iterations/neb2_max1_image05_iter5_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421633986457E+04 0.42163E+04 -0.25382E+05 9008 0.103E+03
DAV: 2 -0.105780543812E+03 -0.43221E+04 -0.39240E+04 11000 0.248E+02
DAV: 3 -0.427224592849E+03 -0.32144E+03 -0.30057E+03 10296 0.655E+01
DAV: 4 -0.435679940908E+03 -0.84553E+01 -0.83579E+01 10816 0.106E+01
DAV: 5 -0.435966630657E+03 -0.28669E+00 -0.28600E+00 11208 0.191E+00 0.100E+02
RMM: 6 -0.387268259603E+03 0.48698E+02 -0.10930E+02 9702 0.144E+01 0.716E+01
RMM: 7 -0.740545106109E+03 -0.35328E+03 -0.37904E+02 11126 0.184E+01 0.140E+02
RMM: 8 -0.501928304289E+03 0.23862E+03 -0.11635E+02 10138 0.113E+01 0.912E+01
RMM: 9 -0.397657806644E+03 0.10427E+03 -0.69171E+01 10200 0.107E+01 0.500E+01
RMM: 10 -0.400198418671E+03 -0.25406E+01 -0.44497E+01 10252 0.860E+00 0.497E+01
RMM: 11 -0.389382114765E+03 0.10816E+02 -0.24226E+01 10232 0.609E+00 0.467E+01
RMM: 12 -0.375328630377E+03 0.14053E+02 -0.81532E+00 9959 0.381E+00 0.276E+01
RMM: 13 -0.375198633597E+03 0.13000E+00 -0.27278E+00 10101 0.223E+00 0.232E+01
RMM: 14 -0.374533454281E+03 0.66518E+00 -0.11561E+00 10107 0.145E+00 0.153E+01
RMM: 15 -0.377681835951E+03 -0.31484E+01 -0.11537E+00 10442 0.140E+00 0.119E+01
RMM: 16 -0.383898843404E+03 -0.62170E+01 -0.13757E+00 10812 0.151E+00 0.158E+01
RMM: 17 -0.386735580590E+03 -0.28367E+01 -0.12603E+00 10801 0.138E+00 0.118E+01
RMM: 18 -0.390269623435E+03 -0.35340E+01 -0.95326E-01 10775 0.118E+00 0.875E+00
RMM: 19 -0.394676907444E+03 -0.44073E+01 -0.10449E+00 11119 0.117E+00 0.688E+00
RMM: 20 -0.397563749035E+03 -0.28868E+01 -0.76030E-01 11112 0.101E+00 0.667E+00
RMM: 21 -0.400810078081E+03 -0.32463E+01 -0.12713E+00 11870 0.117E+00 0.658E+00
RMM: 22 -0.403162935399E+03 -0.23529E+01 -0.72126E-01 11461 0.865E-01 0.622E+00
RMM: 23 -0.407291850215E+03 -0.41289E+01 -0.17781E+00 12608 0.118E+00 0.722E+00
RMM: 24 -0.409197414122E+03 -0.19056E+01 -0.75666E-01 11906 0.785E-01 0.764E+00
RMM: 25 -0.409912628431E+03 -0.71521E+00 -0.22730E-01 11101 0.434E-01 0.700E+00
RMM: 26 -0.410246815247E+03 -0.33419E+00 -0.34896E-02 10640 0.176E-01 0.679E+00
RMM: 27 -0.410471427131E+03 -0.22461E+00 -0.12609E-02 10608 0.101E-01 0.677E+00
RMM: 28 -0.410509145019E+03 -0.37718E-01 -0.32272E-03 11036 0.489E-02 0.675E+00
RMM: 29 -0.410060415452E+03 0.44873E+00 -0.51874E-02 14431 0.253E-01 0.534E+00
RMM: 30 -0.410280702059E+03 -0.22029E+00 -0.11154E-01 15536 0.386E-01 0.522E+00
RMM: 31 -0.410298273535E+03 -0.17571E-01 -0.15250E-01 16193 0.449E-01 0.598E+00
RMM: 32 -0.409288417126E+03 0.10099E+01 -0.12814E-01 16031 0.440E-01 0.739E+00
RMM: 33 -0.411359294118E+03 -0.20709E+01 -0.37651E-01 16917 0.696E-01 0.587E+00
RMM: 34 -0.412918655970E+03 -0.15594E+01 -0.50826E-01 17536 0.696E-01 0.607E+00
RMM: 35 -0.415158750082E+03 -0.22401E+01 -0.35878E-01 16917 0.575E-01 0.586E+00
RMM: 36 -0.415617568475E+03 -0.45882E+00 -0.16182E-01 16051 0.448E-01 0.374E+00
RMM: 37 -0.415908551867E+03 -0.29098E+00 -0.18451E-02 12846 0.175E-01 0.315E+00
RMM: 38 -0.416210425302E+03 -0.30187E+00 -0.19606E-02 12837 0.182E-01 0.281E+00
