iterations/neb1_max2_image01_iter5_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422589250340E+04 0.42259E+04 -0.25385E+05 8992 0.103E+03
DAV: 2 -0.102553418849E+03 -0.43284E+04 -0.39281E+04 10976 0.248E+02
DAV: 3 -0.426570738651E+03 -0.32402E+03 -0.30253E+03 10216 0.657E+01
DAV: 4 -0.435144701806E+03 -0.85740E+01 -0.84678E+01 10744 0.107E+01
DAV: 5 -0.435437936083E+03 -0.29323E+00 -0.29248E+00 11072 0.194E+00 0.100E+02
RMM: 6 -0.389868591159E+03 0.45569E+02 -0.11125E+02 9690 0.146E+01 0.739E+01
RMM: 7 -0.839373282766E+03 -0.44950E+03 -0.48191E+02 11464 0.198E+01 0.153E+02
RMM: 8 -0.497496661738E+03 0.34188E+03 -0.11421E+02 9965 0.113E+01 0.920E+01
RMM: 9 -0.429440919854E+03 0.68056E+02 -0.67660E+01 10160 0.107E+01 0.621E+01
RMM: 10 -0.378046196263E+03 0.51395E+02 -0.39827E+01 10336 0.819E+00 0.348E+01
RMM: 11 -0.387605291727E+03 -0.95591E+01 -0.21833E+01 10435 0.528E+00 0.458E+01
RMM: 12 -0.374123315124E+03 0.13482E+02 -0.59839E+00 9979 0.335E+00 0.289E+01
RMM: 13 -0.372285506291E+03 0.18378E+01 -0.31805E+00 10198 0.245E+00 0.206E+01
RMM: 14 -0.373764688039E+03 -0.14792E+01 -0.18489E+00 10243 0.182E+00 0.133E+01
RMM: 15 -0.379063406483E+03 -0.52987E+01 -0.13584E+00 10422 0.152E+00 0.147E+01
RMM: 16 -0.382286693246E+03 -0.32233E+01 -0.15382E+00 10565 0.160E+00 0.124E+01
RMM: 17 -0.386617206779E+03 -0.43305E+01 -0.16930E+00 10950 0.158E+00 0.964E+00
RMM: 18 -0.390795521417E+03 -0.41783E+01 -0.11896E+00 10813 0.129E+00 0.831E+00
RMM: 19 -0.394064817397E+03 -0.32693E+01 -0.88923E-01 10871 0.112E+00 0.826E+00
RMM: 20 -0.397057448354E+03 -0.29926E+01 -0.90739E-01 11307 0.105E+00 0.701E+00
RMM: 21 -0.398859468245E+03 -0.18020E+01 -0.40053E-01 10761 0.715E-01 0.656E+00
RMM: 22 -0.400979118403E+03 -0.21197E+01 -0.55291E-01 11393 0.797E-01 0.686E+00
RMM: 23 -0.404721674571E+03 -0.37426E+01 -0.18433E+00 12833 0.126E+00 0.653E+00
RMM: 24 -0.407166806294E+03 -0.24451E+01 -0.76914E-01 12046 0.809E-01 0.516E+00
RMM: 25 -0.408724806636E+03 -0.15580E+01 -0.18011E-01 11032 0.406E-01 0.486E+00
RMM: 26 -0.409408973869E+03 -0.68417E+00 -0.51034E-02 10573 0.218E-01 0.490E+00
RMM: 27 -0.409207574952E+03 0.20140E+00 -0.93111E-03 10184 0.111E-01 0.485E+00
RMM: 28 -0.408615529144E+03 0.59205E+00 -0.64809E-02 11735 0.280E-01 0.476E+00
RMM: 29 -0.408754019810E+03 -0.13849E+00 -0.10700E-01 13353 0.405E-01 0.459E+00
RMM: 30 -0.408918899936E+03 -0.16488E+00 -0.12635E-01 13732 0.446E-01 0.589E+00
RMM: 31 -0.409502199298E+03 -0.58330E+00 -0.24317E-02 10709 0.213E-01 0.536E+00
RMM: 32 -0.411982851405E+03 -0.24807E+01 -0.12094E+00 16437 0.113E+00 0.585E+00
RMM: 33 -0.412887504380E+03 -0.90465E+00 -0.37072E-01 15280 0.605E-01 0.549E+00
