iterations/neb0_image02_iter31_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422598324264E+04 0.42260E+04 -0.25384E+05 8992 0.103E+03
DAV: 2 -0.104204064421E+03 -0.43302E+04 -0.39246E+04 11024 0.248E+02
DAV: 3 -0.426669863392E+03 -0.32247E+03 -0.30128E+03 10216 0.657E+01
DAV: 4 -0.435199841388E+03 -0.85300E+01 -0.84296E+01 10792 0.107E+01
DAV: 5 -0.435491793117E+03 -0.29195E+00 -0.29119E+00 11200 0.194E+00 0.996E+01
RMM: 6 -0.388405788860E+03 0.47086E+02 -0.11021E+02 9695 0.145E+01 0.721E+01
RMM: 7 -0.768912574431E+03 -0.38051E+03 -0.40096E+02 11232 0.188E+01 0.145E+02
RMM: 8 -0.495331077112E+03 0.27358E+03 -0.10846E+02 10030 0.110E+01 0.903E+01
RMM: 9 -0.414153303691E+03 0.81178E+02 -0.67914E+01 10177 0.106E+01 0.561E+01
RMM: 10 -0.378198671156E+03 0.35955E+02 -0.38382E+01 10253 0.810E+00 0.336E+01
RMM: 11 -0.392742697401E+03 -0.14544E+02 -0.21807E+01 10388 0.544E+00 0.473E+01
RMM: 12 -0.375657723090E+03 0.17085E+02 -0.64349E+00 9911 0.350E+00 0.285E+01
RMM: 13 -0.373868536786E+03 0.17892E+01 -0.31593E+00 10203 0.234E+00 0.228E+01
RMM: 14 -0.373829934401E+03 0.38602E-01 -0.15580E+00 10255 0.164E+00 0.139E+01
RMM: 15 -0.378014059784E+03 -0.41841E+01 -0.11876E+00 10437 0.141E+00 0.143E+01
RMM: 16 -0.383215838461E+03 -0.52018E+01 -0.15453E+00 10734 0.162E+00 0.143E+01
RMM: 17 -0.386199156214E+03 -0.29833E+01 -0.13302E+00 10760 0.145E+00 0.105E+01
RMM: 18 -0.390510346581E+03 -0.43112E+01 -0.12961E+00 11018 0.133E+00 0.743E+00
RMM: 19 -0.393531657105E+03 -0.30213E+01 -0.63683E-01 10534 0.999E-01 0.720E+00
RMM: 20 -0.397677858952E+03 -0.41462E+01 -0.15132E+00 11688 0.137E+00 0.819E+00
RMM: 21 -0.399239066065E+03 -0.15612E+01 -0.49921E-01 10897 0.782E-01 0.809E+00
RMM: 22 -0.401195827528E+03 -0.19568E+01 -0.57495E-01 11327 0.770E-01 0.816E+00
RMM: 23 -0.404342825929E+03 -0.31470E+01 -0.14479E+00 12490 0.112E+00 0.748E+00
RMM: 24 -0.407514767628E+03 -0.31719E+01 -0.15112E+00 12913 0.108E+00 0.626E+00
RMM: 25 -0.408653972483E+03 -0.11392E+01 -0.11286E-01 10648 0.344E-01 0.594E+00
RMM: 26 -0.408794057308E+03 -0.14008E+00 -0.18317E-02 10916 0.122E-01 0.590E+00
RMM: 27 -0.408890351292E+03 -0.96294E-01 -0.46791E-03 10644 0.665E-02 0.591E+00
RMM: 28 -0.408057114899E+03 0.83324E+00 -0.11278E-01 14134 0.354E-01 0.568E+00
RMM: 29 -0.406444288686E+03 0.16128E+01 -0.51911E-01 16622 0.783E-01 0.523E+00
RMM: 30 -0.406540580027E+03 -0.96291E-01 -0.22595E-02 11915 0.173E-01 0.543E+00
