iterations/neb1_max2_image02_iter32_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422403677275E+04 0.42240E+04 -0.25383E+05 8992 0.103E+03
DAV: 2 -0.103608295017E+03 -0.43276E+04 -0.39225E+04 10968 0.248E+02
DAV: 3 -0.427269522340E+03 -0.32366E+03 -0.30227E+03 10232 0.658E+01
DAV: 4 -0.435786770636E+03 -0.85172E+01 -0.84169E+01 10760 0.107E+01
DAV: 5 -0.436080452365E+03 -0.29368E+00 -0.29289E+00 11104 0.195E+00 0.994E+01
RMM: 6 -0.389321165136E+03 0.46759E+02 -0.11204E+02 9714 0.146E+01 0.736E+01
RMM: 7 -0.814757264914E+03 -0.42544E+03 -0.45072E+02 11353 0.195E+01 0.151E+02
RMM: 8 -0.496696337349E+03 0.31806E+03 -0.11531E+02 10016 0.113E+01 0.914E+01
RMM: 9 -0.422924408264E+03 0.73772E+02 -0.65827E+01 10165 0.105E+01 0.596E+01
RMM: 10 -0.386259692092E+03 0.36665E+02 -0.39632E+01 10293 0.832E+00 0.400E+01
RMM: 11 -0.387398506270E+03 -0.11388E+01 -0.24635E+01 10405 0.570E+00 0.463E+01
RMM: 12 -0.374281571839E+03 0.13117E+02 -0.74599E+00 9994 0.366E+00 0.308E+01
RMM: 13 -0.373545322648E+03 0.73625E+00 -0.33564E+00 10160 0.249E+00 0.230E+01
RMM: 14 -0.372930685741E+03 0.61464E+00 -0.16220E+00 10157 0.169E+00 0.155E+01
RMM: 15 -0.377293763537E+03 -0.43631E+01 -0.14846E+00 10443 0.156E+00 0.128E+01
RMM: 16 -0.382536869136E+03 -0.52431E+01 -0.13156E+00 10475 0.147E+00 0.132E+01
RMM: 17 -0.388241681184E+03 -0.57048E+01 -0.23461E+00 11318 0.182E+00 0.103E+01
RMM: 18 -0.391733682699E+03 -0.34920E+01 -0.11084E+00 10688 0.124E+00 0.710E+00
RMM: 19 -0.394302250427E+03 -0.25686E+01 -0.38440E-01 10279 0.756E-01 0.665E+00
RMM: 20 -0.397750122245E+03 -0.34479E+01 -0.81469E-01 11413 0.984E-01 0.665E+00
RMM: 21 -0.400244688203E+03 -0.24946E+01 -0.83219E-01 11706 0.970E-01 0.582E+00
RMM: 22 -0.403530246334E+03 -0.32856E+01 -0.13614E+00 12354 0.114E+00 0.496E+00
RMM: 23 -0.407531021194E+03 -0.40008E+01 -0.18796E+00 12880 0.127E+00 0.697E+00
RMM: 24 -0.408706328587E+03 -0.11753E+01 -0.57470E-01 11766 0.697E-01 0.690E+00
RMM: 25 -0.408993684715E+03 -0.28736E+00 -0.76554E-02 10583 0.272E-01 0.859E+00
RMM: 26 -0.408713994692E+03 0.27969E+00 -0.37874E-02 10456 0.196E-01 0.643E+00
RMM: 27 -0.411051919607E+03 -0.23379E+01 -0.64660E-01 14242 0.724E-01 0.876E+00
RMM: 28 -0.410951656657E+03 0.10026E+00 -0.68919E-02 11463 0.274E-01 0.717E+00
RMM: 29 -0.411293222165E+03 -0.34157E+00 -0.18611E-02 10588 0.151E-01 0.665E+00
RMM: 30 -0.411613098305E+03 -0.31988E+00 -0.71229E-03 10439 0.106E-01 0.652E+00
RMM: 31 -0.411999574182E+03 -0.38648E+00 -0.39355E-02 12788 0.222E-01 0.576E+00
RMM: 32 -0.413314914330E+03 -0.13153E+01 -0.27614E-01 15792 0.530E-01 0.631E+00
RMM: 33 -0.413712807780E+03 -0.39789E+00 -0.16634E-01 15267 0.415E-01 0.590E+00
RMM: 34 -0.414268927278E+03 -0.55612E+00 -0.88565E-02 14443 0.359E-01 0.411E+00
RMM: 35 -0.415301734817E+03 -0.10328E+01 -0.68290E-02 14246 0.308E-01 0.307E+00
RMM: 36 -0.415678791572E+03 -0.37706E+00 -0.59651E-02 13948 0.294E-01 0.251E+00
RMM: 37 -0.415693955916E+03 -0.15164E-01 -0.27918E-02 12354 0.191E-01 0.216E+00
RMM: 38 -0.415932342249E+03 -0.23839E+00 -0.16339E-02 11588 0.146E-01 0.186E+00
