iterations/neb3_max1_image04_iter22_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421651919842E+04 0.42165E+04 -0.25382E+05 9008 0.103E+03
DAV: 2 -0.105427680832E+03 -0.43219E+04 -0.39275E+04 11016 0.248E+02
DAV: 3 -0.427165099793E+03 -0.32174E+03 -0.30088E+03 10240 0.655E+01
DAV: 4 -0.435687727480E+03 -0.85226E+01 -0.84245E+01 10784 0.107E+01
DAV: 5 -0.435975206788E+03 -0.28748E+00 -0.28683E+00 11208 0.192E+00 0.100E+02
RMM: 6 -0.386877173155E+03 0.49098E+02 -0.10961E+02 9705 0.144E+01 0.718E+01
RMM: 7 -0.727558038048E+03 -0.34068E+03 -0.36417E+02 11038 0.182E+01 0.137E+02
RMM: 8 -0.506079976545E+03 0.22148E+03 -0.11723E+02 10176 0.114E+01 0.914E+01
RMM: 9 -0.395357806327E+03 0.11072E+03 -0.69932E+01 10226 0.108E+01 0.487E+01
RMM: 10 -0.398747901064E+03 -0.33901E+01 -0.43862E+01 10225 0.854E+00 0.490E+01
RMM: 11 -0.390502615857E+03 0.82453E+01 -0.23814E+01 10223 0.607E+00 0.474E+01
RMM: 12 -0.376197053103E+03 0.14306E+02 -0.81632E+00 9955 0.382E+00 0.281E+01
RMM: 13 -0.375282483349E+03 0.91457E+00 -0.25444E+00 10056 0.216E+00 0.232E+01
RMM: 14 -0.374667892435E+03 0.61459E+00 -0.11555E+00 10125 0.144E+00 0.154E+01
RMM: 15 -0.377677979313E+03 -0.30101E+01 -0.11139E+00 10456 0.137E+00 0.117E+01
RMM: 16 -0.383879742826E+03 -0.62018E+01 -0.13614E+00 10835 0.150E+00 0.160E+01
RMM: 17 -0.386809526259E+03 -0.29298E+01 -0.12010E+00 10795 0.135E+00 0.130E+01
RMM: 18 -0.389883860544E+03 -0.30743E+01 -0.92172E-01 10775 0.116E+00 0.982E+00
RMM: 19 -0.394498379657E+03 -0.46145E+01 -0.12197E+00 11284 0.124E+00 0.689E+00
RMM: 20 -0.397415730048E+03 -0.29174E+01 -0.71188E-01 10968 0.991E-01 0.628E+00
RMM: 21 -0.400401661818E+03 -0.29859E+01 -0.10824E+00 11680 0.110E+00 0.627E+00
RMM: 22 -0.402841779169E+03 -0.24401E+01 -0.79546E-01 11525 0.908E-01 0.609E+00
RMM: 23 -0.406889122010E+03 -0.40473E+01 -0.17943E+00 12579 0.119E+00 0.725E+00
RMM: 24 -0.409069599548E+03 -0.21805E+01 -0.10423E+00 12188 0.912E-01 0.765E+00
RMM: 25 -0.410329946768E+03 -0.12603E+01 -0.47267E-01 11535 0.608E-01 0.697E+00
RMM: 26 -0.410355877804E+03 -0.25931E-01 -0.20361E-02 10857 0.151E-01 0.683E+00
RMM: 27 -0.410333171499E+03 0.22706E-01 -0.46315E-03 11072 0.682E-02 0.651E+00
RMM: 28 -0.410835965475E+03 -0.50279E+00 -0.23272E-02 11823 0.159E-01 0.678E+00
RMM: 29 -0.410784107129E+03 0.51858E-01 -0.11600E-03 10566 0.402E-02 0.681E+00
RMM: 30 -0.410763606175E+03 0.20501E-01 -0.14178E-02 13751 0.118E-01 0.598E+00
RMM: 31 -0.411354789218E+03 -0.59118E+00 -0.11637E-01 16956 0.386E-01 0.822E+00
RMM: 32 -0.410153614969E+03 0.12012E+01 -0.28746E-02 15058 0.211E-01 0.855E+00
RMM: 33 -0.409857967837E+03 0.29565E+00 -0.68471E-04 10366 0.401E-02 0.853E+00
RMM: 34 -0.409607741975E+03 0.25023E+00 -0.29135E-02 16268 0.204E-01 0.891E+00
RMM: 35 -0.408984659322E+03 0.62308E+00 -0.88007E-02 17645 0.352E-01 0.972E+00
RMM: 36 -0.407451188045E+03 0.15335E+01 -0.24863E-01 17909 0.568E-01 0.117E+01
RMM: 37 -0.408884613089E+03 -0.14334E+01 -0.64662E-01 17918 0.832E-01 0.903E+00
RMM: 38 -0.411121321870E+03 -0.22367E+01 -0.34943E-01 17920 0.610E-01 0.698E+00
RMM: 39 -0.413888947561E+03 -0.27676E+01 -0.47495E-01 17920 0.762E-01 0.541E+00
RMM: 40 -0.414481036312E+03 -0.59209E+00 -0.74290E-01 17920 0.102E+00 0.850E+00
