iterations/neb0_image02_iter36_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422682658365E+04 0.42268E+04 -0.25386E+05 8992 0.103E+03
DAV: 2 -0.104414892074E+03 -0.43312E+04 -0.39259E+04 11024 0.248E+02
DAV: 3 -0.426728302491E+03 -0.32231E+03 -0.30122E+03 10216 0.657E+01
DAV: 4 -0.435234651961E+03 -0.85063E+01 -0.84072E+01 10816 0.107E+01
DAV: 5 -0.435527496701E+03 -0.29284E+00 -0.29208E+00 11232 0.194E+00 0.999E+01
RMM: 6 -0.388578452421E+03 0.46949E+02 -0.10977E+02 9699 0.145E+01 0.723E+01
RMM: 7 -0.781624351503E+03 -0.39305E+03 -0.41647E+02 11268 0.190E+01 0.147E+02
RMM: 8 -0.495928872376E+03 0.28570E+03 -0.10922E+02 10027 0.110E+01 0.906E+01
RMM: 9 -0.418697706195E+03 0.77231E+02 -0.68029E+01 10175 0.106E+01 0.583E+01
RMM: 10 -0.373840100531E+03 0.44858E+02 -0.37121E+01 10247 0.790E+00 0.295E+01
RMM: 11 -0.391603968345E+03 -0.17764E+02 -0.19443E+01 10391 0.511E+00 0.446E+01
RMM: 12 -0.376515415311E+03 0.15089E+02 -0.54548E+00 9943 0.324E+00 0.278E+01
RMM: 13 -0.373753440502E+03 0.27620E+01 -0.27139E+00 10223 0.220E+00 0.199E+01
RMM: 14 -0.374948434520E+03 -0.11950E+01 -0.14689E+00 10262 0.160E+00 0.130E+01
RMM: 15 -0.379831584752E+03 -0.48832E+01 -0.12260E+00 10481 0.143E+00 0.156E+01
RMM: 16 -0.382710397432E+03 -0.28788E+01 -0.14238E+00 10641 0.156E+00 0.130E+01
RMM: 17 -0.386132616732E+03 -0.34222E+01 -0.13896E+00 10850 0.145E+00 0.961E+00
RMM: 18 -0.391314120092E+03 -0.51815E+01 -0.15458E+00 11225 0.144E+00 0.733E+00
RMM: 19 -0.394490966336E+03 -0.31768E+01 -0.76381E-01 10659 0.109E+00 0.761E+00
RMM: 20 -0.397873621540E+03 -0.33827E+01 -0.12200E+00 11482 0.123E+00 0.795E+00
RMM: 21 -0.399253067972E+03 -0.13794E+01 -0.38223E-01 10674 0.699E-01 0.772E+00
RMM: 22 -0.401274538303E+03 -0.20215E+01 -0.58210E-01 11341 0.778E-01 0.775E+00
RMM: 23 -0.404567741277E+03 -0.32932E+01 -0.15411E+00 12647 0.117E+00 0.689E+00
RMM: 24 -0.407556175619E+03 -0.29884E+01 -0.10819E+00 12442 0.936E-01 0.531E+00
RMM: 25 -0.409337455260E+03 -0.17813E+01 -0.17683E-01 11021 0.408E-01 0.498E+00
RMM: 26 -0.409978853240E+03 -0.64140E+00 -0.42922E-02 10524 0.201E-01 0.492E+00
RMM: 27 -0.410158943820E+03 -0.18009E+00 -0.11090E-02 10847 0.879E-02 0.488E+00
RMM: 28 -0.409565914564E+03 0.59303E+00 -0.61336E-02 11830 0.259E-01 0.459E+00
RMM: 29 -0.409481694926E+03 0.84220E-01 -0.17176E-01 14447 0.498E-01 0.436E+00
RMM: 30 -0.409971719881E+03 -0.49002E+00 -0.77534E-02 13246 0.344E-01 0.520E+00
RMM: 31 -0.410324575919E+03 -0.35286E+00 -0.16056E-02 10599 0.165E-01 0.492E+00
RMM: 32 -0.411780563353E+03 -0.14560E+01 -0.10578E+00 16567 0.100E+00 0.601E+00
