iterations/neb0_image03_iter4_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.425753094828E+04 0.42575E+04 -0.25406E+05 9008 0.103E+03
DAV: 2 -0.923003414378E+02 -0.43498E+04 -0.39447E+04 11000 0.248E+02
DAV: 3 -0.419997228978E+03 -0.32770E+03 -0.30551E+03 10208 0.659E+01
DAV: 4 -0.428818717214E+03 -0.88215E+01 -0.87165E+01 10752 0.108E+01
DAV: 5 -0.429121415414E+03 -0.30270E+00 -0.30192E+00 11096 0.194E+00 0.108E+02
RMM: 6 -0.409745010113E+03 0.19376E+02 -0.10602E+02 9670 0.144E+01 0.895E+01
RMM: 7 -0.107087334189E+04 -0.66113E+03 -0.68996E+02 12207 0.231E+01 0.180E+02
RMM: 8 -0.536942341413E+03 0.53393E+03 -0.10949E+02 10114 0.115E+01 0.109E+02
RMM: 9 -0.615356103243E+03 -0.78414E+02 -0.99070E+01 10361 0.123E+01 0.121E+02
RMM: 10 -0.402909220871E+03 0.21245E+03 -0.49033E+01 10450 0.901E+00 0.553E+01
RMM: 11 -0.359154732804E+03 0.43754E+02 -0.25570E+01 10449 0.535E+00 0.323E+01
RMM: 12 -0.356355958041E+03 0.27988E+01 -0.10182E+01 10299 0.394E+00 0.220E+01
RMM: 13 -0.356991964663E+03 -0.63601E+00 -0.34955E+00 10538 0.228E+00 0.176E+01
RMM: 14 -0.357817747558E+03 -0.82578E+00 -0.12221E+00 10258 0.142E+00 0.148E+01
RMM: 15 -0.361916151783E+03 -0.40984E+01 -0.11811E+00 10397 0.139E+00 0.135E+01
RMM: 16 -0.371541748195E+03 -0.96256E+01 -0.30232E+00 11779 0.210E+00 0.126E+01
RMM: 17 -0.377905684940E+03 -0.63639E+01 -0.30101E+00 11871 0.214E+00 0.128E+01
RMM: 18 -0.377248433173E+03 0.65725E+00 -0.32788E-01 10194 0.761E-01 0.927E+00
RMM: 19 -0.380079036125E+03 -0.28306E+01 -0.88965E-01 11369 0.104E+00 0.101E+01
RMM: 20 -0.381727036602E+03 -0.16480E+01 0.26032E+00 13643 0.210E+00 0.780E+00
RMM: 21 -0.383547615490E+03 -0.18206E+01 -0.94141E+00 13634 0.364E+00 0.828E+00
RMM: 22 -0.384370402804E+03 -0.82279E+00 -0.48105E-01 11477 0.779E-01 0.883E+00
RMM: 23 -0.383966288980E+03 0.40411E+00 -0.39917E-02 10301 0.305E-01 0.865E+00
RMM: 24 -0.384477714744E+03 -0.51143E+00 -0.94052E-02 11087 0.351E-01 0.680E+00
RMM: 25 -0.388261923628E+03 -0.37842E+01 -0.66589E-01 14120 0.861E-01 0.638E+00
RMM: 26 -0.392336014933E+03 -0.40741E+01 -0.54090E-01 13615 0.779E-01 0.589E+00
RMM: 27 -0.395534388442E+03 -0.31984E+01 -0.52963E-01 13621 0.732E-01 0.618E+00
RMM: 28 -0.398267042977E+03 -0.27327E+01 -0.64100E-01 13792 0.748E-01 0.633E+00
RMM: 29 -0.399539378448E+03 -0.12723E+01 -0.25619E-01 12427 0.477E-01 0.630E+00
RMM: 30 -0.399776936090E+03 -0.23756E+00 -0.15243E-02 10416 0.135E-01 0.628E+00
RMM: 31 -0.399461886782E+03 0.31505E+00 -0.10200E-01 12680 0.384E-01 0.535E+00
RMM: 32 -0.399936776261E+03 -0.47489E+00 -0.11713E-01 13356 0.419E-01 0.527E+00
RMM: 33 -0.399985715102E+03 -0.48939E-01 -0.29213E-01 12794 0.479E-01 0.532E+00
RMM: 34 -0.400025099083E+03 -0.39384E-01 -0.19156E-02 10348 0.140E-01 0.526E+00
RMM: 35 -0.400721610413E+03 -0.69651E+00 -0.46687E-01 14519 0.639E-01 0.499E+00
RMM: 36 -0.401981606539E+03 -0.12600E+01 -0.70731E-01 15816 0.768E-01 0.577E+00