RMM: 41 -0.413812399201E+03 0.66864E+00 -0.27598E-02 16569 0.203E-01 0.843E+00
RMM: 42 -0.413914469463E+03 -0.10207E+00 -0.25108E-02 15711 0.197E-01 0.747E+00
RMM: 43 -0.414952129609E+03 -0.10377E+01 -0.25948E-01 17915 0.590E-01 0.510E+00
RMM: 44 -0.415643660150E+03 -0.69153E+00 -0.17062E-01 17890 0.460E-01 0.356E+00
RMM: 45 -0.415818371994E+03 -0.17471E+00 -0.30669E-02 16234 0.211E-01 0.312E+00
RMM: 46 -0.416043153319E+03 -0.22478E+00 -0.19604E-02 15565 0.165E-01 0.270E+00
RMM: 47 -0.416189900701E+03 -0.14675E+00 -0.14299E-02 15247 0.139E-01 0.247E+00
RMM: 48 -0.416307440593E+03 -0.11754E+00 -0.84307E-03 14253 0.106E-01 0.218E+00
RMM: 49 -0.416509085038E+03 -0.20164E+00 -0.85924E-03 14155 0.987E-02 0.181E+00
RMM: 50 -0.416774383740E+03 -0.26530E+00 -0.96637E-03 14349 0.103E-01 0.144E+00
RMM: 51 -0.416978914342E+03 -0.20453E+00 -0.17401E-02 15447 0.133E-01 0.110E+00
RMM: 52 -0.417137876253E+03 -0.15896E+00 -0.23870E-03 11708 0.550E-02 0.972E-01
RMM: 53 -0.417218063155E+03 -0.80187E-01 -0.24489E-03 11603 0.539E-02 0.958E-01
RMM: 54 -0.417256927696E+03 -0.38865E-01 -0.22428E-03 11554 0.507E-02 0.946E-01
RMM: 55 -0.417382964623E+03 -0.12604E+00 -0.37208E-03 12303 0.692E-02 0.881E-01
RMM: 56 -0.417437367199E+03 -0.54403E-01 -0.24950E-03 11546 0.622E-02 0.674E-01
RMM: 57 -0.417488562184E+03 -0.51195E-01 -0.19474E-03 11435 0.474E-02 0.567E-01
RMM: 58 -0.417519962853E+03 -0.31401E-01 -0.88962E-04 10841 0.325E-02 0.563E-01
RMM: 59 -0.417555515802E+03 -0.35553E-01 -0.10411E-03 11202 0.337E-02 0.581E-01
RMM: 60 -0.417622988959E+03 -0.67473E-01 -0.14288E-03 11643 0.385E-02 0.658E-01
RMM: 61 -0.417653558900E+03 -0.30570E-01 -0.29640E-04 10580 0.185E-02 0.624E-01
RMM: 62 -0.417692483227E+03 -0.38924E-01 -0.76453E-04 11521 0.261E-02 0.500E-01
RMM: 63 -0.417721383645E+03 -0.28900E-01 -0.41955E-04 11144 0.181E-02 0.457E-01
RMM: 64 -0.417738002987E+03 -0.16619E-01 -0.30010E-04 11129 0.156E-02 0.356E-01
RMM: 65 -0.417746117378E+03 -0.81144E-02 -0.18233E-04 10957 0.131E-02 0.267E-01
RMM: 66 -0.417750083843E+03 -0.39665E-02 -0.98918E-05 9894 0.105E-02 0.187E-01
RMM: 67 -0.417752790095E+03 -0.27063E-02 -0.70262E-05 8755 0.769E-03 0.153E-01
RMM: 68 -0.417753223030E+03 -0.43294E-03 -0.39581E-05 8174 0.704E-03 0.125E-01
RMM: 69 -0.417753098494E+03 0.12454E-03 -0.23424E-05 7292 0.472E-03 0.102E-01
RMM: 70 -0.417753084723E+03 0.13770E-04 -0.17453E-05 6949 0.438E-03 0.675E-02
RMM: 71 -0.417752256051E+03 0.82867E-03 -0.72873E-05 8737 0.750E-03 0.264E-02
RMM: 72 -0.417753177309E+03 -0.92126E-03 -0.10410E-05 6807 0.334E-03 0.229E-02
RMM: 73 -0.417753635951E+03 -0.45864E-03 -0.55690E-06 6571 0.218E-03 0.195E-02
RMM: 74 -0.417754076606E+03 -0.44065E-03 -0.33463E-06 5513 0.163E-03 0.186E-02
RMM: 75 -0.417754266280E+03 -0.18967E-03 -0.31102E-06 5721 0.157E-03 0.148E-02
RMM: 76 -0.417754332818E+03 -0.66538E-04 -0.23514E-06 4996 0.136E-03 0.142E-02
RMM: 77 -0.417754388813E+03 -0.55995E-04 -0.71999E-07 3504 0.103E-03 0.122E-02
RMM: 78 -0.417754424308E+03 -0.35495E-04 -0.14214E-06 5059 0.130E-03 0.884E-03
RMM: 79 -0.417754434011E+03 -0.97031E-05 -0.85398E-07 4115 0.109E-03
1 F= -.45539328E+03 E0= -.45539378E+03 d E =0.150219E-02 mag= 0.0049