iterations/neb3_max1_image02_iter1_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422613078267E+04 0.42261E+04 -0.25389E+05 9008 0.103E+03
DAV: 2 -0.104039336222E+03 -0.43302E+04 -0.39315E+04 11008 0.248E+02
DAV: 3 -0.425912963624E+03 -0.32187E+03 -0.30137E+03 10328 0.656E+01
DAV: 4 -0.434373442715E+03 -0.84605E+01 -0.83577E+01 10888 0.107E+01
DAV: 5 -0.434656845429E+03 -0.28340E+00 -0.28266E+00 11200 0.190E+00 0.103E+02
RMM: 6 -0.378836909997E+03 0.55820E+02 -0.10956E+02 9703 0.143E+01 0.695E+01
RMM: 7 -0.604481749749E+03 -0.22564E+03 -0.24876E+02 10427 0.169E+01 0.113E+02
RMM: 8 -0.524726187015E+03 0.79756E+02 -0.11632E+02 10301 0.116E+01 0.919E+01
RMM: 9 -0.390044379224E+03 0.13468E+03 -0.49631E+01 10150 0.878E+00 0.395E+01
RMM: 10 -0.400655598525E+03 -0.10611E+02 -0.31758E+01 10223 0.717E+00 0.469E+01
RMM: 11 -0.375904322005E+03 0.24751E+02 -0.95584E+00 9826 0.416E+00 0.152E+01
RMM: 12 -0.377621842725E+03 -0.17175E+01 -0.28464E+00 10430 0.199E+00 0.152E+01
RMM: 13 -0.379304469795E+03 -0.16826E+01 -0.14790E+00 10192 0.157E+00 0.130E+01
RMM: 14 -0.381750598735E+03 -0.24461E+01 -0.84769E-01 10215 0.121E+00 0.978E+00
RMM: 15 -0.385906899534E+03 -0.41563E+01 -0.62527E-01 10389 0.103E+00 0.983E+00
RMM: 16 -0.388506986068E+03 -0.26001E+01 -0.82920E-01 10919 0.113E+00 0.900E+00
RMM: 17 -0.392660564672E+03 -0.41536E+01 -0.13813E+00 11606 0.133E+00 0.681E+00
RMM: 18 -0.395622209514E+03 -0.29616E+01 -0.62487E-01 11031 0.897E-01 0.627E+00
RMM: 19 -0.398884882449E+03 -0.32627E+01 -0.92901E-01 11654 0.101E+00 0.669E+00
RMM: 20 -0.401735333814E+03 -0.28505E+01 -0.10358E+00 11914 0.103E+00 0.582E+00
RMM: 21 -0.405821713714E+03 -0.40864E+01 -0.16068E+00 12542 0.118E+00 0.536E+00
RMM: 22 -0.409466352306E+03 -0.36446E+01 -0.18476E+00 12968 0.118E+00 0.588E+00
RMM: 23 -0.410787566483E+03 -0.13212E+01 -0.30706E-01 11151 0.520E-01 0.567E+00
RMM: 24 -0.411073341849E+03 -0.28578E+00 -0.25485E-02 10444 0.186E-01 0.572E+00
RMM: 25 -0.410751345932E+03 0.32200E+00 -0.35089E-02 10477 0.196E-01 0.558E+00
RMM: 26 -0.410812091003E+03 -0.60745E-01 -0.85710E-03 10201 0.106E-01 0.566E+00
RMM: 27 -0.410787709290E+03 0.24382E-01 -0.23660E-03 10285 0.568E-02 0.562E+00
RMM: 28 -0.410730195226E+03 0.57514E-01 -0.76435E-02 15042 0.347E-01 0.552E+00
RMM: 29 -0.410353904047E+03 0.37629E+00 -0.38910E-01 17201 0.733E-01 0.702E+00
RMM: 30 -0.410992220149E+03 -0.63832E+00 -0.36883E-02 13083 0.258E-01 0.612E+00
RMM: 31 -0.411899348476E+03 -0.90713E+00 -0.39306E-01 16949 0.694E-01 0.649E+00
RMM: 32 -0.412977647387E+03 -0.10783E+01 -0.16911E-01 16224 0.474E-01 0.699E+00
RMM: 33 -0.413639218741E+03 -0.66157E+00 -0.29004E-01 16933 0.618E-01 0.466E+00
RMM: 34 -0.414046290472E+03 -0.40707E+00 -0.21022E-01 15995 0.515E-01 0.421E+00
RMM: 35 -0.413887574132E+03 0.15872E+00 -0.14399E-03 10562 0.522E-02 0.412E+00
RMM: 36 -0.414364056184E+03 -0.47648E+00 -0.18181E-02 13992 0.179E-01 0.343E+00
