iterations/neb1_max2_image02_iter25_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422471355355E+04 0.42247E+04 -0.25383E+05 8992 0.103E+03
DAV: 2 -0.103010903299E+03 -0.43277E+04 -0.39227E+04 10960 0.248E+02
DAV: 3 -0.427051579736E+03 -0.32404E+03 -0.30256E+03 10232 0.657E+01
DAV: 4 -0.435583394675E+03 -0.85318E+01 -0.84293E+01 10776 0.107E+01
DAV: 5 -0.435880206977E+03 -0.29681E+00 -0.29599E+00 11056 0.194E+00 0.995E+01
RMM: 6 -0.389706346818E+03 0.46174E+02 -0.11212E+02 9703 0.146E+01 0.739E+01
RMM: 7 -0.821036556503E+03 -0.43133E+03 -0.46374E+02 11393 0.196E+01 0.151E+02
RMM: 8 -0.495357863167E+03 0.32568E+03 -0.10971E+02 9963 0.111E+01 0.913E+01
RMM: 9 -0.430345126229E+03 0.65013E+02 -0.66767E+01 10164 0.106E+01 0.625E+01
RMM: 10 -0.374058386336E+03 0.56287E+02 -0.38486E+01 10323 0.799E+00 0.293E+01
RMM: 11 -0.389002845710E+03 -0.14944E+02 -0.18490E+01 10410 0.481E+00 0.444E+01
RMM: 12 -0.374325734178E+03 0.14677E+02 -0.49553E+00 9962 0.307E+00 0.255E+01
RMM: 13 -0.372432863309E+03 0.18929E+01 -0.20173E+00 10202 0.199E+00 0.178E+01
RMM: 14 -0.374773731713E+03 -0.23409E+01 -0.13062E+00 10205 0.153E+00 0.130E+01
RMM: 15 -0.380972535022E+03 -0.61988E+01 -0.15684E+00 10611 0.164E+00 0.153E+01
RMM: 16 -0.384967624380E+03 -0.39951E+01 -0.19759E+00 10916 0.175E+00 0.130E+01
RMM: 17 -0.388062802586E+03 -0.30952E+01 -0.13300E+00 10710 0.140E+00 0.102E+01
RMM: 18 -0.392367985296E+03 -0.43052E+01 -0.12808E+00 11027 0.133E+00 0.951E+00
RMM: 19 -0.395344214496E+03 -0.29762E+01 -0.97978E-01 11020 0.115E+00 0.732E+00
RMM: 20 -0.397593800081E+03 -0.22496E+01 -0.42507E-01 10559 0.771E-01 0.664E+00
RMM: 21 -0.399353648560E+03 -0.17598E+01 -0.37805E-01 10886 0.698E-01 0.682E+00
RMM: 22 -0.401810265815E+03 -0.24566E+01 -0.81089E-01 11891 0.953E-01 0.752E+00
RMM: 23 -0.404633737671E+03 -0.28235E+01 -0.13363E+00 12540 0.107E+00 0.600E+00
RMM: 24 -0.408249956422E+03 -0.36162E+01 -0.15948E+00 13034 0.111E+00 0.511E+00
RMM: 25 -0.410159979940E+03 -0.19100E+01 -0.34429E-01 11479 0.556E-01 0.480E+00
RMM: 26 -0.410793167900E+03 -0.63319E+00 -0.50499E-02 10512 0.223E-01 0.479E+00
RMM: 27 -0.411028034088E+03 -0.23487E+00 -0.21390E-02 10655 0.130E-01 0.479E+00
RMM: 28 -0.411030118368E+03 -0.20843E-02 -0.31425E-03 10859 0.557E-02 0.478E+00
RMM: 29 -0.410788142498E+03 0.24198E+00 -0.27568E-02 12116 0.195E-01 0.462E+00
RMM: 30 -0.411125563443E+03 -0.33742E+00 -0.87643E-02 14947 0.366E-01 0.485E+00
RMM: 31 -0.411282542271E+03 -0.15698E+00 -0.59911E-02 14368 0.310E-01 0.529E+00