RMM: 39 -0.416516218397E+03 -0.30579E+00 -0.28384E-02 13636 0.211E-01 0.240E+00
RMM: 40 -0.416686095857E+03 -0.16988E+00 -0.19528E-02 12891 0.167E-01 0.189E+00
RMM: 41 -0.416846481141E+03 -0.16039E+00 -0.10745E-02 11972 0.123E-01 0.166E+00
RMM: 42 -0.416955239763E+03 -0.10876E+00 -0.69206E-03 11341 0.957E-02 0.145E+00
RMM: 43 -0.417042675796E+03 -0.87436E-01 -0.59470E-03 11272 0.851E-02 0.127E+00
RMM: 44 -0.417129752739E+03 -0.87077E-01 -0.48398E-03 11212 0.746E-02 0.119E+00
RMM: 45 -0.417230498842E+03 -0.10075E+00 -0.11322E-02 12507 0.104E-01 0.986E-01
RMM: 46 -0.417300104401E+03 -0.69606E-01 -0.78784E-03 12052 0.865E-02 0.775E-01
RMM: 47 -0.417379141736E+03 -0.79037E-01 -0.76660E-03 12026 0.821E-02 0.579E-01
RMM: 48 -0.417474396206E+03 -0.95254E-01 -0.51885E-03 11534 0.715E-02 0.419E-01
RMM: 49 -0.417566271343E+03 -0.91875E-01 -0.77417E-03 12092 0.821E-02 0.413E-01
RMM: 50 -0.417608231941E+03 -0.41961E-01 -0.17165E-03 10850 0.415E-02 0.415E-01
RMM: 51 -0.417611781440E+03 -0.35495E-02 -0.53695E-03 12281 0.749E-02 0.417E-01
RMM: 52 -0.417633757969E+03 -0.21977E-01 -0.20302E-03 11086 0.497E-02 0.227E-01
RMM: 53 -0.417678165031E+03 -0.44407E-01 -0.98713E-04 10830 0.300E-02 0.191E-01
RMM: 54 -0.417710923638E+03 -0.32759E-01 -0.73054E-04 10896 0.276E-02 0.249E-01
RMM: 55 -0.417742988050E+03 -0.32064E-01 -0.71253E-04 11220 0.245E-02 0.198E-01
RMM: 56 -0.417756263245E+03 -0.13275E-01 -0.39046E-04 10874 0.196E-02 0.160E-01
RMM: 57 -0.417786361680E+03 -0.30098E-01 -0.25193E-04 10524 0.145E-02 0.131E-01
RMM: 58 -0.417828470714E+03 -0.42109E-01 -0.44820E-04 11826 0.179E-02 0.823E-02
RMM: 59 -0.417846986649E+03 -0.18516E-01 -0.17454E-04 10663 0.123E-02 0.723E-02
RMM: 60 -0.417853448529E+03 -0.64619E-02 -0.84835E-05 9338 0.889E-03 0.601E-02
RMM: 61 -0.417855461641E+03 -0.20131E-02 -0.76874E-05 9603 0.914E-03 0.412E-02
RMM: 62 -0.417856479942E+03 -0.10183E-02 -0.25849E-05 7499 0.558E-03 0.208E-02
RMM: 63 -0.417856853660E+03 -0.37372E-03 -0.18453E-05 7048 0.414E-03 0.137E-02
RMM: 64 -0.417857069859E+03 -0.21620E-03 -0.95357E-06 6652 0.292E-03 0.178E-02
RMM: 65 -0.417857856345E+03 -0.78649E-03 -0.93970E-06 6751 0.301E-03 0.206E-02
RMM: 66 -0.417858271304E+03 -0.41496E-03 -0.51547E-06 6357 0.198E-03 0.112E-02
RMM: 67 -0.417858531535E+03 -0.26023E-03 -0.24803E-06 4312 0.131E-03 0.962E-03
RMM: 68 -0.417858651000E+03 -0.11946E-03 -0.16921E-06 4215 0.124E-03 0.579E-03
RMM: 69 -0.417858734815E+03 -0.83815E-04 -0.63352E-07 3195 0.101E-03 0.566E-03
RMM: 70 -0.417858777512E+03 -0.42697E-04 -0.85499E-07 3743 0.110E-03 0.347E-03
RMM: 71 -0.417858831233E+03 -0.53721E-04 -0.75633E-07 3791 0.104E-03 0.252E-03
RMM: 72 -0.417858908863E+03 -0.77630E-04 -0.30759E-07 2923 0.857E-04 0.214E-03
RMM: 73 -0.417858974827E+03 -0.65965E-04 -0.78334E-07 3772 0.100E-03 0.520E-03
RMM: 74 -0.417858987379E+03 -0.12552E-04 -0.33598E-08 2299 0.761E-04 0.269E-03
RMM: 75 -0.417859003603E+03 -0.16224E-04 -0.53456E-08 2324 0.760E-04 0.206E-03
RMM: 76 -0.417859012176E+03 -0.85731E-05 -0.65410E-08 2378 0.782E-04
1 F= -.45549004E+03 E0= -.45549048E+03 d E =0.130841E-02 mag= 0.0002