RMM: 37 -0.415023187269E+03 -0.65913E+00 -0.46484E-02 15744 0.261E-01 0.277E+00
RMM: 38 -0.415329301114E+03 -0.30611E+00 -0.23089E-02 14814 0.177E-01 0.214E+00
RMM: 39 -0.415648674128E+03 -0.31937E+00 -0.11443E-02 13397 0.127E-01 0.171E+00
RMM: 40 -0.416023277897E+03 -0.37460E+00 -0.12548E-02 13517 0.139E-01 0.124E+00
RMM: 41 -0.416199196222E+03 -0.17592E+00 -0.95490E-03 13023 0.115E-01 0.944E-01
RMM: 42 -0.416330997347E+03 -0.13180E+00 -0.12926E-02 13438 0.125E-01 0.847E-01
RMM: 43 -0.416395697304E+03 -0.64700E-01 -0.92831E-03 12812 0.984E-02 0.803E-01
RMM: 44 -0.416536106901E+03 -0.14041E+00 -0.82066E-03 12394 0.961E-02 0.538E-01
RMM: 45 -0.416606394494E+03 -0.70288E-01 -0.37933E-03 11324 0.671E-02 0.430E-01
RMM: 46 -0.416685963872E+03 -0.79569E-01 -0.88132E-03 12213 0.836E-02 0.389E-01
RMM: 47 -0.416747785723E+03 -0.61822E-01 -0.57666E-03 11841 0.673E-02 0.377E-01
RMM: 48 -0.416809005213E+03 -0.61219E-01 -0.27294E-03 11280 0.449E-02 0.286E-01
RMM: 49 -0.416871445293E+03 -0.62440E-01 -0.25042E-03 11516 0.415E-02 0.212E-01
RMM: 50 -0.416930991238E+03 -0.59546E-01 -0.18143E-03 11462 0.343E-02 0.164E-01
RMM: 51 -0.416964050156E+03 -0.33059E-01 -0.97127E-04 11166 0.293E-02 0.125E-01
RMM: 52 -0.416999311895E+03 -0.35262E-01 -0.49514E-04 10875 0.200E-02 0.102E-01
RMM: 53 -0.417036822291E+03 -0.37510E-01 -0.54765E-04 11463 0.191E-02 0.591E-02
RMM: 54 -0.417049207743E+03 -0.12385E-01 -0.14175E-04 9931 0.113E-02 0.450E-02
RMM: 55 -0.417052930773E+03 -0.37230E-02 -0.39747E-05 8067 0.614E-03 0.447E-02
RMM: 56 -0.417056027969E+03 -0.30972E-02 -0.43185E-05 7909 0.554E-03 0.252E-02
RMM: 57 -0.417057314436E+03 -0.12865E-02 -0.20494E-05 7216 0.421E-03 0.213E-02
RMM: 58 -0.417057727787E+03 -0.41335E-03 -0.83198E-06 6563 0.253E-03 0.176E-02
RMM: 59 -0.417057716861E+03 0.10926E-04 -0.23780E-06 5403 0.163E-03 0.139E-02
RMM: 60 -0.417057879900E+03 -0.16304E-03 -0.36021E-06 6170 0.174E-03 0.741E-03
RMM: 61 -0.417057977814E+03 -0.97915E-04 -0.13444E-06 3974 0.113E-03 0.536E-03
RMM: 62 -0.417058076955E+03 -0.99141E-04 -0.13516E-06 3747 0.108E-03 0.384E-03
RMM: 63 -0.417058163932E+03 -0.86978E-04 -0.87638E-07 3565 0.103E-03 0.340E-03
RMM: 64 -0.417058284158E+03 -0.12023E-03 -0.11116E-06 4072 0.111E-03 0.299E-03
RMM: 65 -0.417058358581E+03 -0.74423E-04 -0.45392E-07 3155 0.928E-04 0.284E-03
RMM: 66 -0.417058400837E+03 -0.42256E-04 -0.29227E-07 3001 0.907E-04 0.176E-03
RMM: 67 -0.417058467289E+03 -0.66452E-04 -0.32189E-07 2773 0.857E-04 0.233E-03
RMM: 68 -0.417058514695E+03 -0.47407E-04 -0.32029E-07 2910 0.884E-04 0.148E-03
RMM: 69 -0.417058535679E+03 -0.20984E-04 -0.22109E-07 2768 0.859E-04 0.825E-04
RMM: 70 -0.417058553643E+03 -0.17964E-04 -0.15142E-07 2504 0.803E-04 0.710E-04
RMM: 71 -0.417058563987E+03 -0.10344E-04 -0.14166E-07 2571 0.816E-04 0.402E-04
RMM: 72 -0.417058571062E+03 -0.70752E-05 -0.11363E-07 2436 0.798E-04
1 F= -.45473404E+03 E0= -.45473490E+03 d E =0.256752E-02 mag= -0.0006