iterations/neb0_image01_iter12_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422437801609E+04 0.42244E+04 -0.25386E+05 9000 0.103E+03
DAV: 2 -0.103869535638E+03 -0.43282E+04 -0.39340E+04 11040 0.248E+02
DAV: 3 -0.425777111633E+03 -0.32191E+03 -0.30131E+03 10248 0.655E+01
DAV: 4 -0.434350630915E+03 -0.85735E+01 -0.84200E+01 10992 0.107E+01
DAV: 5 -0.434639716608E+03 -0.28909E+00 -0.28834E+00 11040 0.191E+00 0.996E+01
RMM: 6 -0.387256895824E+03 0.47383E+02 -0.10693E+02 9706 0.143E+01 0.729E+01
RMM: 7 -0.792710227809E+03 -0.40545E+03 -0.42298E+02 11322 0.190E+01 0.148E+02
RMM: 8 -0.495132036772E+03 0.29758E+03 -0.11517E+02 10030 0.113E+01 0.896E+01
RMM: 9 -0.405521779443E+03 0.89610E+02 -0.68839E+01 10178 0.107E+01 0.533E+01
RMM: 10 -0.388006789953E+03 0.17515E+02 -0.39354E+01 10216 0.817E+00 0.406E+01
RMM: 11 -0.383067923551E+03 0.49389E+01 -0.20346E+01 10224 0.554E+00 0.407E+01
RMM: 12 -0.374925038580E+03 0.81429E+01 -0.65045E+00 9952 0.352E+00 0.259E+01
RMM: 13 -0.372910149856E+03 0.20149E+01 -0.29884E+00 10160 0.225E+00 0.199E+01
RMM: 14 -0.374028510415E+03 -0.11184E+01 -0.12744E+00 10246 0.150E+00 0.125E+01
RMM: 15 -0.379758622482E+03 -0.57301E+01 -0.12854E+00 10478 0.148E+00 0.156E+01
RMM: 16 -0.383945831445E+03 -0.41872E+01 -0.15286E+00 10772 0.161E+00 0.143E+01
RMM: 17 -0.386085192491E+03 -0.21394E+01 -0.96939E-01 10475 0.126E+00 0.940E+00
RMM: 18 -0.390825319505E+03 -0.47401E+01 -0.11831E+00 10978 0.129E+00 0.704E+00
RMM: 19 -0.394155411875E+03 -0.33301E+01 -0.76975E-01 10822 0.108E+00 0.661E+00
RMM: 20 -0.397969547555E+03 -0.38141E+01 -0.13229E+00 11657 0.125E+00 0.732E+00
RMM: 21 -0.399456551200E+03 -0.14870E+01 -0.40184E-01 10856 0.693E-01 0.748E+00
RMM: 22 -0.402343547298E+03 -0.28870E+01 -0.87507E-01 11766 0.917E-01 0.812E+00
RMM: 23 -0.406286070232E+03 -0.39425E+01 -0.17868E+00 12828 0.123E+00 0.863E+00
RMM: 24 -0.408629918344E+03 -0.23438E+01 -0.99788E-01 12247 0.884E-01 0.691E+00
RMM: 25 -0.409541789060E+03 -0.91187E+00 -0.72591E-02 10516 0.280E-01 0.654E+00
RMM: 26 -0.409833082388E+03 -0.29129E+00 -0.21906E-02 10669 0.129E-01 0.650E+00
RMM: 27 -0.410107492717E+03 -0.27441E+00 -0.14364E-02 10665 0.111E-01 0.665E+00
RMM: 28 -0.409968767336E+03 0.13873E+00 -0.17220E-03 10872 0.420E-02 0.660E+00
RMM: 29 -0.409865873487E+03 0.10289E+00 -0.38921E-03 10943 0.713E-02 0.705E+00
RMM: 30 -0.409245970447E+03 0.61990E+00 -0.34419E-02 14570 0.216E-01 0.780E+00
RMM: 31 -0.408049042143E+03 0.11969E+01 -0.12853E-01 16685 0.430E-01 0.887E+00
RMM: 32 -0.407390558561E+03 0.65848E+00 -0.54054E-02 15281 0.289E-01 0.869E+00
RMM: 33 -0.408096623053E+03 -0.70606E+00 -0.13580E-02 12848 0.149E-01 0.941E+00
RMM: 34 -0.410073782227E+03 -0.19772E+01 -0.43485E-01 17695 0.800E-01 0.867E+00
RMM: 35 -0.411299820334E+03 -0.12260E+01 -0.30442E-01 17425 0.661E-01 0.726E+00
RMM: 36 -0.412766193838E+03 -0.14664E+01 -0.42082E-01 17503 0.641E-01 0.624E+00
RMM: 37 -0.413109272521E+03 -0.34308E+00 -0.23664E-01 17456 0.591E-01 0.457E+00
