iterations/neb2_max2_image03_iter4_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422350966841E+04 0.42235E+04 -0.25381E+05 8992 0.103E+03
DAV: 2 -0.102433417542E+03 -0.43259E+04 -0.39228E+04 11000 0.248E+02
DAV: 3 -0.425429759654E+03 -0.32300E+03 -0.30234E+03 10232 0.657E+01
DAV: 4 -0.434082812567E+03 -0.86531E+01 -0.85445E+01 10872 0.108E+01
DAV: 5 -0.434380783422E+03 -0.29797E+00 -0.29707E+00 11248 0.195E+00 0.988E+01
RMM: 6 -0.378374676560E+03 0.56006E+02 -0.11417E+02 9680 0.146E+01 0.686E+01
RMM: 7 -0.569357589726E+03 -0.19098E+03 -0.21439E+02 10329 0.162E+01 0.105E+02
RMM: 8 -0.523977029953E+03 0.45381E+02 -0.11149E+02 10302 0.115E+01 0.913E+01
RMM: 9 -0.390965475134E+03 0.13301E+03 -0.44908E+01 10153 0.821E+00 0.394E+01
RMM: 10 -0.421051770233E+03 -0.30086E+02 -0.45145E+01 10492 0.833E+00 0.569E+01
RMM: 11 -0.377700921982E+03 0.43351E+02 -0.11070E+01 9689 0.455E+00 0.257E+01
RMM: 12 -0.374662003169E+03 0.30389E+01 -0.62715E+00 10265 0.301E+00 0.205E+01
RMM: 13 -0.377297471950E+03 -0.26355E+01 -0.23312E+00 10270 0.195E+00 0.152E+01
RMM: 14 -0.379169643388E+03 -0.18722E+01 -0.11909E+00 10269 0.145E+00 0.103E+01
RMM: 15 -0.383363410715E+03 -0.41938E+01 -0.85433E-01 10343 0.121E+00 0.106E+01
RMM: 16 -0.386215556244E+03 -0.28521E+01 -0.10432E+00 10744 0.131E+00 0.970E+00
RMM: 17 -0.390016669759E+03 -0.38011E+01 -0.10582E+00 11013 0.119E+00 0.727E+00
RMM: 18 -0.392885555497E+03 -0.28689E+01 -0.57373E-01 10779 0.866E-01 0.602E+00
RMM: 19 -0.396878039088E+03 -0.39925E+01 -0.97118E-01 11714 0.102E+00 0.596E+00
RMM: 20 -0.399141259229E+03 -0.22632E+01 -0.51878E-01 11219 0.759E-01 0.531E+00
RMM: 21 -0.402056404437E+03 -0.29151E+01 -0.91940E-01 12004 0.948E-01 0.488E+00
RMM: 22 -0.408453827087E+03 -0.63974E+01 -0.54849E+00 14610 0.192E+00 0.693E+00
RMM: 23 -0.408874728501E+03 -0.42090E+00 -0.92131E-01 12520 0.840E-01 0.628E+00
RMM: 24 -0.409950134650E+03 -0.10754E+01 -0.12953E-01 10713 0.371E-01 0.599E+00
RMM: 25 -0.410803136786E+03 -0.85300E+00 -0.72397E-02 10625 0.257E-01 0.593E+00
RMM: 26 -0.411276407177E+03 -0.47327E+00 -0.11302E-01 11494 0.326E-01 0.596E+00
RMM: 27 -0.411308236730E+03 -0.31830E-01 -0.20864E-01 12698 0.528E-01 0.555E+00
RMM: 28 -0.411641826181E+03 -0.33359E+00 -0.70752E-02 10823 0.338E-01 0.453E+00
RMM: 29 -0.412476133908E+03 -0.83431E+00 -0.53570E-02 10695 0.285E-01 0.382E+00
RMM: 30 -0.413214072597E+03 -0.73794E+00 -0.74561E-02 11152 0.316E-01 0.331E+00
RMM: 31 -0.413829621158E+03 -0.61555E+00 -0.64453E-02 10991 0.288E-01 0.233E+00
RMM: 32 -0.414446570299E+03 -0.61695E+00 -0.25462E-02 10393 0.193E-01 0.192E+00
RMM: 33 -0.414735237751E+03 -0.28867E+00 -0.23299E-02 10710 0.170E-01 0.140E+00
RMM: 34 -0.414869183199E+03 -0.13395E+00 -0.81758E-03 10394 0.100E-01 0.120E+00
