iterations/neb1_max2_image04_iter5_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422698582794E+04 0.42270E+04 -0.25383E+05 8992 0.103E+03
DAV: 2 -0.100601903081E+03 -0.43276E+04 -0.39253E+04 10976 0.248E+02
DAV: 3 -0.425013828092E+03 -0.32441E+03 -0.30308E+03 10272 0.657E+01
DAV: 4 -0.433633787978E+03 -0.86200E+01 -0.85100E+01 10824 0.108E+01
DAV: 5 -0.433936292761E+03 -0.30250E+00 -0.30173E+00 11056 0.196E+00 0.999E+01
RMM: 6 -0.389720764504E+03 0.44216E+02 -0.10690E+02 9675 0.144E+01 0.782E+01
RMM: 7 -0.827647433821E+03 -0.43793E+03 -0.44481E+02 11533 0.191E+01 0.154E+02
RMM: 8 -0.485585748311E+03 0.34206E+03 -0.10186E+02 10021 0.109E+01 0.866E+01
RMM: 9 -0.429730012896E+03 0.55856E+02 -0.78530E+01 10326 0.114E+01 0.642E+01
RMM: 10 -0.366701235978E+03 0.63029E+02 -0.31871E+01 10272 0.714E+00 0.256E+01
RMM: 11 -0.365908616585E+03 0.79262E+00 -0.16192E+01 10183 0.499E+00 0.236E+01
RMM: 12 -0.365950896865E+03 -0.42280E-01 -0.48605E+00 10278 0.277E+00 0.152E+01
RMM: 13 -0.372985038070E+03 -0.70341E+01 -0.33175E+00 10276 0.244E+00 0.152E+01
RMM: 14 -0.375019912939E+03 -0.20349E+01 -0.19037E+00 10188 0.179E+00 0.124E+01
RMM: 15 -0.378066928041E+03 -0.30470E+01 -0.11414E+00 10253 0.135E+00 0.999E+00
RMM: 16 -0.384038355584E+03 -0.59714E+01 -0.17732E+00 11074 0.155E+00 0.804E+00
RMM: 17 -0.387834245707E+03 -0.37959E+01 -0.87222E-01 10601 0.116E+00 0.654E+00
RMM: 18 -0.391628036003E+03 -0.37938E+01 -0.78969E-01 10906 0.996E-01 0.594E+00
RMM: 19 -0.394960370874E+03 -0.33323E+01 -0.92435E-01 11463 0.102E+00 0.641E+00
RMM: 20 -0.397888440788E+03 -0.29281E+01 -0.90279E-01 11658 0.958E-01 0.530E+00
RMM: 21 -0.400687164415E+03 -0.27987E+01 -0.66788E-01 11537 0.808E-01 0.479E+00
RMM: 22 -0.406618247486E+03 -0.59311E+01 -0.25184E+00 13300 0.138E+00 0.484E+00
RMM: 23 -0.409066127947E+03 -0.24479E+01 -0.99111E-01 12383 0.886E-01 0.510E+00
RMM: 24 -0.409485233048E+03 -0.41911E+00 -0.14127E-01 10832 0.365E-01 0.501E+00
RMM: 25 -0.409362720653E+03 0.12251E+00 -0.13446E-02 10644 0.126E-01 0.502E+00
RMM: 26 -0.408781657956E+03 0.58106E+00 -0.80578E-02 11519 0.323E-01 0.462E+00
RMM: 27 -0.409013502068E+03 -0.23184E+00 -0.17448E-01 13615 0.498E-01 0.505E+00
RMM: 28 -0.408280789731E+03 0.73271E+00 -0.22404E-01 14073 0.593E-01 0.638E+00
RMM: 29 -0.409285773437E+03 -0.10050E+01 -0.10820E-01 11892 0.412E-01 0.568E+00
RMM: 30 -0.410310201275E+03 -0.10244E+01 -0.40234E-01 14469 0.682E-01 0.648E+00
RMM: 31 -0.410865539340E+03 -0.55534E+00 -0.17714E-01 13454 0.473E-01 0.633E+00
RMM: 32 -0.411900878335E+03 -0.10353E+01 -0.37886E-01 14469 0.631E-01 0.361E+00
RMM: 33 -0.412102198161E+03 -0.20132E+00 -0.22433E-02 10687 0.186E-01 0.293E+00
RMM: 34 -0.412242097402E+03 -0.13990E+00 -0.24624E-02 10711 0.207E-01 0.273E+00
RMM: 35 -0.412561972772E+03 -0.31988E+00 -0.39136E-02 11515 0.249E-01 0.270E+00