RMM: 33 -0.412681325404E+03 -0.90076E+00 -0.40634E-01 15840 0.622E-01 0.780E+00
RMM: 34 -0.413248502775E+03 -0.56718E+00 -0.15185E-02 11041 0.184E-01 0.834E+00
RMM: 35 -0.413606228940E+03 -0.35773E+00 -0.54576E-02 11910 0.185E-01 0.935E+00
RMM: 36 -0.414376824903E+03 -0.77060E+00 -0.25629E-01 14622 0.377E-01 0.977E+00
RMM: 37 -0.415218311120E+03 -0.84149E+00 -0.42592E-01 16075 0.533E-01 0.996E+00
RMM: 38 -0.415138375419E+03 0.79936E-01 -0.40435E-01 15859 0.562E-01 0.653E+00
RMM: 39 -0.414873508910E+03 0.26487E+00 -0.49238E-01 13643 0.472E-01 0.605E+00
RMM: 40 -0.414415192668E+03 0.45832E+00 -0.92675E-01 13661 0.581E-01 0.579E+00
RMM: 41 -0.414084457146E+03 0.33074E+00 -0.14868E-01 11477 0.222E-01 0.587E+00
RMM: 42 -0.414084811526E+03 -0.35438E-03 -0.22003E-03 11270 0.468E-02 0.589E+00
RMM: 43 -0.414204690595E+03 -0.11988E+00 -0.11724E-02 11030 0.747E-02 0.598E+00
RMM: 44 -0.413844247962E+03 0.36044E+00 -0.79753E-02 12341 0.154E-01 0.601E+00
RMM: 45 -0.413571103633E+03 0.27314E+00 -0.38312E-02 11919 0.105E-01 0.601E+00
RMM: 46 -0.413621995140E+03 -0.50892E-01 -0.29671E-03 10428 0.393E-02 0.603E+00
RMM: 47 -0.410251905073E+03 0.33701E+01 -0.29642E+00 17779 0.101E+00 0.564E+00
RMM: 48 -0.406998763632E+03 0.32531E+01 -0.11168E+00 17855 0.701E-01 0.569E+00
RMM: 49 -0.406764892343E+03 0.23387E+00 -0.56973E-02 17477 0.195E-01 0.546E+00
RMM: 50 -0.406804296662E+03 -0.39404E-01 -0.28257E-02 17449 0.159E-01 0.510E+00
RMM: 51 -0.404329185019E+03 0.24751E+01 -0.37538E-01 17920 0.615E-01 0.584E+00
RMM: 52 -0.403630809173E+03 0.69838E+00 -0.83717E-02 17590 0.298E-01 0.560E+00
RMM: 53 -0.404724595451E+03 -0.10938E+01 -0.50799E-02 17349 0.236E-01 0.520E+00
RMM: 54 -0.405666178978E+03 -0.94158E+00 -0.62993E-02 17323 0.236E-01 0.475E+00
RMM: 55 -0.406305248796E+03 -0.63907E+00 -0.46969E-02 16619 0.191E-01 0.461E+00
RMM: 56 -0.406993378755E+03 -0.68813E+00 -0.52293E-02 16599 0.200E-01 0.452E+00
RMM: 57 -0.405796902875E+03 0.11965E+01 -0.81254E-02 16848 0.263E-01 0.459E+00
RMM: 58 -0.407050281216E+03 -0.12534E+01 -0.16689E-01 17296 0.348E-01 0.433E+00
RMM: 59 -0.408859532229E+03 -0.18093E+01 -0.31538E-01 17530 0.447E-01 0.659E+00
RMM: 60 -0.409070598369E+03 -0.21107E+00 -0.24026E-02 15187 0.188E-01 0.646E+00
RMM: 61 -0.409382804472E+03 -0.31221E+00 -0.14896E-02 13945 0.102E-01 0.634E+00
RMM: 62 -0.409805967772E+03 -0.42316E+00 -0.33824E-02 14087 0.138E-01 0.623E+00
RMM: 63 -0.410488120807E+03 -0.68215E+00 -0.80322E-02 14651 0.198E-01 0.601E+00
