iterations/neb3_max1_image04_iter7_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422289563553E+04 0.42229E+04 -0.25387E+05 9008 0.103E+03
DAV: 2 -0.104409677008E+03 -0.43273E+04 -0.39302E+04 11008 0.248E+02
DAV: 3 -0.426090852503E+03 -0.32168E+03 -0.30119E+03 10312 0.655E+01
DAV: 4 -0.434562200826E+03 -0.84713E+01 -0.83428E+01 10928 0.107E+01
DAV: 5 -0.434846730459E+03 -0.28453E+00 -0.28380E+00 11208 0.190E+00 0.101E+02
RMM: 6 -0.384941485496E+03 0.49905E+02 -0.10789E+02 9692 0.142E+01 0.715E+01
RMM: 7 -0.804079156196E+03 -0.41914E+03 -0.45261E+02 11370 0.195E+01 0.148E+02
RMM: 8 -0.499618431558E+03 0.30446E+03 -0.11990E+02 10057 0.115E+01 0.919E+01
RMM: 9 -0.406177767648E+03 0.93441E+02 -0.67127E+01 10174 0.106E+01 0.537E+01
RMM: 10 -0.398795355181E+03 0.73824E+01 -0.43989E+01 10308 0.861E+00 0.479E+01
RMM: 11 -0.383841799671E+03 0.14954E+02 -0.23439E+01 10239 0.592E+00 0.432E+01
RMM: 12 -0.373559091058E+03 0.10283E+02 -0.69468E+00 9944 0.357E+00 0.258E+01
RMM: 13 -0.374144948515E+03 -0.58586E+00 -0.32715E+00 10151 0.243E+00 0.212E+01
RMM: 14 -0.373963161630E+03 0.18179E+00 -0.12164E+00 10115 0.148E+00 0.135E+01
RMM: 15 -0.378619402896E+03 -0.46562E+01 -0.13451E+00 10466 0.150E+00 0.132E+01
RMM: 16 -0.384299910980E+03 -0.56805E+01 -0.14286E+00 10704 0.156E+00 0.155E+01
RMM: 17 -0.387297129690E+03 -0.29972E+01 -0.14232E+00 10855 0.145E+00 0.998E+00
RMM: 18 -0.389916947802E+03 -0.26198E+01 -0.60087E-01 10360 0.962E-01 0.695E+00
RMM: 19 -0.392937699088E+03 -0.30208E+01 -0.50187E-01 10655 0.858E-01 0.672E+00
RMM: 20 -0.396267318141E+03 -0.33296E+01 -0.85336E-01 11490 0.105E+00 0.690E+00
RMM: 21 -0.400351727811E+03 -0.40844E+01 -0.14923E+00 12329 0.123E+00 0.651E+00
RMM: 22 -0.403395860412E+03 -0.30441E+01 -0.10221E+00 11994 0.994E-01 0.581E+00
RMM: 23 -0.407465741325E+03 -0.40699E+01 -0.16666E+00 12695 0.114E+00 0.720E+00
RMM: 24 -0.409228663089E+03 -0.17629E+01 -0.73869E-01 11928 0.770E-01 0.752E+00
RMM: 25 -0.409562064294E+03 -0.33340E+00 -0.97014E-02 10705 0.299E-01 0.718E+00
RMM: 26 -0.409586358324E+03 -0.24294E-01 -0.13106E-02 11210 0.104E-01 0.717E+00
RMM: 27 -0.409594083433E+03 -0.77251E-02 -0.26710E-03 11414 0.471E-02 0.717E+00
RMM: 28 -0.409312530804E+03 0.28155E+00 -0.54297E-02 14361 0.258E-01 0.743E+00
RMM: 29 -0.407750323197E+03 0.15622E+01 -0.45051E-01 16973 0.670E-01 0.726E+00
RMM: 30 -0.406336059182E+03 0.14143E+01 -0.45949E-01 17190 0.699E-01 0.729E+00
RMM: 31 -0.406101722113E+03 0.23434E+00 -0.25074E-02 12662 0.166E-01 0.744E+00
RMM: 32 -0.408927116046E+03 -0.28254E+01 -0.10976E+00 17322 0.985E-01 0.704E+00
RMM: 33 -0.411620330261E+03 -0.26932E+01 -0.13057E+00 17770 0.105E+00 0.616E+00
RMM: 34 -0.413810524945E+03 -0.21902E+01 -0.78533E-01 17771 0.881E-01 0.480E+00
RMM: 35 -0.414507059430E+03 -0.69653E+00 -0.96059E-02 15715 0.346E-01 0.449E+00