RMM: 37 -0.403026518009E+03 -0.10449E+01 -0.51414E-01 16063 0.705E-01 0.602E+00
RMM: 38 -0.403492409423E+03 -0.46589E+00 -0.12652E-01 14273 0.373E-01 0.499E+00
RMM: 39 -0.403635937898E+03 -0.14353E+00 -0.38898E-02 11661 0.195E-01 0.463E+00
RMM: 40 -0.404093336945E+03 -0.45740E+00 -0.29634E-01 13149 0.394E-01 0.457E+00
RMM: 41 -0.405262898425E+03 -0.11696E+01 -0.17431E+00 15336 0.800E-01 0.306E+00
RMM: 42 -0.405909116754E+03 -0.64622E+00 -0.10746E+00 14144 0.594E-01 0.266E+00
RMM: 43 -0.405983217266E+03 -0.74101E-01 -0.17849E-02 11644 0.872E-02 0.273E+00
RMM: 44 -0.405769479228E+03 0.21374E+00 -0.46087E-01 14070 0.525E-01 0.257E+00
RMM: 45 -0.405032419499E+03 0.73706E+00 -0.17956E+00 14751 0.932E-01 0.236E+00
RMM: 46 -0.403261292122E+03 0.17711E+01 -0.80620E-01 15346 0.855E-01 0.246E+00
RMM: 47 -0.401758657658E+03 0.15026E+01 -0.26587E-01 15009 0.523E-01 0.258E+00
RMM: 48 -0.400000189914E+03 0.17585E+01 -0.15323E-01 14761 0.405E-01 0.310E+00
RMM: 49 -0.400230301367E+03 -0.23011E+00 -0.18635E-03 10685 0.582E-02 0.302E+00
RMM: 50 -0.403968290574E+03 -0.37380E+01 -0.58955E-01 16707 0.702E-01 0.180E+00
RMM: 51 -0.406250124751E+03 -0.22818E+01 -0.62872E+00 17268 0.107E+00 0.143E+00
RMM: 52 -0.406425581631E+03 -0.17546E+00 -0.76136E-01 15975 0.358E-01 0.131E+00
RMM: 53 -0.406538501079E+03 -0.11292E+00 -0.20154E-01 15271 0.199E-01 0.120E+00
RMM: 54 -0.406624150686E+03 -0.85650E-01 -0.61028E-02 14389 0.133E-01 0.111E+00
RMM: 55 -0.406627559033E+03 -0.34083E-02 -0.40782E-03 12371 0.400E-02 0.113E+00
RMM: 56 -0.406645368337E+03 -0.17809E-01 -0.30477E-03 12080 0.571E-02 0.117E+00
RMM: 57 -0.406587619481E+03 0.57749E-01 -0.26509E-02 14471 0.120E-01 0.121E+00
RMM: 58 -0.406572625484E+03 0.14994E-01 -0.26772E-02 14223 0.103E-01 0.124E+00
RMM: 59 -0.406415843249E+03 0.15678E+00 -0.29018E-01 16123 0.317E-01 0.144E+00
RMM: 60 -0.402469994850E+03 0.39458E+01 -0.44246E+00 16823 0.135E+00 0.242E+00
RMM: 61 -0.406471418230E+03 -0.40014E+01 -0.54616E+00 16567 0.114E+00 0.105E+00
RMM: 62 -0.406488181373E+03 -0.16763E-01 -0.75143E-02 13703 0.135E-01 0.126E+00
RMM: 63 -0.406537524282E+03 -0.49343E-01 -0.15714E-02 13630 0.855E-02 0.126E+00
RMM: 64 -0.406675307100E+03 -0.13778E+00 -0.10916E-01 15313 0.192E-01 0.118E+00
RMM: 65 -0.406923973382E+03 -0.24867E+00 -0.64169E-01 17454 0.470E-01 0.109E+00
RMM: 66 -0.406977840114E+03 -0.53867E-01 -0.13266E-01 16634 0.235E-01 0.135E+00
RMM: 67 -0.406997231788E+03 -0.19392E-01 -0.65097E-03 12982 0.732E-02 0.138E+00
RMM: 68 -0.407007953663E+03 -0.10722E-01 -0.10778E-03 11386 0.343E-02 0.143E+00
RMM: 69 -0.407017781586E+03 -0.98279E-02 -0.13171E-03 11638 0.363E-02 0.137E+00
RMM: 70 -0.407040785030E+03 -0.23003E-01 -0.12660E-02 15102 0.983E-02 0.124E+00
RMM: 71 -0.407078248932E+03 -0.37464E-01 -0.19847E-02 15729 0.119E-01 0.112E+00
RMM: 72 -0.407099632884E+03 -0.21384E-01 -0.20422E-03 12946 0.504E-02 0.101E+00
RMM: 73 -0.407111728589E+03 -0.12096E-01 -0.19503E-03 12763 0.440E-02 0.911E-01