RMM: 64 -0.411236278402E+03 -0.74816E+00 -0.12371E-01 14842 0.235E-01 0.578E+00
RMM: 65 -0.411995726112E+03 -0.75945E+00 -0.18592E-01 15144 0.285E-01 0.559E+00
RMM: 66 -0.412557582677E+03 -0.56186E+00 -0.15373E-01 15648 0.263E-01 0.552E+00
RMM: 67 -0.412474050297E+03 0.83532E-01 -0.56039E-03 12776 0.679E-02 0.557E+00
RMM: 68 -0.412236913239E+03 0.23714E+00 -0.18945E-02 12771 0.994E-02 0.567E+00
RMM: 69 -0.412275852963E+03 -0.38940E-01 -0.63932E-03 11971 0.584E-02 0.568E+00
RMM: 70 -0.412764405352E+03 -0.48855E+00 -0.18989E-01 16194 0.283E-01 0.555E+00
RMM: 71 -0.414587366821E+03 -0.18230E+01 -0.18484E+00 17744 0.856E-01 0.478E+00
RMM: 72 -0.415583783445E+03 -0.99642E+00 -0.10717E+00 17669 0.664E-01 0.425E+00
RMM: 73 -0.415985512051E+03 -0.40173E+00 -0.20230E-01 16739 0.306E-01 0.423E+00
RMM: 74 -0.416350489303E+03 -0.36498E+00 -0.24898E-01 16804 0.349E-01 0.421E+00
RMM: 75 -0.416422611449E+03 -0.72122E-01 -0.19570E-02 13708 0.110E-01 0.411E+00
RMM: 76 -0.416588585905E+03 -0.16597E+00 -0.16960E-01 17777 0.325E-01 0.408E+00
RMM: 77 -0.416477997245E+03 0.11059E+00 -0.73500E-02 17071 0.174E-01 0.293E+00
RMM: 78 -0.416500152379E+03 -0.22155E-01 -0.58800E-03 15516 0.735E-02 0.272E+00
RMM: 79 -0.416532690392E+03 -0.32538E-01 -0.21802E-02 16192 0.109E-01 0.270E+00
RMM: 80 -0.416613209904E+03 -0.80520E-01 -0.12114E-02 15857 0.871E-02 0.257E+00
RMM: 81 -0.416741684986E+03 -0.12848E+00 -0.50852E-02 17227 0.163E-01 0.286E+00
RMM: 82 -0.416760299587E+03 -0.18615E-01 -0.28658E-02 15913 0.110E-01 0.211E+00
RMM: 83 -0.416774792272E+03 -0.14493E-01 -0.90428E-03 14462 0.619E-02 0.186E+00
RMM: 84 -0.416796604968E+03 -0.21813E-01 -0.38485E-03 13171 0.440E-02 0.171E+00
RMM: 85 -0.416816956701E+03 -0.20352E-01 -0.38644E-03 13238 0.429E-02 0.160E+00
RMM: 86 -0.416845675334E+03 -0.28719E-01 -0.23433E-02 15552 0.954E-02 0.171E+00
RMM: 87 -0.416858398527E+03 -0.12723E-01 -0.52848E-03 13875 0.524E-02 0.152E+00
RMM: 88 -0.416856220701E+03 0.21778E-02 -0.60898E-03 14467 0.532E-02 0.154E+00
RMM: 89 -0.416854921554E+03 0.12991E-02 -0.12983E-03 12470 0.283E-02 0.147E+00
RMM: 90 -0.416873984322E+03 -0.19063E-01 -0.40890E-03 14787 0.480E-02 0.135E+00
RMM: 91 -0.416870789454E+03 0.31949E-02 -0.21038E-03 13345 0.337E-02 0.132E+00
RMM: 92 -0.416904450653E+03 -0.33661E-01 -0.24042E-03 14006 0.377E-02 0.120E+00
RMM: 93 -0.416927834009E+03 -0.23383E-01 -0.13477E-03 12716 0.283E-02 0.111E+00
RMM: 94 -0.416947028566E+03 -0.19195E-01 -0.83064E-04 12174 0.240E-02 0.104E+00
RMM: 95 -0.416954587328E+03 -0.75588E-02 -0.23644E-03 12404 0.308E-02 0.100E+00
