E+04   -0.79185E-06   -0.63022E-05   988   0.167E-02 
  49 F= -.14286168E+04 E0= -.14286330E+04  d E =-.631222E-03
       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1    -0.142861702619E+04   -0.24241E-03   -0.92625E-02   890   0.506E-01    0.671E-02
DAV:   2    -0.142861718763E+04   -0.16144E-03   -0.20346E-03   996   0.670E-02    0.433E-02
DAV:   3    -0.142861717594E+04    0.11690E-04   -0.53480E-05   972   0.148E-02    0.256E-02
DAV:   4    -0.142861717594E+04   -0.30559E-08   -0.29435E-05   756   0.112E-02 
  50 F= -.14286172E+04 E0= -.14286334E+04  d E =-.391364E-03