iterations/neb1_max2_image05_iter33_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422594403235E+04 0.42259E+04 -0.25389E+05 9000 0.103E+03
DAV: 2 -0.104737447787E+03 -0.43307E+04 -0.39285E+04 11024 0.248E+02
DAV: 3 -0.426513562720E+03 -0.32178E+03 -0.30147E+03 10248 0.656E+01
DAV: 4 -0.434996522969E+03 -0.84830E+01 -0.83802E+01 10984 0.107E+01
DAV: 5 -0.435288622566E+03 -0.29210E+00 -0.29118E+00 11208 0.192E+00 0.992E+01
RMM: 6 -0.377901922807E+03 0.57387E+02 -0.11477E+02 9680 0.145E+01 0.680E+01
RMM: 7 -0.524455517019E+03 -0.14655E+03 -0.18225E+02 10078 0.155E+01 0.948E+01
RMM: 8 -0.448586852192E+03 0.75869E+02 -0.81646E+01 10146 0.113E+01 0.665E+01
RMM: 9 -0.449940372359E+03 -0.13535E+01 -0.43773E+01 10176 0.759E+00 0.686E+01
RMM: 10 -0.398912397580E+03 0.51028E+02 -0.45093E+01 10454 0.801E+00 0.450E+01
RMM: 11 -0.378007836197E+03 0.20905E+02 -0.80424E+00 9598 0.409E+00 0.269E+01
RMM: 12 -0.375952746903E+03 0.20551E+01 -0.54920E+00 10172 0.303E+00 0.219E+01
RMM: 13 -0.375649958724E+03 0.30279E+00 -0.22965E+00 10133 0.193E+00 0.136E+01
RMM: 14 -0.378121842392E+03 -0.24719E+01 -0.10781E+00 10219 0.127E+00 0.114E+01
RMM: 15 -0.382828378048E+03 -0.47065E+01 -0.10679E+00 10511 0.129E+00 0.115E+01
RMM: 16 -0.388387025605E+03 -0.55586E+01 -0.23617E+00 11503 0.179E+00 0.974E+00
RMM: 17 -0.394024012570E+03 -0.56370E+01 -0.16439E+00 11318 0.146E+00 0.853E+00
RMM: 18 -0.394962843195E+03 -0.93883E+00 -0.29046E-01 10154 0.703E-01 0.730E+00
RMM: 19 -0.397907277768E+03 -0.29444E+01 -0.76860E-01 11416 0.969E-01 0.673E+00
RMM: 20 -0.400129068286E+03 -0.22218E+01 -0.54389E-01 11391 0.789E-01 0.615E+00
RMM: 21 -0.400649254673E+03 -0.52019E+00 -0.64141E-02 10378 0.287E-01 0.589E+00
RMM: 22 -0.402328698035E+03 -0.16794E+01 -0.30511E-01 11795 0.555E-01 0.559E+00
RMM: 23 -0.406114747429E+03 -0.37860E+01 -0.15103E+00 14164 0.120E+00 0.500E+00
RMM: 24 -0.409704830319E+03 -0.35901E+01 -0.11958E+00 14179 0.104E+00 0.595E+00
RMM: 25 -0.411772012042E+03 -0.20672E+01 -0.66394E-01 13328 0.764E-01 0.599E+00
RMM: 26 -0.412620516486E+03 -0.84850E+00 -0.16824E-01 11485 0.402E-01 0.604E+00
RMM: 27 -0.412753339396E+03 -0.13282E+00 -0.93941E-03 10689 0.104E-01 0.606E+00
RMM: 28 -0.412556782197E+03 0.19656E+00 -0.11601E-02 10397 0.131E-01 0.579E+00
RMM: 29 -0.412376184512E+03 0.18060E+00 -0.36529E-02 11954 0.230E-01 0.537E+00
RMM: 30 -0.411920426844E+03 0.45576E+00 -0.16425E-01 14802 0.498E-01 0.450E+00
RMM: 31 -0.411920814825E+03 -0.38798E-03 -0.13757E-01 14650 0.448E-01 0.596E+00
RMM: 32 -0.411892541452E+03 0.28273E-01 -0.41707E-03 10300 0.869E-02 0.630E+00
RMM: 33 -0.412880970163E+03 -0.98843E+00 -0.83759E-01 17446 0.100E+00 0.500E+00
RMM: 34 -0.413288518924E+03 -0.40755E+00 -0.14251E-01 15854 0.424E-01 0.545E+00
RMM: 35 -0.414389179320E+03 -0.11007E+01 -0.11929E-01 15401 0.390E-01 0.405E+00
RMM: 36 -0.415025691802E+03 -0.63651E+00 -0.56884E-02 14213 0.281E-01 0.237E+00
RMM: 37 -0.415065730387E+03 -0.40039E-01 -0.30367E-03 10437 0.748E-02 0.216E+00
