iterations/neb0_image03_iter49_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422888972143E+04 0.42289E+04 -0.25389E+05 9000 0.103E+03
DAV: 2 -0.103267217045E+03 -0.43322E+04 -0.39317E+04 11000 0.248E+02
DAV: 3 -0.426420676277E+03 -0.32315E+03 -0.30215E+03 10240 0.657E+01
DAV: 4 -0.434955664383E+03 -0.85350E+01 -0.84342E+01 10776 0.107E+01
DAV: 5 -0.435253018523E+03 -0.29735E+00 -0.29650E+00 11192 0.195E+00 0.993E+01
RMM: 6 -0.387775300523E+03 0.47478E+02 -0.11116E+02 9704 0.146E+01 0.738E+01
RMM: 7 -0.811385346833E+03 -0.42361E+03 -0.45282E+02 11343 0.196E+01 0.153E+02
RMM: 8 -0.494403212032E+03 0.31698E+03 -0.10438E+02 9948 0.109E+01 0.905E+01
RMM: 9 -0.435690425943E+03 0.58713E+02 -0.67309E+01 10189 0.106E+01 0.640E+01
RMM: 10 -0.369615822568E+03 0.66075E+02 -0.35393E+01 10278 0.767E+00 0.226E+01
RMM: 11 -0.374064453198E+03 -0.44486E+01 -0.13431E+01 10344 0.412E+00 0.315E+01
RMM: 12 -0.371154460956E+03 0.29100E+01 -0.36074E+00 10009 0.267E+00 0.182E+01
RMM: 13 -0.373981490780E+03 -0.28270E+01 -0.21942E+00 10117 0.210E+00 0.148E+01
RMM: 14 -0.377608877035E+03 -0.36274E+01 -0.10973E+00 10165 0.140E+00 0.112E+01
RMM: 15 -0.380499724268E+03 -0.28908E+01 -0.75740E-01 10232 0.114E+00 0.939E+00
RMM: 16 -0.388754912784E+03 -0.82552E+01 -0.22865E+00 11759 0.178E+00 0.102E+01
RMM: 17 -0.390728822656E+03 -0.19739E+01 -0.85784E-01 10827 0.115E+00 0.830E+00
RMM: 18 -0.393149813824E+03 -0.24210E+01 -0.44771E-01 10494 0.763E-01 0.709E+00
RMM: 19 -0.395726007687E+03 -0.25762E+01 -0.48493E-01 11129 0.745E-01 0.685E+00
RMM: 20 -0.400388059261E+03 -0.46621E+01 -0.18008E+00 12650 0.131E+00 0.602E+00
RMM: 21 -0.404677176596E+03 -0.42891E+01 -0.13841E+00 12489 0.113E+00 0.496E+00
RMM: 22 -0.409875797931E+03 -0.51986E+01 -0.24878E+00 13241 0.135E+00 0.493E+00
RMM: 23 -0.411378267157E+03 -0.15025E+01 -0.32464E-01 11310 0.544E-01 0.494E+00
RMM: 24 -0.411738485371E+03 -0.36022E+00 -0.52453E-02 10552 0.223E-01 0.492E+00
RMM: 25 -0.411454290570E+03 0.28419E+00 -0.21931E-02 10206 0.171E-01 0.482E+00
RMM: 26 -0.410943692239E+03 0.51060E+00 -0.97787E-02 11720 0.382E-01 0.450E+00
RMM: 27 -0.411132868699E+03 -0.18918E+00 -0.13146E-01 12837 0.443E-01 0.506E+00
RMM: 28 -0.410674801190E+03 0.45807E+00 -0.16032E-01 13111 0.512E-01 0.681E+00
RMM: 29 -0.411455073516E+03 -0.78027E+00 -0.84501E-02 11523 0.385E-01 0.594E+00
RMM: 30 -0.412287624245E+03 -0.83255E+00 -0.86483E-01 15357 0.972E-01 0.576E+00
RMM: 31 -0.413451786558E+03 -0.11642E+01 -0.36704E-01 14246 0.584E-01 0.563E+00
RMM: 32 -0.414174106638E+03 -0.72232E+00 -0.12596E-01 12234 0.393E-01 0.365E+00