RMM: 36 -0.412639637845E+03 -0.77665E-01 -0.22134E-02 10802 0.194E-01 0.161E+00
RMM: 37 -0.412919888676E+03 -0.28025E+00 -0.21220E-02 10776 0.174E-01 0.127E+00
RMM: 38 -0.413127442245E+03 -0.20755E+00 -0.12275E-02 10533 0.134E-01 0.825E-01
RMM: 39 -0.413333618694E+03 -0.20618E+00 -0.10456E-02 10854 0.111E-01 0.801E-01
RMM: 40 -0.413476750326E+03 -0.14313E+00 -0.12844E-02 11354 0.113E-01 0.626E-01
RMM: 41 -0.413568457187E+03 -0.91707E-01 -0.11765E-02 11464 0.105E-01 0.688E-01
RMM: 42 -0.413633572354E+03 -0.65115E-01 -0.95824E-03 11491 0.924E-02 0.539E-01
RMM: 43 -0.413716300724E+03 -0.82728E-01 -0.99487E-03 11764 0.887E-02 0.399E-01
RMM: 44 -0.413802708301E+03 -0.86408E-01 -0.10955E-02 12084 0.872E-02 0.360E-01
RMM: 45 -0.413862858571E+03 -0.60150E-01 -0.61855E-03 11502 0.701E-02 0.307E-01
RMM: 46 -0.413928674608E+03 -0.65816E-01 -0.34326E-03 11245 0.486E-02 0.265E-01
RMM: 47 -0.413962838806E+03 -0.34164E-01 -0.97781E-04 10720 0.301E-02 0.217E-01
RMM: 48 -0.413993108165E+03 -0.30269E-01 -0.72918E-04 10831 0.267E-02 0.207E-01
RMM: 49 -0.414014951323E+03 -0.21843E-01 -0.43700E-04 10743 0.202E-02 0.101E-01
RMM: 50 -0.414032163373E+03 -0.17212E-01 -0.22362E-04 10321 0.139E-02 0.753E-02
RMM: 51 -0.414044951469E+03 -0.12788E-01 -0.29715E-04 11244 0.158E-02 0.990E-02
RMM: 52 -0.414051852993E+03 -0.69015E-02 -0.86121E-05 9409 0.941E-03 0.520E-02
RMM: 53 -0.414057904089E+03 -0.60511E-02 -0.80093E-05 9314 0.837E-03 0.787E-02
RMM: 54 -0.414060281190E+03 -0.23771E-02 -0.22918E-05 7490 0.478E-03 0.516E-02
RMM: 55 -0.414062503785E+03 -0.22226E-02 -0.32766E-05 7728 0.510E-03 0.245E-02
RMM: 56 -0.414062695688E+03 -0.19190E-03 -0.75654E-06 6294 0.321E-03 0.311E-02
RMM: 57 -0.414063673495E+03 -0.97781E-03 -0.11940E-05 6843 0.329E-03 0.256E-02
RMM: 58 -0.414064146079E+03 -0.47258E-03 -0.56343E-06 6378 0.229E-03 0.718E-03
RMM: 59 -0.414064388764E+03 -0.24268E-03 -0.28698E-06 5513 0.164E-03 0.766E-03
RMM: 60 -0.414064645260E+03 -0.25650E-03 -0.38630E-06 6223 0.177E-03 0.171E-02
RMM: 61 -0.414064728637E+03 -0.83377E-04 -0.97442E-07 3923 0.108E-03 0.105E-02
RMM: 62 -0.414064821924E+03 -0.93286E-04 -0.14862E-06 4783 0.122E-03 0.412E-03
RMM: 63 -0.414064954113E+03 -0.13219E-03 -0.10255E-06 4138 0.113E-03 0.741E-03
RMM: 64 -0.414065029925E+03 -0.75811E-04 -0.41364E-07 3139 0.914E-04 0.356E-03
RMM: 65 -0.414065085080E+03 -0.55155E-04 -0.45994E-07 3315 0.936E-04 0.397E-03
RMM: 66 -0.414065108432E+03 -0.23353E-04 -0.68506E-07 3462 0.986E-04 0.188E-03
RMM: 67 -0.414065135941E+03 -0.27509E-04 -0.19189E-07 2790 0.834E-04 0.133E-03
RMM: 68 -0.414065152196E+03 -0.16254E-04 -0.17956E-07 2744 0.854E-04 0.643E-04
RMM: 69 -0.414065162882E+03 -0.10687E-04 -0.14717E-07 2619 0.843E-04 0.132E-03
RMM: 70 -0.414065172507E+03 -0.96243E-05 -0.11877E-07 2554 0.838E-04
1 F= -.45181093E+03 E0= -.45181056E+03 d E =-.113821E-02 mag= 0.0001