RMM: 34 -0.413706782027E+03 -0.81928E+00 -0.33229E-01 15172 0.577E-01 0.368E+00
RMM: 35 -0.414114309971E+03 -0.40753E+00 -0.23542E-02 11126 0.193E-01 0.357E+00
RMM: 36 -0.414050225994E+03 0.64084E-01 -0.49021E-03 10354 0.892E-02 0.328E+00
RMM: 37 -0.414760184808E+03 -0.70996E+00 -0.40611E-02 13530 0.272E-01 0.289E+00
RMM: 38 -0.415188830853E+03 -0.42865E+00 -0.50812E-02 13890 0.265E-01 0.201E+00
RMM: 39 -0.415271908660E+03 -0.83078E-01 -0.17010E-02 12038 0.158E-01 0.183E+00
RMM: 40 -0.415439357250E+03 -0.16745E+00 -0.61800E-03 10720 0.978E-02 0.162E+00
RMM: 41 -0.415583558615E+03 -0.14420E+00 -0.36408E-03 10526 0.742E-02 0.138E+00
RMM: 42 -0.415757166163E+03 -0.17361E+00 -0.63484E-03 11399 0.926E-02 0.117E+00
RMM: 43 -0.415831468377E+03 -0.74302E-01 -0.15714E-02 12816 0.132E-01 0.851E-01
RMM: 44 -0.415915137611E+03 -0.83669E-01 -0.70920E-03 11882 0.857E-02 0.645E-01
RMM: 45 -0.416031737316E+03 -0.11660E+00 -0.92376E-03 12256 0.921E-02 0.446E-01
RMM: 46 -0.416149247425E+03 -0.11751E+00 -0.72340E-03 11942 0.820E-02 0.437E-01
RMM: 47 -0.416222892126E+03 -0.73645E-01 -0.63362E-03 11713 0.758E-02 0.391E-01
RMM: 48 -0.416296649845E+03 -0.73758E-01 -0.48714E-03 11516 0.629E-02 0.363E-01
RMM: 49 -0.416351149939E+03 -0.54500E-01 -0.28258E-03 11155 0.469E-02 0.319E-01
RMM: 50 -0.416409675280E+03 -0.58525E-01 -0.36751E-03 11738 0.498E-02 0.249E-01
RMM: 51 -0.416404498662E+03 0.51766E-02 -0.26471E-03 11841 0.505E-02 0.173E-01
RMM: 52 -0.416440813818E+03 -0.36315E-01 -0.10851E-03 11024 0.327E-02 0.110E-01
RMM: 53 -0.416472508461E+03 -0.31695E-01 -0.68136E-04 10914 0.246E-02 0.109E-01
RMM: 54 -0.416511245446E+03 -0.38737E-01 -0.39626E-04 10620 0.180E-02 0.102E-01
RMM: 55 -0.416532157679E+03 -0.20912E-01 -0.17627E-04 9802 0.123E-02 0.879E-02
RMM: 56 -0.416527070879E+03 0.50868E-02 -0.75857E-05 9927 0.102E-02 0.631E-02
RMM: 57 -0.416538175425E+03 -0.11105E-01 -0.88173E-05 9374 0.100E-02 0.437E-02
RMM: 58 -0.416540914315E+03 -0.27389E-02 -0.51342E-05 8577 0.700E-03 0.306E-02
RMM: 59 -0.416542763920E+03 -0.18496E-02 -0.50812E-05 8378 0.654E-03 0.311E-02
RMM: 60 -0.416544310689E+03 -0.15468E-02 -0.37611E-05 7933 0.505E-03 0.244E-02
RMM: 61 -0.416544977488E+03 -0.66680E-03 -0.15584E-05 6987 0.324E-03 0.181E-02
RMM: 62 -0.416545214919E+03 -0.23743E-03 -0.75679E-06 6264 0.238E-03 0.154E-02
RMM: 63 -0.416545379997E+03 -0.16508E-03 -0.36781E-06 5445 0.169E-03 0.135E-02
RMM: 64 -0.416545526995E+03 -0.14700E-03 -0.30508E-06 5090 0.151E-03 0.116E-02
RMM: 65 -0.416545556699E+03 -0.29704E-04 -0.36608E-06 5694 0.169E-03 0.100E-02
RMM: 66 -0.416545561307E+03 -0.46074E-05 -0.23423E-06 4801 0.142E-03
1 F= -.45425039E+03 E0= -.45425015E+03 d E =-.713524E-03 mag= -0.0034