RMM: 31 -0.410034173847E+03 -0.34936E+01 -0.11942E+00 17117 0.108E+00 0.591E+00
RMM: 32 -0.412392807111E+03 -0.23586E+01 -0.11998E+00 17378 0.101E+00 0.540E+00
RMM: 33 -0.414128103122E+03 -0.17353E+01 -0.33960E-01 16158 0.567E-01 0.759E+00
RMM: 34 -0.413956783906E+03 0.17132E+00 -0.23317E-02 11657 0.196E-01 0.876E+00
RMM: 35 -0.413697653019E+03 0.25913E+00 -0.37487E-02 11320 0.158E-01 0.664E+00
RMM: 36 -0.413928347317E+03 -0.23069E+00 -0.24707E-03 10524 0.783E-02 0.665E+00
RMM: 37 -0.413852063062E+03 0.76284E-01 -0.59994E-03 11486 0.780E-02 0.677E+00
RMM: 38 -0.413926821497E+03 -0.74758E-01 -0.90258E-03 11602 0.900E-02 0.651E+00
RMM: 39 -0.414658641788E+03 -0.73182E+00 -0.91005E-02 14960 0.222E-01 0.836E+00
RMM: 40 -0.414854334519E+03 -0.19569E+00 -0.10373E+00 17258 0.717E-01 0.532E+00
RMM: 41 -0.414064982576E+03 0.78935E+00 -0.14183E+00 17083 0.823E-01 0.529E+00
RMM: 42 -0.413913312463E+03 0.15167E+00 -0.12403E-01 15448 0.291E-01 0.506E+00
RMM: 43 -0.413695952921E+03 0.21736E+00 -0.10924E-01 15165 0.278E-01 0.503E+00
RMM: 44 -0.413276634297E+03 0.41932E+00 -0.96328E-02 15151 0.259E-01 0.490E+00
RMM: 45 -0.412708421897E+03 0.56821E+00 -0.15969E-01 16205 0.339E-01 0.443E+00
RMM: 46 -0.412167524755E+03 0.54090E+00 -0.13644E-01 15540 0.313E-01 0.421E+00
RMM: 47 -0.411573259504E+03 0.59427E+00 -0.25160E-01 16654 0.436E-01 0.661E+00
RMM: 48 -0.412795641379E+03 -0.12224E+01 -0.22899E-01 15163 0.419E-01 0.606E+00
RMM: 49 -0.413106772913E+03 -0.31113E+00 -0.92871E-02 13212 0.229E-01 0.576E+00
RMM: 50 -0.413756608070E+03 -0.64984E+00 -0.31246E-01 14430 0.395E-01 0.508E+00
RMM: 51 -0.414149599883E+03 -0.39299E+00 -0.21256E-01 17125 0.447E-01 0.473E+00
RMM: 52 -0.414664972122E+03 -0.51537E+00 -0.12306E-01 13480 0.273E-01 0.432E+00
RMM: 53 -0.414832076682E+03 -0.16710E+00 -0.41533E-02 13401 0.186E-01 0.425E+00
RMM: 54 -0.415016697384E+03 -0.18462E+00 -0.46087E-02 12536 0.178E-01 0.417E+00
RMM: 55 -0.415477143716E+03 -0.46045E+00 -0.41656E-01 14745 0.448E-01 0.378E+00
RMM: 56 -0.415612008341E+03 -0.13486E+00 -0.32413E-01 15823 0.403E-01 0.353E+00
RMM: 57 -0.415816769558E+03 -0.20476E+00 -0.13856E-01 14250 0.260E-01 0.264E+00
RMM: 58 -0.415860684416E+03 -0.43915E-01 -0.20974E-02 12167 0.109E-01 0.218E+00
RMM: 59 -0.415964863045E+03 -0.10418E+00 -0.27872E-02 13503 0.137E-01 0.166E+00
RMM: 60 -0.416149390739E+03 -0.18453E+00 -0.54434E-02 15211 0.200E-01 0.111E+00