RMM: 36 -0.414922283607E+03 -0.41522E+00 -0.99712E-02 15592 0.385E-01 0.431E+00
RMM: 37 -0.415243675481E+03 -0.32139E+00 -0.84825E-02 15488 0.337E-01 0.312E+00
RMM: 38 -0.415670191542E+03 -0.42652E+00 -0.90648E-02 15635 0.339E-01 0.254E+00
RMM: 39 -0.415798535241E+03 -0.12834E+00 -0.30182E-02 13622 0.198E-01 0.230E+00
RMM: 40 -0.416083933420E+03 -0.28540E+00 -0.28839E-02 13349 0.192E-01 0.182E+00
RMM: 41 -0.416316179418E+03 -0.23225E+00 -0.17891E-02 12504 0.149E-01 0.154E+00
RMM: 42 -0.416417448498E+03 -0.10127E+00 -0.65080E-03 11313 0.930E-02 0.133E+00
RMM: 43 -0.416487836711E+03 -0.70388E-01 -0.52468E-03 11147 0.829E-02 0.111E+00
RMM: 44 -0.416605807193E+03 -0.11797E+00 -0.89037E-03 11969 0.987E-02 0.773E-01
RMM: 45 -0.416722808956E+03 -0.11700E+00 -0.50388E-03 11369 0.753E-02 0.595E-01
RMM: 46 -0.416798334371E+03 -0.75525E-01 -0.63531E-03 11796 0.807E-02 0.512E-01
RMM: 47 -0.416814662831E+03 -0.16328E-01 -0.67066E-03 11953 0.795E-02 0.473E-01
RMM: 48 -0.416874425484E+03 -0.59763E-01 -0.67577E-03 11974 0.774E-02 0.444E-01
RMM: 49 -0.416936134810E+03 -0.61709E-01 -0.33396E-03 11221 0.563E-02 0.427E-01
RMM: 50 -0.416989798119E+03 -0.53663E-01 -0.19953E-03 10948 0.423E-02 0.351E-01
RMM: 51 -0.417000333167E+03 -0.10535E-01 -0.39223E-03 12030 0.621E-02 0.309E-01
RMM: 52 -0.417046582781E+03 -0.46250E-01 -0.15285E-03 11070 0.374E-02 0.224E-01
RMM: 53 -0.417080705324E+03 -0.34123E-01 -0.14966E-03 11370 0.360E-02 0.179E-01
RMM: 54 -0.417124186382E+03 -0.43481E-01 -0.80319E-04 11045 0.240E-02 0.165E-01
RMM: 55 -0.417171007765E+03 -0.46821E-01 -0.42902E-04 10912 0.189E-02 0.144E-01
RMM: 56 -0.417196610531E+03 -0.25603E-01 -0.26495E-04 10751 0.174E-02 0.125E-01
RMM: 57 -0.417213825575E+03 -0.17215E-01 -0.23187E-04 10801 0.145E-02 0.884E-02
RMM: 58 -0.417216611164E+03 -0.27856E-02 -0.85589E-05 9211 0.891E-03 0.599E-02
RMM: 59 -0.417218332493E+03 -0.17213E-02 -0.73437E-05 8887 0.794E-03 0.450E-02
RMM: 60 -0.417219542345E+03 -0.12099E-02 -0.36354E-05 7969 0.558E-03 0.427E-02
RMM: 61 -0.417220382995E+03 -0.84065E-03 -0.13291E-05 6878 0.344E-03 0.334E-02
RMM: 62 -0.417220736437E+03 -0.35344E-03 -0.10283E-05 6515 0.353E-03 0.193E-02
RMM: 63 -0.417220863389E+03 -0.12695E-03 -0.51859E-06 6389 0.225E-03 0.122E-02
RMM: 64 -0.417220947680E+03 -0.84291E-04 -0.23220E-06 4590 0.139E-03 0.903E-03
RMM: 65 -0.417220994873E+03 -0.47193E-04 -0.12175E-06 3939 0.117E-03 0.786E-03
RMM: 66 -0.417221041950E+03 -0.47077E-04 -0.18620E-06 5325 0.137E-03 0.570E-03
RMM: 67 -0.417221063165E+03 -0.21214E-04 -0.81587E-07 3867 0.108E-03 0.525E-03
RMM: 68 -0.417221076420E+03 -0.13256E-04 -0.28362E-07 2820 0.868E-04 0.277E-03
RMM: 69 -0.417221084313E+03 -0.78931E-05 -0.51986E-07 3255 0.922E-04
1 F= -.45489704E+03 E0= -.45489789E+03 d E =0.254505E-02 mag= -0.0002