RMM: 35 -0.414956560128E+03 -0.87377E-01 -0.40626E-03 10424 0.717E-02 0.109E+00
RMM: 36 -0.415002756267E+03 -0.46196E-01 -0.32787E-03 10663 0.630E-02 0.908E-01
RMM: 37 -0.415096893712E+03 -0.94137E-01 -0.37152E-03 11014 0.699E-02 0.607E-01
RMM: 38 -0.415268346472E+03 -0.17145E+00 -0.44066E-03 11548 0.762E-02 0.505E-01
RMM: 39 -0.415315832489E+03 -0.47486E-01 -0.39552E-03 11333 0.676E-02 0.467E-01
RMM: 40 -0.415355442919E+03 -0.39610E-01 -0.26467E-03 11105 0.547E-02 0.562E-01
RMM: 41 -0.415417564963E+03 -0.62122E-01 -0.54161E-03 11988 0.696E-02 0.303E-01
RMM: 42 -0.415497992176E+03 -0.80427E-01 -0.47591E-03 12020 0.607E-02 0.309E-01
RMM: 43 -0.415559563674E+03 -0.61571E-01 -0.50487E-03 11880 0.576E-02 0.306E-01
RMM: 44 -0.415625156867E+03 -0.65593E-01 -0.48364E-03 12116 0.534E-02 0.180E-01
RMM: 45 -0.415690827957E+03 -0.65671E-01 -0.35741E-03 11979 0.448E-02 0.111E-01
RMM: 46 -0.415747325010E+03 -0.56497E-01 -0.17252E-03 11504 0.319E-02 0.858E-02
RMM: 47 -0.415789642993E+03 -0.42318E-01 -0.63628E-04 10805 0.208E-02 0.604E-02
RMM: 48 -0.415825199560E+03 -0.35557E-01 -0.37612E-04 10339 0.164E-02 0.458E-02
RMM: 49 -0.415836945730E+03 -0.11746E-01 -0.12815E-04 9438 0.104E-02 0.274E-02
RMM: 50 -0.415840584433E+03 -0.36387E-02 -0.55318E-05 8554 0.643E-03 0.246E-02
RMM: 51 -0.415841385464E+03 -0.80103E-03 -0.21345E-05 7464 0.396E-03 0.163E-02
RMM: 52 -0.415841748154E+03 -0.36269E-03 -0.11891E-05 6878 0.286E-03 0.970E-03
RMM: 53 -0.415841878866E+03 -0.13071E-03 -0.38582E-06 5446 0.182E-03 0.664E-03
RMM: 54 -0.415842127932E+03 -0.24907E-03 -0.38231E-06 5128 0.162E-03 0.562E-03
RMM: 55 -0.415842316353E+03 -0.18842E-03 -0.22285E-06 4390 0.131E-03 0.510E-03
RMM: 56 -0.415842407432E+03 -0.91079E-04 -0.12035E-06 3898 0.113E-03 0.336E-03
RMM: 57 -0.415842562770E+03 -0.15534E-03 -0.13466E-06 4201 0.113E-03 0.265E-03
RMM: 58 -0.415842696634E+03 -0.13386E-03 -0.67437E-07 3449 0.961E-04 0.223E-03
RMM: 59 -0.415842830841E+03 -0.13421E-03 -0.74943E-07 3657 0.982E-04 0.195E-03
RMM: 60 -0.415842910278E+03 -0.79438E-04 -0.36312E-07 3083 0.893E-04 0.440E-03
RMM: 61 -0.415842943283E+03 -0.33005E-04 -0.26745E-07 2815 0.861E-04 0.174E-03
RMM: 62 -0.415842989208E+03 -0.45924E-04 -0.40258E-07 3102 0.910E-04 0.264E-03
RMM: 63 -0.415843018964E+03 -0.29756E-04 -0.21626E-07 2703 0.854E-04 0.330E-03
RMM: 64 -0.415843042154E+03 -0.23191E-04 -0.18757E-07 2678 0.836E-04 0.292E-03
RMM: 65 -0.415843058781E+03 -0.16627E-04 -0.93021E-08 2412 0.809E-04 0.201E-03
RMM: 66 -0.415843072344E+03 -0.13563E-04 -0.15816E-07 2551 0.825E-04 0.110E-03
RMM: 67 -0.415843082933E+03 -0.10590E-04 -0.10928E-07 2432 0.816E-04 0.509E-04
RMM: 68 -0.415843090589E+03 -0.76551E-05 -0.10700E-07 2454 0.819E-04
1 F= -.45356596E+03 E0= -.45356555E+03 d E =-.122430E-02 mag= -0.0000