RMM: 61 -0.416202827190E+03 -0.53436E-01 -0.18847E-02 12992 0.117E-01 0.107E+00
RMM: 62 -0.416292442103E+03 -0.89615E-01 -0.22637E-02 13879 0.136E-01 0.117E+00
RMM: 63 -0.416428995077E+03 -0.13655E+00 -0.47157E-03 12045 0.722E-02 0.103E+00
RMM: 64 -0.416577484974E+03 -0.14849E+00 -0.67933E-03 12304 0.863E-02 0.952E-01
RMM: 65 -0.416589525146E+03 -0.12040E-01 -0.16232E-02 13379 0.115E-01 0.857E-01
RMM: 66 -0.416609950497E+03 -0.20425E-01 -0.57612E-03 12110 0.713E-02 0.747E-01
RMM: 67 -0.416661581568E+03 -0.51631E-01 -0.57005E-03 11908 0.642E-02 0.584E-01
RMM: 68 -0.416707386112E+03 -0.45805E-01 -0.36489E-03 11707 0.501E-02 0.448E-01
RMM: 69 -0.416750219210E+03 -0.42833E-01 -0.24654E-03 11657 0.421E-02 0.360E-01
RMM: 70 -0.416789118089E+03 -0.38899E-01 -0.19789E-03 11606 0.394E-02 0.353E-01
RMM: 71 -0.416830961651E+03 -0.41844E-01 -0.17494E-03 11585 0.364E-02 0.372E-01
RMM: 72 -0.416870685669E+03 -0.39724E-01 -0.54893E-04 11057 0.232E-02 0.307E-01
RMM: 73 -0.416905768476E+03 -0.35083E-01 -0.88828E-04 11596 0.260E-02 0.211E-01
RMM: 74 -0.416938344069E+03 -0.32576E-01 -0.67961E-04 11516 0.227E-02 0.170E-01
RMM: 75 -0.416956668230E+03 -0.18324E-01 -0.51480E-04 11240 0.190E-02 0.134E-01
RMM: 76 -0.416960291531E+03 -0.36233E-02 -0.11864E-04 9740 0.107E-02 0.137E-01
RMM: 77 -0.416964591066E+03 -0.42995E-02 -0.10930E-04 9524 0.865E-03 0.117E-01
RMM: 78 -0.416965823619E+03 -0.12326E-02 -0.73387E-05 8482 0.729E-03 0.111E-01
RMM: 79 -0.416965981225E+03 -0.15761E-03 -0.35955E-05 7665 0.522E-03 0.101E-01
RMM: 80 -0.416965923045E+03 0.58179E-04 -0.21023E-05 6926 0.385E-03 0.929E-02
RMM: 81 -0.416964615459E+03 0.13076E-02 -0.14807E-04 9033 0.866E-03 0.952E-02
RMM: 82 -0.416964570783E+03 0.44675E-04 -0.10812E-05 6658 0.349E-03 0.892E-02
RMM: 83 -0.416964838276E+03 -0.26749E-03 -0.20491E-05 6951 0.369E-03 0.821E-02
RMM: 84 -0.416964703132E+03 0.13514E-03 -0.24547E-05 6947 0.375E-03 0.728E-02
RMM: 85 -0.416964594396E+03 0.10874E-03 -0.41483E-05 7594 0.468E-03 0.570E-02
RMM: 86 -0.416964741581E+03 -0.14718E-03 -0.50193E-05 7826 0.529E-03 0.378E-02
RMM: 87 -0.416965244055E+03 -0.50247E-03 -0.10312E-05 6769 0.298E-03 0.335E-02
RMM: 88 -0.416965579454E+03 -0.33540E-03 -0.51836E-06 5897 0.201E-03 0.338E-02
RMM: 89 -0.416965618275E+03 -0.38822E-04 -0.78450E-06 6164 0.227E-03 0.313E-02
RMM: 90 -0.416965621719E+03 -0.34438E-05 -0.68636E-06 5697 0.211E-03
1 F= -.45469200E+03 E0= -.45469228E+03 d E =0.812000E-03 mag= 0.0002