RMM: 32 -0.411295049209E+03 -0.12507E-01 -0.18272E-03 10323 0.576E-02 0.539E+00
RMM: 33 -0.412466934682E+03 -0.11719E+01 -0.32483E-01 17474 0.708E-01 0.545E+00
RMM: 34 -0.414042524348E+03 -0.15756E+01 -0.51308E-01 17668 0.712E-01 0.952E+00
RMM: 35 -0.414513176981E+03 -0.47065E+00 -0.35437E-02 13760 0.221E-01 0.979E+00
RMM: 36 -0.414130466958E+03 0.38271E+00 -0.22275E-01 16955 0.444E-01 0.538E+00
RMM: 37 -0.414518166904E+03 -0.38770E+00 -0.12019E-01 16511 0.410E-01 0.439E+00
RMM: 38 -0.414766984408E+03 -0.24882E+00 -0.25101E-02 14375 0.183E-01 0.781E+00
RMM: 39 -0.414385330125E+03 0.38165E+00 -0.10421E-02 12237 0.153E-01 0.357E+00
RMM: 40 -0.415281535164E+03 -0.89621E+00 -0.67217E-02 15862 0.295E-01 0.767E+00
RMM: 41 -0.414917431380E+03 0.36410E+00 -0.31197E-02 14673 0.222E-01 0.257E+00
RMM: 42 -0.415509498112E+03 -0.59207E+00 -0.13315E-02 13130 0.159E-01 0.211E+00
RMM: 43 -0.415693434722E+03 -0.18394E+00 -0.35589E-03 10899 0.711E-02 0.280E+00
RMM: 44 -0.415723861782E+03 -0.30427E-01 -0.35996E-03 10771 0.673E-02 0.253E+00
RMM: 45 -0.415817039336E+03 -0.93178E-01 -0.34443E-03 11516 0.661E-02 0.295E+00
RMM: 46 -0.415966487259E+03 -0.14945E+00 -0.12163E-02 12161 0.993E-02 0.550E+00
RMM: 47 -0.415758847744E+03 0.20764E+00 -0.27114E-02 14926 0.188E-01 0.126E+00
RMM: 48 -0.416141684042E+03 -0.38284E+00 -0.10838E-02 13801 0.133E-01 0.960E-01
RMM: 49 -0.416255869182E+03 -0.11419E+00 -0.11315E-02 13745 0.107E-01 0.739E-01
RMM: 50 -0.416369654440E+03 -0.11379E+00 -0.12202E-02 13816 0.104E-01 0.773E-01
RMM: 51 -0.416440261142E+03 -0.70607E-01 -0.29910E-03 11703 0.610E-02 0.666E-01
RMM: 52 -0.416522712920E+03 -0.82452E-01 -0.27755E-03 11454 0.566E-02 0.631E-01
RMM: 53 -0.416586458842E+03 -0.63746E-01 -0.39716E-03 11996 0.613E-02 0.694E-01
RMM: 54 -0.416633804209E+03 -0.47345E-01 -0.48125E-03 12236 0.629E-02 0.844E-01
RMM: 55 -0.416677819638E+03 -0.44015E-01 -0.52869E-03 12128 0.661E-02 0.110E+00
RMM: 56 -0.416683159547E+03 -0.53399E-02 -0.33625E-03 11532 0.497E-02 0.132E+00
RMM: 57 -0.416673472590E+03 0.96870E-02 -0.26453E-03 11564 0.423E-02 0.151E+00
RMM: 58 -0.416650281737E+03 0.23191E-01 -0.16262E-03 11209 0.323E-02 0.166E+00
RMM: 59 -0.416633299234E+03 0.16983E-01 -0.93588E-04 10728 0.249E-02 0.179E+00
RMM: 60 -0.416628028485E+03 0.52707E-02 -0.10277E-04 8787 0.102E-02 0.182E+00
RMM: 61 -0.416691405763E+03 -0.63377E-01 -0.41686E-03 12633 0.413E-02 0.152E+00
RMM: 62 -0.416743278018E+03 -0.51872E-01 -0.50377E-03 13678 0.479E-02 0.118E+00
RMM: 63 -0.416810724408E+03 -0.67446E-01 -0.98516E-03 14698 0.644E-02 0.743E-01
