iterations/neb0_image05_iter50_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.423182749966E+04 0.42318E+04 -0.25394E+05 9000 0.103E+03
DAV: 2 -0.104202498609E+03 -0.43360E+04 -0.39322E+04 10984 0.248E+02
DAV: 3 -0.426799924970E+03 -0.32260E+03 -0.30199E+03 10312 0.657E+01
DAV: 4 -0.435279074082E+03 -0.84791E+01 -0.83704E+01 10936 0.107E+01
DAV: 5 -0.435573150162E+03 -0.29408E+00 -0.29311E+00 11024 0.193E+00 0.994E+01
RMM: 6 -0.378924891876E+03 0.56648E+02 -0.11414E+02 9717 0.146E+01 0.674E+01
RMM: 7 -0.495659255694E+03 -0.11673E+03 -0.15762E+02 9893 0.149E+01 0.896E+01
RMM: 8 -0.386734187009E+03 0.10893E+03 -0.58135E+01 9826 0.105E+01 0.361E+01
RMM: 9 -0.526825997071E+03 -0.14009E+03 -0.50802E+01 10271 0.776E+00 0.916E+01
RMM: 10 -0.387416082883E+03 0.13941E+03 -0.35450E+01 10407 0.675E+00 0.370E+01
RMM: 11 -0.375246481348E+03 0.12170E+02 -0.71402E+00 9770 0.377E+00 0.191E+01
RMM: 12 -0.379345736684E+03 -0.40993E+01 -0.55542E+00 10257 0.289E+00 0.142E+01
RMM: 13 -0.382008925517E+03 -0.26632E+01 -0.18164E+00 10151 0.165E+00 0.129E+01
RMM: 14 -0.383334821658E+03 -0.13259E+01 -0.68040E-01 10163 0.107E+00 0.105E+01
RMM: 15 -0.385382441876E+03 -0.20476E+01 -0.52383E-01 10274 0.984E-01 0.879E+00
RMM: 16 -0.390200241816E+03 -0.48178E+01 -0.11653E+00 11325 0.135E+00 0.827E+00
RMM: 17 -0.395520984408E+03 -0.53207E+01 -0.18162E+00 11813 0.153E+00 0.730E+00
RMM: 18 -0.401731265945E+03 -0.62103E+01 -0.32351E+00 12532 0.180E+00 0.786E+00
RMM: 19 -0.402900015528E+03 -0.11687E+01 -0.43772E-01 10816 0.727E-01 0.674E+00
RMM: 20 -0.404814718143E+03 -0.19147E+01 -0.45817E-01 11164 0.668E-01 0.656E+00
RMM: 21 -0.409042007185E+03 -0.42273E+01 -0.26695E+00 13474 0.148E+00 0.570E+00
RMM: 22 -0.411849527082E+03 -0.28075E+01 -0.15193E+00 12937 0.112E+00 0.589E+00
RMM: 23 -0.413461308033E+03 -0.16118E+01 -0.17232E-01 10693 0.431E-01 0.569E+00
RMM: 24 -0.414056833874E+03 -0.59553E+00 -0.48693E-02 10333 0.217E-01 0.559E+00
RMM: 25 -0.414424081598E+03 -0.36725E+00 -0.59766E-02 10982 0.239E-01 0.559E+00
RMM: 26 -0.414965313181E+03 -0.54123E+00 -0.17716E-01 12261 0.402E-01 0.476E+00
RMM: 27 -0.415444791931E+03 -0.47948E+00 -0.10419E-01 11866 0.383E-01 0.365E+00
RMM: 28 -0.415562834684E+03 -0.11804E+00 -0.46871E-02 10914 0.272E-01 0.320E+00
RMM: 29 -0.415957260629E+03 -0.39443E+00 -0.41457E-02 10727 0.260E-01 0.219E+00
RMM: 30 -0.416581965466E+03 -0.62470E+00 -0.37288E-02 10586 0.249E-01 0.158E+00
RMM: 31 -0.416914068263E+03 -0.33210E+00 -0.19255E-02 10361 0.170E-01 0.128E+00
RMM: 32 -0.417086697070E+03 -0.17263E+00 -0.11155E-02 10393 0.128E-01 0.104E+00
