iterations/neb0_image02_iter2_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.427304737099E+04 0.42730E+04 -0.25423E+05 9024 0.103E+03
DAV: 2 -0.900117201044E+02 -0.43631E+04 -0.39644E+04 11024 0.249E+02
DAV: 3 -0.417793030815E+03 -0.32778E+03 -0.30578E+03 10304 0.660E+01
DAV: 4 -0.426280119608E+03 -0.84871E+01 -0.83945E+01 10792 0.107E+01
DAV: 5 -0.426568252296E+03 -0.28813E+00 -0.28737E+00 11216 0.189E+00 0.116E+02
RMM: 6 -0.380625320614E+03 0.45943E+02 -0.10716E+02 9691 0.143E+01 0.817E+01
RMM: 7 -0.114262300964E+04 -0.76200E+03 -0.84780E+02 13010 0.265E+01 0.177E+02
RMM: 8 -0.532631153652E+03 0.60999E+03 -0.15209E+02 9955 0.132E+01 0.106E+02
RMM: 9 -0.463421025151E+03 0.69210E+02 -0.91143E+01 10138 0.120E+01 0.805E+01
RMM: 10 -0.383847677705E+03 0.79573E+02 -0.57557E+01 10380 0.978E+00 0.431E+01
RMM: 11 -0.359963820974E+03 0.23884E+02 -0.22677E+01 10363 0.527E+00 0.324E+01
RMM: 12 -0.361207829321E+03 -0.12440E+01 -0.80145E+00 10220 0.353E+00 0.312E+01
RMM: 13 -0.361243696445E+03 -0.35867E-01 -0.35860E+00 10234 0.255E+00 0.203E+01
RMM: 14 -0.361970158336E+03 -0.72646E+00 -0.14050E+00 10202 0.153E+00 0.162E+01
RMM: 15 -0.363946160690E+03 -0.19760E+01 -0.10773E+00 10347 0.133E+00 0.124E+01
RMM: 16 -0.369563119093E+03 -0.56170E+01 -0.16863E+00 11037 0.167E+00 0.143E+01
RMM: 17 -0.375216202073E+03 -0.56531E+01 -0.18455E+00 11378 0.167E+00 0.172E+01
RMM: 18 -0.375637173768E+03 -0.42097E+00 -0.11046E+00 10804 0.128E+00 0.111E+01
RMM: 19 -0.379209253853E+03 -0.35721E+01 -0.15641E+00 11547 0.137E+00 0.858E+00
RMM: 20 -0.380712471624E+03 -0.15032E+01 -0.11590E+00 11200 0.123E+00 0.858E+00
RMM: 21 -0.381637158814E+03 -0.92469E+00 -0.12260E+00 11326 0.117E+00 0.899E+00
RMM: 22 -0.382873548466E+03 -0.12364E+01 -0.63229E-01 11508 0.876E-01 0.767E+00
RMM: 23 -0.385157882709E+03 -0.22843E+01 -0.11353E+00 12438 0.109E+00 0.100E+01
RMM: 24 -0.385726094368E+03 -0.56821E+00 -0.81305E-02 10250 0.357E-01 0.688E+00
RMM: 25 -0.389497442853E+03 -0.37713E+01 -0.75338E-01 13053 0.862E-01 0.763E+00
RMM: 26 -0.392377592291E+03 -0.28801E+01 -0.12934E+00 13893 0.106E+00 0.745E+00
RMM: 27 -0.394121852441E+03 -0.17443E+01 -0.37212E-01 12336 0.590E-01 0.552E+00
RMM: 28 -0.396177438282E+03 -0.20556E+01 -0.22957E-01 11614 0.450E-01 0.638E+00
RMM: 29 -0.396491974182E+03 -0.31454E+00 -0.33066E-02 10610 0.192E-01 0.658E+00
RMM: 30 -0.396305298061E+03 0.18668E+00 -0.72787E-03 10165 0.106E-01 0.729E+00