RMM: 64 -0.416857933312E+03 -0.47209E-01 -0.69938E-03 13848 0.543E-02 0.462E-01
RMM: 65 -0.416872821923E+03 -0.14889E-01 -0.55808E-04 11549 0.200E-02 0.425E-01
RMM: 66 -0.416877926331E+03 -0.51044E-02 -0.42920E-04 11122 0.178E-02 0.410E-01
RMM: 67 -0.416891356753E+03 -0.13430E-01 -0.24811E-04 11139 0.139E-02 0.401E-01
RMM: 68 -0.416896595262E+03 -0.52385E-02 -0.18154E-04 10644 0.120E-02 0.391E-01
RMM: 69 -0.416898572430E+03 -0.19772E-02 -0.93359E-05 9292 0.860E-03 0.383E-01
RMM: 70 -0.416898128686E+03 0.44374E-03 -0.84347E-05 8467 0.779E-03 0.379E-01
RMM: 71 -0.416897554398E+03 0.57429E-03 -0.20187E-04 9334 0.107E-02 0.383E-01
RMM: 72 -0.416896868063E+03 0.68634E-03 -0.65338E-05 8510 0.652E-03 0.378E-01
RMM: 73 -0.416895599551E+03 0.12685E-02 -0.60679E-05 8150 0.594E-03 0.372E-01
RMM: 74 -0.416894401716E+03 0.11978E-02 -0.57669E-05 7984 0.559E-03 0.363E-01
RMM: 75 -0.416893248548E+03 0.11532E-02 -0.62626E-05 8032 0.570E-03 0.347E-01
RMM: 76 -0.416891895666E+03 0.13529E-02 -0.51336E-05 7837 0.547E-03 0.342E-01
RMM: 77 -0.416890810269E+03 0.10854E-02 -0.38025E-05 7320 0.461E-03 0.334E-01
RMM: 78 -0.416886486169E+03 0.43241E-02 -0.55044E-04 12096 0.157E-02 0.290E-01
RMM: 79 -0.416883701737E+03 0.27844E-02 -0.32470E-04 11015 0.123E-02 0.259E-01
RMM: 80 -0.416880897968E+03 0.28038E-02 -0.53423E-04 11969 0.156E-02 0.217E-01
RMM: 81 -0.416878129132E+03 0.27688E-02 -0.81085E-04 12892 0.188E-02 0.168E-01
RMM: 82 -0.416877729218E+03 0.39991E-03 -0.44063E-05 7880 0.528E-03 0.158E-01
RMM: 83 -0.416877366401E+03 0.36282E-03 -0.26278E-05 7025 0.411E-03 0.152E-01
RMM: 84 -0.416877025001E+03 0.34140E-03 -0.28052E-05 6976 0.398E-03 0.142E-01
RMM: 85 -0.416876132805E+03 0.89220E-03 -0.26600E-04 10539 0.111E-02 0.107E-01
RMM: 86 -0.416875186711E+03 0.94609E-03 -0.53116E-04 11940 0.154E-02 0.678E-02
RMM: 87 -0.416875308040E+03 -0.12133E-03 -0.12046E-05 6835 0.333E-03 0.689E-02
RMM: 88 -0.416875157765E+03 0.15028E-03 -0.86638E-05 8127 0.652E-03 0.417E-02
RMM: 89 -0.416875138848E+03 0.18917E-04 -0.74498E-05 8236 0.630E-03 0.159E-02
RMM: 90 -0.416875169235E+03 -0.30387E-04 -0.25376E-05 6883 0.402E-03 0.964E-03
RMM: 91 -0.416875146984E+03 0.22251E-04 -0.22288E-06 5113 0.170E-03 0.763E-03
RMM: 92 -0.416875161111E+03 -0.14127E-04 -0.26416E-07 3109 0.984E-04 0.626E-03
RMM: 93 -0.416875178781E+03 -0.17670E-04 -0.26683E-07 3135 0.998E-04 0.310E-03
RMM: 94 -0.416875174573E+03 0.42073E-05 -0.88824E-07 3844 0.117E-03
1 F= -.45457719E+03 E0= -.45457688E+03 d E =-.942900E-03 mag= 0.0006