RMM: 39 -0.416076828385E+03 -0.14449E+00 -0.11619E-02 11184 0.116E-01 0.163E+00
RMM: 40 -0.416136797040E+03 -0.59969E-01 -0.77691E-03 10855 0.999E-02 0.148E+00
RMM: 41 -0.416207273610E+03 -0.70477E-01 -0.61464E-03 11061 0.852E-02 0.134E+00
RMM: 42 -0.416326741697E+03 -0.11947E+00 -0.11663E-02 12080 0.110E-01 0.971E-01
RMM: 43 -0.416458281375E+03 -0.13154E+00 -0.70228E-03 11551 0.883E-02 0.699E-01
RMM: 44 -0.416555000341E+03 -0.96719E-01 -0.59561E-03 11463 0.814E-02 0.447E-01
RMM: 45 -0.416619333152E+03 -0.64333E-01 -0.50242E-03 11319 0.726E-02 0.370E-01
RMM: 46 -0.416661647387E+03 -0.42314E-01 -0.81739E-03 12108 0.818E-02 0.414E-01
RMM: 47 -0.416753459259E+03 -0.91812E-01 -0.34369E-03 11245 0.540E-02 0.420E-01
RMM: 48 -0.416859066982E+03 -0.10561E+00 -0.31241E-03 11399 0.483E-02 0.421E-01
RMM: 49 -0.416925302727E+03 -0.66236E-01 -0.21450E-03 11276 0.390E-02 0.287E-01
RMM: 50 -0.416959002360E+03 -0.33700E-01 -0.11522E-03 11059 0.304E-02 0.348E-01
RMM: 51 -0.416881133765E+03 0.77869E-01 -0.33434E-03 12678 0.560E-02 0.521E-01
RMM: 52 -0.416900517075E+03 -0.19383E-01 -0.32037E-04 10465 0.241E-02 0.549E-01
RMM: 53 -0.416900057655E+03 0.45942E-03 -0.72377E-05 8608 0.106E-02 0.368E-01
RMM: 54 -0.416905768682E+03 -0.57110E-02 -0.90768E-05 8102 0.965E-03 0.452E-01
RMM: 55 -0.416955502906E+03 -0.49734E-01 -0.72112E-04 12507 0.273E-02 0.385E-01
RMM: 56 -0.416973715806E+03 -0.18213E-01 -0.20270E-04 10993 0.196E-02 0.431E-01
RMM: 57 -0.417001593386E+03 -0.27878E-01 -0.23071E-04 10686 0.144E-02 0.272E-01
RMM: 58 -0.417009085480E+03 -0.74921E-02 -0.80000E-05 9010 0.101E-02 0.152E-01
RMM: 59 -0.417012997232E+03 -0.39118E-02 -0.73932E-05 8026 0.904E-03 0.137E-01
RMM: 60 -0.417014215072E+03 -0.12178E-02 -0.63670E-05 7614 0.742E-03 0.143E-01
RMM: 61 -0.417014494842E+03 -0.27977E-03 -0.15408E-04 8215 0.964E-03 0.170E-01
RMM: 62 -0.417014004203E+03 0.49064E-03 -0.91590E-05 7456 0.740E-03 0.225E-01
RMM: 63 -0.417013378225E+03 0.62598E-03 -0.42008E-05 6903 0.551E-03 0.248E-01
RMM: 64 -0.417014190498E+03 -0.81227E-03 -0.29644E-05 6517 0.472E-03 0.241E-01
RMM: 65 -0.417016648228E+03 -0.24577E-02 -0.27426E-04 8679 0.110E-02 0.241E-01
RMM: 66 -0.417019027738E+03 -0.23795E-02 -0.59533E-04 10156 0.166E-02 0.110E-01
RMM: 67 -0.417020219254E+03 -0.11915E-02 -0.32107E-05 7280 0.780E-03 0.868E-02
RMM: 68 -0.417021086087E+03 -0.86683E-03 -0.16474E-05 6939 0.471E-03 0.701E-02
RMM: 69 -0.417021942920E+03 -0.85683E-03 -0.15131E-05 6972 0.379E-03 0.583E-02
RMM: 70 -0.417022316797E+03 -0.37388E-03 -0.11695E-05 6645 0.315E-03 0.488E-02
RMM: 71 -0.417022252651E+03 0.64146E-04 -0.45037E-05 6955 0.537E-03 0.224E-02
RMM: 72 -0.417022373250E+03 -0.12060E-03 -0.16708E-06 4943 0.167E-03 0.198E-02
RMM: 73 -0.417022507974E+03 -0.13472E-03 -0.53694E-06 6336 0.228E-03 0.197E-02
RMM: 74 -0.417022582934E+03 -0.74960E-04 -0.90501E-07 4098 0.130E-03 0.138E-02
RMM: 75 -0.417022760257E+03 -0.17732E-03 -0.32482E-06 5986 0.172E-03 0.252E-02
RMM: 76 -0.417022768883E+03 -0.86255E-05 -0.98428E-07 4370 0.138E-03
1 F= -.45472540E+03 E0= -.45472652E+03 d E =0.335762E-02 mag= -0.0039