RMM: 31 -0.395937758866E+03 0.36754E+00 -0.15611E-02 10705 0.135E-01 0.734E+00
RMM: 32 -0.395395112123E+03 0.54265E+00 -0.43348E-02 12825 0.236E-01 0.508E+00
RMM: 33 -0.395774250109E+03 -0.37914E+00 -0.10628E-01 14919 0.404E-01 0.671E+00
RMM: 34 -0.395571526984E+03 0.20272E+00 -0.83956E-02 14098 0.365E-01 0.607E+00
RMM: 35 -0.396142258954E+03 -0.57073E+00 -0.99371E-02 13721 0.388E-01 0.507E+00
RMM: 36 -0.397428907596E+03 -0.12866E+01 -0.53135E-01 16393 0.753E-01 0.602E+00
RMM: 37 -0.399061264055E+03 -0.16324E+01 -0.74969E-01 16578 0.887E-01 0.485E+00
RMM: 38 -0.401007490767E+03 -0.19462E+01 -0.34044E+00 16109 0.964E-01 0.479E+00
RMM: 39 -0.401196402536E+03 -0.18891E+00 -0.54160E-01 13918 0.456E-01 0.449E+00
RMM: 40 -0.401160143565E+03 0.36259E-01 -0.14228E-01 12668 0.253E-01 0.440E+00
RMM: 41 -0.401191554386E+03 -0.31411E-01 -0.51336E-02 12405 0.156E-01 0.446E+00
RMM: 42 -0.401184343619E+03 0.72108E-02 -0.16855E-02 12099 0.861E-02 0.455E+00
RMM: 43 -0.400982380806E+03 0.20196E+00 -0.24236E+00 16591 0.105E+00 0.433E+00
RMM: 44 -0.399578051476E+03 0.14043E+01 -0.33310E+00 17126 0.127E+00 0.536E+00
RMM: 45 -0.397730345678E+03 0.18477E+01 -0.56888E-01 16849 0.650E-01 0.685E+00
RMM: 46 -0.395628945644E+03 0.21014E+01 -0.28715E-01 15643 0.465E-01 0.615E+00
RMM: 47 -0.396588587105E+03 -0.95964E+00 -0.43842E-02 12663 0.193E-01 0.619E+00
RMM: 48 -0.398602266085E+03 -0.20137E+01 -0.25510E-01 15646 0.427E-01 0.451E+00
RMM: 49 -0.401126003323E+03 -0.25237E+01 -0.23909E+00 16499 0.861E-01 0.373E+00
RMM: 50 -0.402285743817E+03 -0.11597E+01 -0.20548E+00 16721 0.119E+00 0.323E+00
RMM: 51 -0.402689218321E+03 -0.40347E+00 -0.29487E+00 17429 0.814E-01 0.298E+00
RMM: 52 -0.402631335533E+03 0.57883E-01 -0.29820E-01 14904 0.225E-01 0.224E+00
RMM: 53 -0.402664969313E+03 -0.33634E-01 -0.79293E-02 13531 0.110E-01 0.247E+00
RMM: 54 -0.402645982614E+03 0.18987E-01 -0.61649E-03 11985 0.411E-02 0.233E+00
RMM: 55 -0.402718942512E+03 -0.72960E-01 -0.34127E-02 14485 0.142E-01 0.320E+00
RMM: 56 -0.402529185627E+03 0.18976E+00 -0.15802E-01 16788 0.280E-01 0.445E+00
RMM: 57 -0.402340693192E+03 0.18849E+00 -0.18487E-02 13837 0.790E-02 0.457E+00
RMM: 58 -0.402300964002E+03 0.39729E-01 -0.49954E-03 12001 0.547E-02 0.451E+00
RMM: 59 -0.402306191182E+03 -0.52272E-02 -0.51837E-03 12424 0.472E-02 0.448E+00
RMM: 60 -0.402309758004E+03 -0.35668E-02 -0.66627E-02 16332 0.160E-01 0.400E+00