RMM: 38 -0.414176117191E+03 -0.10668E+01 -0.22208E-01 17270 0.485E-01 0.292E+00
RMM: 39 -0.414497259520E+03 -0.32114E+00 -0.91145E-02 16169 0.343E-01 0.326E+00
RMM: 40 -0.414326288589E+03 0.17097E+00 -0.24597E-02 14406 0.180E-01 0.305E+00
RMM: 41 -0.414643664484E+03 -0.31738E+00 -0.34792E-02 14558 0.196E-01 0.267E+00
RMM: 42 -0.415237256117E+03 -0.59359E+00 -0.47000E-02 14872 0.221E-01 0.236E+00
RMM: 43 -0.415517479494E+03 -0.28022E+00 -0.12291E-02 12884 0.135E-01 0.205E+00
RMM: 44 -0.415745781915E+03 -0.22830E+00 -0.93070E-03 12361 0.118E-01 0.170E+00
RMM: 45 -0.415947393535E+03 -0.20161E+00 -0.57686E-03 11672 0.935E-02 0.129E+00
RMM: 46 -0.416100673090E+03 -0.15328E+00 -0.68785E-03 11783 0.983E-02 0.916E-01
RMM: 47 -0.416165581417E+03 -0.64908E-01 -0.41780E-03 11302 0.717E-02 0.720E-01
RMM: 48 -0.416266409759E+03 -0.10083E+00 -0.56107E-03 11879 0.772E-02 0.577E-01
RMM: 49 -0.416319187182E+03 -0.52777E-01 -0.10772E-02 12917 0.105E-01 0.407E-01
RMM: 50 -0.416328132957E+03 -0.89458E-02 -0.51936E-03 11963 0.686E-02 0.393E-01
RMM: 51 -0.416419776520E+03 -0.91644E-01 -0.52547E-03 11132 0.881E-02 0.404E-01
RMM: 52 -0.416467180506E+03 -0.47404E-01 -0.30672E-03 11140 0.506E-02 0.387E-01
RMM: 53 -0.416529063702E+03 -0.61883E-01 -0.34400E-03 11494 0.533E-02 0.264E-01
RMM: 54 -0.416568322038E+03 -0.39258E-01 -0.16699E-03 11141 0.355E-02 0.159E-01
RMM: 55 -0.416613776671E+03 -0.45455E-01 -0.77096E-04 10876 0.263E-02 0.128E-01
RMM: 56 -0.416669950265E+03 -0.56174E-01 -0.73839E-04 11275 0.252E-02 0.137E-01
RMM: 57 -0.416701568250E+03 -0.31618E-01 -0.30090E-04 10782 0.178E-02 0.119E-01
RMM: 58 -0.416727017525E+03 -0.25449E-01 -0.16792E-04 10233 0.122E-02 0.798E-02
RMM: 59 -0.416747034238E+03 -0.20017E-01 -0.19896E-04 10615 0.121E-02 0.429E-02
RMM: 60 -0.416752781711E+03 -0.57475E-02 -0.93449E-05 9325 0.895E-03 0.285E-02
RMM: 61 -0.416755283957E+03 -0.25022E-02 -0.50578E-05 8317 0.657E-03 0.295E-02
RMM: 62 -0.416757562028E+03 -0.22781E-02 -0.55722E-05 8351 0.622E-03 0.262E-02
RMM: 63 -0.416758613089E+03 -0.10511E-02 -0.20463E-05 7245 0.398E-03 0.189E-02
RMM: 64 -0.416759163201E+03 -0.55011E-03 -0.13214E-05 6861 0.317E-03 0.168E-02
RMM: 65 -0.416759577486E+03 -0.41429E-03 -0.74515E-06 6332 0.227E-03 0.901E-03
RMM: 66 -0.416760068059E+03 -0.49057E-03 -0.72986E-06 6660 0.225E-03 0.553E-03
RMM: 67 -0.416760285884E+03 -0.21782E-03 -0.26827E-06 4335 0.133E-03 0.618E-03
RMM: 68 -0.416760465771E+03 -0.17989E-03 -0.21203E-06 4565 0.134E-03 0.313E-03
RMM: 69 -0.416760545605E+03 -0.79834E-04 -0.10152E-06 3581 0.106E-03 0.274E-03
RMM: 70 -0.416760593956E+03 -0.48351E-04 -0.90272E-07 3549 0.102E-03 0.295E-03
RMM: 71 -0.416760606643E+03 -0.12687E-04 -0.10106E-06 4026 0.107E-03 0.169E-03
RMM: 72 -0.416760630697E+03 -0.24054E-04 -0.51509E-07 3127 0.917E-04 0.978E-04
RMM: 73 -0.416760639915E+03 -0.92185E-05 -0.29536E-07 2830 0.867E-04
1 F= -.45446667E+03 E0= -.45446715E+03 d E =0.141748E-02 mag= -0.0010