RMM: 33 -0.417170208878E+03 -0.83512E-01 -0.69183E-03 10432 0.973E-02 0.867E-01
RMM: 34 -0.417265864393E+03 -0.95656E-01 -0.99683E-03 11088 0.113E-01 0.904E-01
RMM: 35 -0.417309570531E+03 -0.43706E-01 -0.85608E-03 11067 0.992E-02 0.573E-01
RMM: 36 -0.417443519040E+03 -0.13395E+00 -0.10860E-02 11452 0.103E-01 0.564E-01
RMM: 37 -0.417539808797E+03 -0.96290E-01 -0.12735E-02 11761 0.103E-01 0.680E-01
RMM: 38 -0.417590866512E+03 -0.51058E-01 -0.56578E-03 11223 0.702E-02 0.570E-01
RMM: 39 -0.417670071177E+03 -0.79205E-01 -0.76998E-03 11739 0.720E-02 0.419E-01
RMM: 40 -0.417708782704E+03 -0.38712E-01 -0.38203E-03 11326 0.545E-02 0.266E-01
RMM: 41 -0.417767752636E+03 -0.58970E-01 -0.41542E-03 11603 0.497E-02 0.214E-01
RMM: 42 -0.417831350558E+03 -0.63598E-01 -0.24337E-03 11344 0.392E-02 0.172E-01
RMM: 43 -0.417923611740E+03 -0.92261E-01 -0.22918E-03 11615 0.344E-02 0.111E-01
RMM: 44 -0.417955437798E+03 -0.31826E-01 -0.64207E-04 10926 0.218E-02 0.823E-02
RMM: 45 -0.417962255742E+03 -0.68179E-02 -0.22638E-04 10282 0.137E-02 0.435E-02
RMM: 46 -0.417963307090E+03 -0.10513E-02 -0.71881E-05 8635 0.790E-03 0.353E-02
RMM: 47 -0.417963687221E+03 -0.38013E-03 -0.37508E-05 8003 0.567E-03 0.233E-02
RMM: 48 -0.417964186466E+03 -0.49924E-03 -0.18430E-05 7275 0.416E-03 0.197E-02
RMM: 49 -0.417964568209E+03 -0.38174E-03 -0.16907E-05 7235 0.370E-03 0.330E-02
RMM: 50 -0.417964760551E+03 -0.19234E-03 -0.67396E-06 6663 0.249E-03 0.218E-02
RMM: 51 -0.417965082266E+03 -0.32171E-03 -0.67290E-06 6678 0.238E-03 0.132E-02
RMM: 52 -0.417965327107E+03 -0.24484E-03 -0.30032E-06 5602 0.172E-03 0.855E-03
RMM: 53 -0.417965561276E+03 -0.23417E-03 -0.20744E-06 5490 0.145E-03 0.967E-03
RMM: 54 -0.417965796228E+03 -0.23495E-03 -0.12165E-06 4413 0.118E-03 0.514E-03
RMM: 55 -0.417966168694E+03 -0.37247E-03 -0.14912E-06 4775 0.123E-03 0.403E-03
RMM: 56 -0.417966503503E+03 -0.33481E-03 -0.10057E-06 3844 0.108E-03 0.588E-03
RMM: 57 -0.417966728407E+03 -0.22490E-03 -0.72649E-07 3741 0.102E-03 0.431E-03
RMM: 58 -0.417966929530E+03 -0.20112E-03 -0.87071E-07 4033 0.103E-03 0.275E-03
RMM: 59 -0.417967066883E+03 -0.13735E-03 -0.46200E-07 3431 0.929E-04 0.254E-03
RMM: 60 -0.417967153046E+03 -0.86163E-04 -0.50516E-07 3443 0.917E-04 0.218E-03
RMM: 61 -0.417967223656E+03 -0.70610E-04 -0.43483E-07 3242 0.919E-04 0.148E-03
RMM: 62 -0.417967263699E+03 -0.40043E-04 -0.40080E-07 3184 0.924E-04 0.936E-04
RMM: 63 -0.417967275481E+03 -0.11782E-04 -0.18733E-07 2732 0.861E-04 0.594E-04
RMM: 64 -0.417967283583E+03 -0.81024E-05 -0.14674E-07 2625 0.846E-04
1 F= -.45576562E+03 E0= -.45576547E+03 d E =-.432478E-03 mag= -0.0004