RMM: 74 -0.407139080888E+03 -0.27352E-01 -0.45389E-03 14016 0.648E-02 0.849E-01
RMM: 75 -0.407169379505E+03 -0.30299E-01 -0.24676E-02 16220 0.140E-01 0.702E-01
RMM: 76 -0.407201798456E+03 -0.32419E-01 -0.62795E-03 14314 0.822E-02 0.571E-01
RMM: 77 -0.407240088099E+03 -0.38290E-01 -0.48398E-03 13722 0.652E-02 0.564E-01
RMM: 78 -0.407277830539E+03 -0.37742E-01 -0.15416E-03 12023 0.381E-02 0.542E-01
RMM: 79 -0.407298444052E+03 -0.20614E-01 -0.18026E-03 11900 0.367E-02 0.520E-01
RMM: 80 -0.407319315769E+03 -0.20872E-01 -0.52587E-04 10992 0.207E-02 0.489E-01
RMM: 81 -0.407335487672E+03 -0.16172E-01 -0.20212E-03 13063 0.392E-02 0.425E-01
RMM: 82 -0.407341037335E+03 -0.55497E-02 -0.44222E-04 11472 0.225E-02 0.373E-01
RMM: 83 -0.407351834549E+03 -0.10797E-01 -0.10863E-03 12393 0.297E-02 0.328E-01
RMM: 84 -0.407362389981E+03 -0.10555E-01 -0.13322E-03 12956 0.317E-02 0.276E-01
RMM: 85 -0.407370396016E+03 -0.80060E-02 -0.45337E-04 11474 0.194E-02 0.236E-01
RMM: 86 -0.407376094037E+03 -0.56980E-02 -0.60605E-04 11697 0.212E-02 0.220E-01
RMM: 87 -0.407381784071E+03 -0.56900E-02 -0.78436E-04 12189 0.235E-02 0.187E-01
RMM: 88 -0.407383072919E+03 -0.12888E-02 -0.80477E-04 12063 0.238E-02 0.149E-01
RMM: 89 -0.407382665690E+03 0.40723E-03 -0.11731E-03 12797 0.288E-02 0.118E-01
RMM: 90 -0.407383374489E+03 -0.70880E-03 -0.38144E-04 11158 0.171E-02 0.933E-02
RMM: 91 -0.407378667148E+03 0.47073E-02 -0.29685E-03 14604 0.474E-02 0.550E-02
RMM: 92 -0.407380628774E+03 -0.19616E-02 -0.13521E-04 9334 0.160E-02 0.400E-02
RMM: 93 -0.407382150531E+03 -0.15218E-02 -0.37093E-05 7699 0.712E-03 0.302E-02
RMM: 94 -0.407384228625E+03 -0.20781E-02 -0.35675E-05 7701 0.541E-03 0.277E-02
RMM: 95 -0.407385614550E+03 -0.13859E-02 -0.84709E-05 8190 0.886E-03 0.293E-02
RMM: 96 -0.407385931625E+03 -0.31708E-03 -0.18272E-05 6971 0.477E-03 0.221E-02
RMM: 97 -0.407386621312E+03 -0.68969E-03 -0.59684E-06 5883 0.232E-03 0.233E-02
RMM: 98 -0.407387476489E+03 -0.85518E-03 -0.21369E-05 7003 0.408E-03 0.181E-02
RMM: 99 -0.407388671959E+03 -0.11955E-02 -0.15018E-05 6470 0.304E-03 0.148E-02
RMM: 100 -0.407389446556E+03 -0.77460E-03 -0.10363E-05 6224 0.263E-03 0.105E-02
RMM: 101 -0.407389952902E+03 -0.50635E-03 -0.10176E-05 6296 0.279E-03 0.754E-03
RMM: 102 -0.407390338903E+03 -0.38600E-03 -0.50369E-06 5176 0.187E-03 0.604E-03
RMM: 103 -0.407390499539E+03 -0.16064E-03 -0.14503E-06 3791 0.125E-03 0.454E-03
RMM: 104 -0.407390615100E+03 -0.11556E-03 -0.25725E-06 4797 0.166E-03 0.278E-03
RMM: 105 -0.407390682540E+03 -0.67440E-04 -0.17698E-06 4190 0.145E-03 0.130E-03
RMM: 106 -0.407390717388E+03 -0.34848E-04 -0.45538E-07 3175 0.100E-03 0.102E-03
RMM: 107 -0.407390738120E+03 -0.20733E-04 -0.16332E-07 2635 0.869E-04 0.627E-04
RMM: 108 -0.407390748841E+03 -0.10721E-04 -0.84547E-08 2409 0.831E-04 0.585E-04
RMM: 109 -0.407390754956E+03 -0.61152E-05 -0.72251E-08 2363 0.825E-04
1 F= -.44523560E+03 E0= -.44523538E+03 d E =-.668356E-03 mag= -0.0001