RMM: 96 -0.416938004812E+03 0.16583E-01 -0.51407E-04 11444 0.194E-02 0.994E-01
RMM: 97 -0.416946379947E+03 -0.83751E-02 -0.56145E-04 11929 0.185E-02 0.937E-01
RMM: 98 -0.416958932170E+03 -0.12552E-01 -0.31652E-03 14964 0.396E-02 0.810E-01
RMM: 99 -0.416966277705E+03 -0.73455E-02 -0.20408E-03 14431 0.326E-02 0.705E-01
RMM: 100 -0.416976065476E+03 -0.97878E-02 -0.15661E-03 13732 0.279E-02 0.624E-01
RMM: 101 -0.416995405712E+03 -0.19340E-01 -0.71524E-02 17803 0.172E-01 0.532E-01
RMM: 102 -0.417008368979E+03 -0.12963E-01 -0.28641E-03 13985 0.409E-02 0.379E-01
RMM: 103 -0.417024702299E+03 -0.16333E-01 -0.80067E-04 12719 0.235E-02 0.291E-01
RMM: 104 -0.417032484626E+03 -0.77823E-02 -0.43693E-04 11171 0.164E-02 0.179E-01
RMM: 105 -0.417035349272E+03 -0.28646E-02 -0.30786E-04 10069 0.125E-02 0.109E-01
RMM: 106 -0.417037369822E+03 -0.20205E-02 -0.19297E-04 9087 0.107E-02 0.115E-01
RMM: 107 -0.417038138859E+03 -0.76904E-03 -0.96731E-05 7914 0.718E-03 0.801E-02
RMM: 108 -0.417040032624E+03 -0.18938E-02 -0.91614E-05 8079 0.717E-03 0.495E-02
RMM: 109 -0.417043498154E+03 -0.34655E-02 -0.73696E-05 7866 0.669E-03 0.324E-02
RMM: 110 -0.417047664554E+03 -0.41664E-02 -0.47070E-05 7539 0.564E-03 0.262E-02
RMM: 111 -0.417050407657E+03 -0.27431E-02 -0.18691E-05 6908 0.395E-03 0.290E-02
RMM: 112 -0.417052354935E+03 -0.19473E-02 -0.10352E-05 6647 0.316E-03 0.268E-02
RMM: 113 -0.417054234674E+03 -0.18797E-02 -0.81780E-06 6691 0.268E-03 0.209E-02
RMM: 114 -0.417055930764E+03 -0.16961E-02 -0.10376E-05 6584 0.268E-03 0.124E-02
RMM: 115 -0.417057326536E+03 -0.13958E-02 -0.92574E-06 5973 0.240E-03 0.671E-03
RMM: 116 -0.417057830597E+03 -0.50406E-03 -0.15578E-06 4379 0.141E-03 0.553E-03
RMM: 117 -0.417058537558E+03 -0.70696E-03 -0.25258E-06 4843 0.146E-03 0.477E-03
RMM: 118 -0.417058845220E+03 -0.30766E-03 -0.11921E-06 3965 0.113E-03 0.331E-03
RMM: 119 -0.417059102064E+03 -0.25684E-03 -0.87597E-07 3909 0.109E-03 0.290E-03
RMM: 120 -0.417059231787E+03 -0.12972E-03 -0.58953E-07 3551 0.986E-04 0.332E-03
RMM: 121 -0.417059298111E+03 -0.66323E-04 -0.23866E-07 2927 0.884E-04 0.217E-03
RMM: 122 -0.417059366152E+03 -0.68042E-04 -0.34679E-07 3081 0.903E-04 0.197E-03
RMM: 123 -0.417059409438E+03 -0.43286E-04 -0.41962E-07 3093 0.920E-04 0.129E-03
RMM: 124 -0.417059437810E+03 -0.28372E-04 -0.50666E-07 3345 0.935E-04 0.129E-03
RMM: 125 -0.417059449405E+03 -0.11594E-04 -0.27728E-07 2908 0.869E-04 0.892E-04
RMM: 126 -0.417059457296E+03 -0.78913E-05 -0.27943E-07 2878 0.872E-04
1 F= -.45478329E+03 E0= -.45478355E+03 d E =0.764376E-03 mag= -0.0002