RMM: 61 -0.402335073470E+03 -0.25315E-01 -0.16222E-01 17248 0.240E-01 0.316E+00
RMM: 62 -0.402626952740E+03 -0.29188E+00 -0.58999E-02 16551 0.147E-01 0.322E+00
RMM: 63 -0.402917203614E+03 -0.29025E+00 -0.16557E-01 17412 0.271E-01 0.425E+00
RMM: 64 -0.402842679275E+03 0.74524E-01 -0.94362E-03 13688 0.576E-02 0.428E+00
RMM: 65 -0.402871271231E+03 -0.28592E-01 -0.91290E-03 13586 0.732E-02 0.339E+00
RMM: 66 -0.402996103550E+03 -0.12483E+00 -0.71933E-03 15425 0.888E-02 0.311E+00
RMM: 67 -0.403198035421E+03 -0.20193E+00 -0.76624E-02 16943 0.227E-01 0.392E+00
RMM: 68 -0.403305024973E+03 -0.10699E+00 -0.39023E-02 17064 0.175E-01 0.327E+00
RMM: 69 -0.403613676301E+03 -0.30865E+00 -0.20625E-01 17430 0.321E-01 0.226E+00
RMM: 70 -0.403727151722E+03 -0.11348E+00 -0.88140E-03 14647 0.817E-02 0.210E+00
RMM: 71 -0.403788061957E+03 -0.60910E-01 -0.40848E-02 16401 0.151E-01 0.158E+00
RMM: 72 -0.403845941115E+03 -0.57879E-01 -0.65001E-03 14585 0.718E-02 0.138E+00
RMM: 73 -0.403900792859E+03 -0.54852E-01 -0.17300E-02 16173 0.121E-01 0.118E+00
RMM: 74 -0.403966152386E+03 -0.65360E-01 -0.13330E-02 15699 0.104E-01 0.114E+00
RMM: 75 -0.403972024588E+03 -0.58722E-02 -0.11132E-02 14712 0.789E-02 0.118E+00
RMM: 76 -0.403954283575E+03 0.17741E-01 -0.41997E-03 13761 0.620E-02 0.120E+00
RMM: 77 -0.403950114230E+03 0.41693E-02 -0.76836E-03 14017 0.646E-02 0.129E+00
RMM: 78 -0.403943619356E+03 0.64949E-02 -0.28268E-03 12587 0.371E-02 0.134E+00
RMM: 79 -0.403983670790E+03 -0.40051E-01 -0.23394E-02 14962 0.113E-01 0.115E+00
RMM: 80 -0.404038768189E+03 -0.55097E-01 -0.43137E-02 16378 0.142E-01 0.944E-01
RMM: 81 -0.404059301845E+03 -0.20534E-01 -0.58817E-02 16896 0.171E-01 0.792E-01
RMM: 82 -0.404069364946E+03 -0.10063E-01 -0.11306E-02 15005 0.746E-02 0.804E-01
RMM: 83 -0.404068475532E+03 0.88941E-03 -0.34578E-04 11198 0.204E-02 0.808E-01
RMM: 84 -0.404070046465E+03 -0.15709E-02 -0.18490E-04 10623 0.141E-02 0.805E-01
RMM: 85 -0.404072179344E+03 -0.21329E-02 -0.45806E-04 10989 0.180E-02 0.824E-01
RMM: 86 -0.404068298890E+03 0.38805E-02 -0.18386E-03 13881 0.386E-02 0.831E-01
RMM: 87 -0.404078788487E+03 -0.10490E-01 -0.14336E-03 13283 0.334E-02 0.786E-01
RMM: 88 -0.404099142831E+03 -0.20354E-01 -0.57406E-03 15371 0.621E-02 0.830E-01
RMM: 89 -0.404093591011E+03 0.55518E-02 -0.16491E-02 16663 0.959E-02 0.928E-01
RMM: 90 -0.404125377698E+03 -0.31787E-01 -0.19144E-02 16323 0.106E-01 0.811E-01
RMM: 91 -0.404123018201E+03 0.23595E-02 -0.26410E-02 17302 0.122E-01 0.923E-01
