iterations/neb3_max1_image03_iter8_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421898052035E+04 0.42190E+04 -0.25385E+05 9008 0.103E+03
DAV: 2 -0.104449769299E+03 -0.43234E+04 -0.39299E+04 11016 0.248E+02
DAV: 3 -0.425960529987E+03 -0.32151E+03 -0.30094E+03 10296 0.655E+01
DAV: 4 -0.434545559218E+03 -0.85850E+01 -0.84451E+01 10848 0.107E+01
DAV: 5 -0.434839042549E+03 -0.29348E+00 -0.29279E+00 11168 0.193E+00 0.996E+01
RMM: 6 -0.391118158971E+03 0.43721E+02 -0.10610E+02 9680 0.142E+01 0.765E+01
RMM: 7 -0.855570568516E+03 -0.46445E+03 -0.47074E+02 11480 0.194E+01 0.152E+02
RMM: 8 -0.493302349539E+03 0.36227E+03 -0.11613E+02 9954 0.115E+01 0.895E+01
RMM: 9 -0.415012535582E+03 0.78290E+02 -0.72737E+01 10189 0.111E+01 0.586E+01
RMM: 10 -0.383145210971E+03 0.31867E+02 -0.33713E+01 10221 0.764E+00 0.381E+01
RMM: 11 -0.379014247536E+03 0.41310E+01 -0.19320E+01 10309 0.527E+00 0.375E+01
RMM: 12 -0.374809280994E+03 0.42050E+01 -0.63346E+00 10042 0.345E+00 0.273E+01
RMM: 13 -0.372056161215E+03 0.27531E+01 -0.31814E+00 10153 0.237E+00 0.204E+01
RMM: 14 -0.372426735286E+03 -0.37057E+00 -0.15158E+00 10263 0.162E+00 0.131E+01
RMM: 15 -0.379129487343E+03 -0.67028E+01 -0.16717E+00 10490 0.170E+00 0.148E+01
RMM: 16 -0.383132981176E+03 -0.40035E+01 -0.19813E+00 10707 0.182E+00 0.977E+00
RMM: 17 -0.388969334961E+03 -0.58364E+01 -0.19651E+00 11086 0.168E+00 0.909E+00
RMM: 18 -0.391464717109E+03 -0.24954E+01 -0.62117E-01 10296 0.101E+00 0.640E+00
RMM: 19 -0.393783924973E+03 -0.23192E+01 -0.46615E-01 10601 0.833E-01 0.662E+00
RMM: 20 -0.396049033046E+03 -0.22651E+01 -0.43658E-01 10984 0.755E-01 0.645E+00
RMM: 21 -0.396646814403E+03 -0.59778E+00 -0.11420E-01 10428 0.397E-01 0.547E+00
RMM: 22 -0.403019700359E+03 -0.63729E+01 -0.25972E+00 13629 0.150E+00 0.670E+00
RMM: 23 -0.406722695898E+03 -0.37030E+01 -0.15282E+00 13472 0.115E+00 0.720E+00
RMM: 24 -0.409169110714E+03 -0.24464E+01 -0.96228E-01 12769 0.876E-01 0.615E+00
RMM: 25 -0.409798341453E+03 -0.62923E+00 -0.48167E-02 10527 0.233E-01 0.599E+00
RMM: 26 -0.408931782853E+03 0.86656E+00 -0.89214E-02 10844 0.319E-01 0.553E+00
RMM: 27 -0.407996016418E+03 0.93577E+00 -0.19777E-01 12253 0.478E-01 0.612E+00
RMM: 28 -0.407168763467E+03 0.82725E+00 -0.91256E-02 11600 0.358E-01 0.643E+00
RMM: 29 -0.406707549311E+03 0.46121E+00 -0.27498E-02 10452 0.198E-01 0.633E+00
RMM: 30 -0.409823022382E+03 -0.31155E+01 -0.92648E-01 14993 0.998E-01 0.616E+00
RMM: 31 -0.412830277328E+03 -0.30073E+01 -0.17878E+00 16283 0.125E+00 0.472E+00
RMM: 32 -0.414326886249E+03 -0.14966E+01 -0.28722E-01 14137 0.523E-01 0.401E+00
RMM: 33 -0.414507489303E+03 -0.18060E+00 -0.35557E-02 11064 0.238E-01 0.329E+00
RMM: 34 -0.414790166161E+03 -0.28268E+00 -0.72349E-02 11653 0.333E-01 0.291E+00