RMM: 33 -0.414440933985E+03 -0.26683E+00 -0.12820E-02 10368 0.144E-01 0.311E+00
RMM: 34 -0.414584277650E+03 -0.14334E+00 -0.10194E-02 10487 0.129E-01 0.305E+00
RMM: 35 -0.415006874065E+03 -0.42260E+00 -0.36570E-02 12205 0.235E-01 0.279E+00
RMM: 36 -0.415135259038E+03 -0.12838E+00 -0.21796E-02 11374 0.186E-01 0.187E+00
RMM: 37 -0.415397084195E+03 -0.26183E+00 -0.13703E-02 10874 0.143E-01 0.136E+00
RMM: 38 -0.415551576304E+03 -0.15449E+00 -0.76916E-03 10634 0.104E-01 0.140E+00
RMM: 39 -0.415642463502E+03 -0.90887E-01 -0.11284E-02 11362 0.118E-01 0.122E+00
RMM: 40 -0.415691466193E+03 -0.49003E-01 -0.84219E-03 11152 0.101E-01 0.890E-01
RMM: 41 -0.415808867187E+03 -0.11740E+00 -0.13709E-02 12060 0.119E-01 0.597E-01
RMM: 42 -0.415933031100E+03 -0.12416E+00 -0.10266E-02 11619 0.991E-02 0.514E-01
RMM: 43 -0.416041027005E+03 -0.10800E+00 -0.82178E-03 11487 0.845E-02 0.452E-01
RMM: 44 -0.416108770051E+03 -0.67743E-01 -0.60432E-03 11358 0.765E-02 0.482E-01
RMM: 45 -0.416181621463E+03 -0.72851E-01 -0.83767E-03 11792 0.806E-02 0.485E-01
RMM: 46 -0.416217910738E+03 -0.36289E-01 -0.21620E-03 10860 0.437E-02 0.330E-01
RMM: 47 -0.416253385175E+03 -0.35474E-01 -0.18096E-03 11037 0.376E-02 0.235E-01
RMM: 48 -0.416290350868E+03 -0.36966E-01 -0.13757E-03 11226 0.323E-02 0.200E-01
RMM: 49 -0.416329671403E+03 -0.39321E-01 -0.99864E-04 11246 0.269E-02 0.163E-01
RMM: 50 -0.416376191074E+03 -0.46520E-01 -0.83558E-04 11470 0.239E-02 0.120E-01
RMM: 51 -0.416396005489E+03 -0.19814E-01 -0.39150E-04 11039 0.183E-02 0.732E-02
RMM: 52 -0.416408092775E+03 -0.12087E-01 -0.14138E-04 10000 0.120E-02 0.630E-02
RMM: 53 -0.416411885522E+03 -0.37927E-02 -0.75596E-05 9058 0.837E-03 0.475E-02
RMM: 54 -0.416414007436E+03 -0.21219E-02 -0.52509E-05 8434 0.660E-03 0.322E-02
RMM: 55 -0.416414807771E+03 -0.80033E-03 -0.20256E-05 7298 0.431E-03 0.274E-02
RMM: 56 -0.416414233200E+03 0.57457E-03 -0.17757E-05 6670 0.483E-03 0.176E-02
RMM: 57 -0.416414961870E+03 -0.72867E-03 -0.10078E-05 6632 0.368E-03 0.106E-02
RMM: 58 -0.416415434486E+03 -0.47262E-03 -0.73198E-06 6633 0.221E-03 0.107E-02
RMM: 59 -0.416415695603E+03 -0.26112E-03 -0.51046E-06 5615 0.180E-03 0.771E-03
RMM: 60 -0.416415929382E+03 -0.23378E-03 -0.35317E-06 5054 0.150E-03 0.364E-03
RMM: 61 -0.416416098202E+03 -0.16882E-03 -0.18760E-06 4296 0.121E-03 0.381E-03
RMM: 62 -0.416416190939E+03 -0.92737E-04 -0.18922E-06 5115 0.133E-03 0.183E-02
RMM: 63 -0.416416194104E+03 -0.31654E-05 -0.39243E-07 3201 0.926E-04
1 F= -.45417413E+03 E0= -.45417364E+03 d E =-.147156E-02 mag= -0.0025