RMM: 92 -0.404152995614E+03 -0.29977E-01 -0.11755E-02 16401 0.789E-02 0.972E-01
RMM: 93 -0.404172139719E+03 -0.19144E-01 -0.58751E-03 15620 0.578E-02 0.100E+00
RMM: 94 -0.404202696298E+03 -0.30557E-01 -0.19218E-02 17004 0.103E-01 0.102E+00
RMM: 95 -0.404236259172E+03 -0.33563E-01 -0.33133E-02 17358 0.133E-01 0.104E+00
RMM: 96 -0.404250653416E+03 -0.14394E-01 -0.39870E-03 15268 0.519E-02 0.109E+00
RMM: 97 -0.404263922182E+03 -0.13269E-01 -0.15365E-02 16617 0.904E-02 0.151E+00
RMM: 98 -0.404266329306E+03 -0.24071E-02 -0.26612E-03 13072 0.560E-02 0.130E+00
RMM: 99 -0.404269706352E+03 -0.33770E-02 -0.57167E-04 11126 0.190E-02 0.123E+00
RMM: 100 -0.404291218919E+03 -0.21513E-01 -0.81333E-03 15861 0.679E-02 0.993E-01
RMM: 101 -0.404324844203E+03 -0.33625E-01 -0.19991E-03 14530 0.407E-02 0.933E-01
RMM: 102 -0.404362606297E+03 -0.37762E-01 -0.31484E-03 14520 0.430E-02 0.756E-01
RMM: 103 -0.404415545051E+03 -0.52939E-01 -0.14018E-02 16791 0.880E-02 0.553E-01
RMM: 104 -0.404454313235E+03 -0.38768E-01 -0.10627E-03 13717 0.332E-02 0.488E-01
RMM: 105 -0.404482867206E+03 -0.28554E-01 -0.46798E-04 11781 0.203E-02 0.393E-01
RMM: 106 -0.404491294981E+03 -0.84278E-02 -0.25416E-02 17172 0.121E-01 0.124E-01
RMM: 107 -0.404497046952E+03 -0.57520E-02 -0.66717E-04 12677 0.333E-02 0.921E-02
RMM: 108 -0.404499176098E+03 -0.21291E-02 -0.14840E-04 9235 0.140E-02 0.898E-02
RMM: 109 -0.404500132923E+03 -0.95682E-03 -0.37992E-04 10364 0.159E-02 0.877E-02
RMM: 110 -0.404501543984E+03 -0.14111E-02 -0.60371E-05 8096 0.711E-03 0.876E-02
RMM: 111 -0.404502198939E+03 -0.65496E-03 -0.16408E-05 6971 0.473E-03 0.868E-02
RMM: 112 -0.404503398077E+03 -0.11991E-02 -0.10880E-05 6814 0.336E-03 0.937E-02
RMM: 113 -0.404503965379E+03 -0.56730E-03 -0.21925E-05 7125 0.408E-03 0.102E-01
RMM: 114 -0.404504391635E+03 -0.42626E-03 -0.38993E-05 7327 0.486E-03 0.109E-01
RMM: 115 -0.404504687278E+03 -0.29564E-03 -0.30726E-05 7036 0.436E-03 0.121E-01
RMM: 116 -0.404504458684E+03 0.22859E-03 -0.21243E-05 6876 0.372E-03 0.125E-01
RMM: 117 -0.404504500180E+03 -0.41496E-04 -0.99650E-06 5861 0.270E-03 0.130E-01
RMM: 118 -0.404504526592E+03 -0.26412E-04 -0.26023E-06 4510 0.169E-03 0.132E-01
RMM: 119 -0.404504539473E+03 -0.12881E-04 -0.53326E-07 3413 0.112E-03 0.131E-01
RMM: 120 -0.404504539802E+03 -0.32866E-06 -0.26575E-07 2903 0.964E-04
1 F= -.44232388E+03 E0= -.44232440E+03 d E =0.156635E-02 mag= 0.1949