RMM: 38 -0.415385421758E+03 -0.31969E+00 -0.19865E-02 13108 0.201E-01 0.175E+00
RMM: 39 -0.415846312945E+03 -0.46089E+00 -0.32333E-02 14258 0.225E-01 0.105E+00
RMM: 40 -0.416180514702E+03 -0.33420E+00 -0.16626E-02 12941 0.143E-01 0.833E-01
RMM: 41 -0.416414741962E+03 -0.23423E+00 -0.12219E-02 12145 0.117E-01 0.827E-01
RMM: 42 -0.416520640218E+03 -0.10590E+00 -0.15666E-02 12497 0.131E-01 0.792E-01
RMM: 43 -0.416539378102E+03 -0.18738E-01 -0.12898E-02 12158 0.112E-01 0.609E-01
RMM: 44 -0.416630593871E+03 -0.91216E-01 -0.62058E-03 11336 0.766E-02 0.540E-01
RMM: 45 -0.416700492211E+03 -0.69898E-01 -0.46652E-03 11370 0.654E-02 0.526E-01
RMM: 46 -0.416748327373E+03 -0.47835E-01 -0.10624E-02 12445 0.872E-02 0.375E-01
RMM: 47 -0.416874980430E+03 -0.12665E+00 -0.58337E-03 11998 0.720E-02 0.325E-01
RMM: 48 -0.416947199243E+03 -0.72219E-01 -0.31770E-03 11421 0.535E-02 0.338E-01
RMM: 49 -0.417035682647E+03 -0.88483E-01 -0.14476E-03 10977 0.326E-02 0.302E-01
RMM: 50 -0.417105011794E+03 -0.69329E-01 -0.77800E-04 10882 0.256E-02 0.231E-01
RMM: 51 -0.417133170161E+03 -0.28158E-01 -0.42546E-04 10810 0.207E-02 0.176E-01
RMM: 52 -0.417138718271E+03 -0.55481E-02 -0.16543E-04 10419 0.139E-02 0.129E-01
RMM: 53 -0.417140517602E+03 -0.17993E-02 -0.15916E-04 10781 0.132E-02 0.747E-02
RMM: 54 -0.417141946177E+03 -0.14286E-02 -0.60810E-05 8871 0.801E-03 0.559E-02
RMM: 55 -0.417143371023E+03 -0.14248E-02 -0.32176E-05 7683 0.572E-03 0.402E-02
RMM: 56 -0.417143288224E+03 0.82799E-04 -0.27690E-05 7331 0.601E-03 0.228E-02
RMM: 57 -0.417144346225E+03 -0.10580E-02 -0.19581E-05 7154 0.474E-03 0.230E-02
RMM: 58 -0.417144510665E+03 -0.16444E-03 -0.92176E-06 6678 0.313E-03 0.117E-02
RMM: 59 -0.417144764391E+03 -0.25373E-03 -0.46193E-06 6357 0.205E-03 0.769E-03
RMM: 60 -0.417145163297E+03 -0.39891E-03 -0.42872E-06 6425 0.192E-03 0.173E-02
RMM: 61 -0.417145386135E+03 -0.22284E-03 -0.16928E-06 4168 0.117E-03 0.181E-02
RMM: 62 -0.417145541772E+03 -0.15564E-03 -0.11245E-06 4035 0.115E-03 0.841E-03
RMM: 63 -0.417145809848E+03 -0.26808E-03 -0.42932E-06 6434 0.198E-03 0.138E-02
RMM: 64 -0.417145920214E+03 -0.11037E-03 -0.53379E-07 3307 0.900E-04 0.121E-02
RMM: 65 -0.417146089511E+03 -0.16930E-03 -0.39377E-07 3220 0.927E-04 0.910E-03
RMM: 66 -0.417146259199E+03 -0.16969E-03 -0.65737E-07 3666 0.101E-03 0.760E-03
RMM: 67 -0.417146318472E+03 -0.59272E-04 -0.23528E-07 2875 0.864E-04 0.466E-03
RMM: 68 -0.417146385719E+03 -0.67248E-04 -0.38714E-07 3227 0.909E-04 0.298E-03
RMM: 69 -0.417146422657E+03 -0.36938E-04 -0.20018E-07 2704 0.843E-04 0.215E-03
RMM: 70 -0.417146460732E+03 -0.38075E-04 -0.27484E-07 2966 0.869E-04 0.222E-03
RMM: 71 -0.417146479562E+03 -0.18830E-04 -0.18039E-07 2677 0.849E-04 0.108E-03
RMM: 72 -0.417146494712E+03 -0.15151E-04 -0.25269E-07 2848 0.879E-04 0.795E-04
RMM: 73 -0.417146503445E+03 -0.87329E-05 -0.15084E-07 2573 0.846E-04
1 F= -.45486742E+03 E0= -.45486709E+03 d E =-.100483E-02 mag= -0.0011