RMM: 35 -0.415319512927E+03 -0.52935E+00 -0.12142E-01 12484 0.365E-01 0.267E+00
RMM: 36 -0.415404617317E+03 -0.85104E-01 -0.26714E-02 10761 0.205E-01 0.210E+00
RMM: 37 -0.415643231916E+03 -0.23861E+00 -0.16306E-02 10533 0.157E-01 0.165E+00
RMM: 38 -0.415787381582E+03 -0.14415E+00 -0.90794E-03 10470 0.114E-01 0.144E+00
RMM: 39 -0.415887501624E+03 -0.10012E+00 -0.62878E-03 10584 0.909E-02 0.142E+00
RMM: 40 -0.416031614802E+03 -0.14411E+00 -0.10869E-02 11493 0.114E-01 0.103E+00
RMM: 41 -0.416268972172E+03 -0.23736E+00 -0.12554E-02 11858 0.119E-01 0.713E-01
RMM: 42 -0.416430848327E+03 -0.16188E+00 -0.64823E-03 11157 0.845E-02 0.523E-01
RMM: 43 -0.416544253782E+03 -0.11341E+00 -0.38714E-03 10891 0.647E-02 0.438E-01
RMM: 44 -0.416558219675E+03 -0.13966E-01 -0.87981E-03 12063 0.898E-02 0.407E-01
RMM: 45 -0.416612034250E+03 -0.53815E-01 -0.67647E-03 11805 0.767E-02 0.401E-01
RMM: 46 -0.416675265099E+03 -0.63231E-01 -0.27439E-03 10991 0.531E-02 0.304E-01
RMM: 47 -0.416730650827E+03 -0.55386E-01 -0.30829E-03 11310 0.516E-02 0.229E-01
RMM: 48 -0.416801765318E+03 -0.71114E-01 -0.41027E-03 11739 0.525E-02 0.181E-01
RMM: 49 -0.416852032597E+03 -0.50267E-01 -0.17598E-03 11361 0.351E-02 0.142E-01
RMM: 50 -0.416885645102E+03 -0.33613E-01 -0.58243E-04 10851 0.218E-02 0.128E-01
RMM: 51 -0.416899170603E+03 -0.13526E-01 -0.55070E-04 11159 0.238E-02 0.167E-01
RMM: 52 -0.416929154293E+03 -0.29984E-01 -0.30131E-04 10806 0.165E-02 0.142E-01
RMM: 53 -0.416957294690E+03 -0.28140E-01 -0.49267E-04 11621 0.181E-02 0.863E-02
RMM: 54 -0.416961740252E+03 -0.44456E-02 -0.95413E-05 9729 0.103E-02 0.666E-02
RMM: 55 -0.416964514323E+03 -0.27741E-02 -0.86963E-05 9545 0.952E-03 0.691E-02
RMM: 56 -0.416963861538E+03 0.65278E-03 -0.57829E-05 9120 0.843E-03 0.358E-02
RMM: 57 -0.416965989461E+03 -0.21279E-02 -0.46541E-05 8067 0.669E-03 0.322E-02
RMM: 58 -0.416967062194E+03 -0.10727E-02 -0.28208E-05 7522 0.463E-03 0.206E-02
RMM: 59 -0.416967692540E+03 -0.63035E-03 -0.16889E-05 7116 0.347E-03 0.128E-02
RMM: 60 -0.416968191315E+03 -0.49878E-03 -0.10681E-05 6697 0.261E-03 0.856E-03
RMM: 61 -0.416968542149E+03 -0.35083E-03 -0.55761E-06 6034 0.200E-03 0.850E-03
RMM: 62 -0.416968832257E+03 -0.29011E-03 -0.51078E-06 5201 0.172E-03 0.664E-03
RMM: 63 -0.416969051951E+03 -0.21969E-03 -0.32829E-06 4496 0.142E-03 0.340E-03
RMM: 64 -0.416969151325E+03 -0.99374E-04 -0.15563E-06 3893 0.117E-03 0.221E-03
RMM: 65 -0.416969218338E+03 -0.67013E-04 -0.13916E-06 3859 0.111E-03 0.202E-03
RMM: 66 -0.416969252047E+03 -0.33709E-04 -0.78141E-07 3354 0.977E-04 0.141E-03
RMM: 67 -0.416969272937E+03 -0.20890E-04 -0.46680E-07 3109 0.910E-04 0.126E-03
RMM: 68 -0.416969279768E+03 -0.68306E-05 -0.24164E-07 2750 0.869E-04
1 F= -.45465449E+03 E0= -.45465541E+03 d E =0.275584E-02 mag= -0.0010