iterations/neb2_max1_image05_iter6_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421619416766E+04 0.42162E+04 -0.25382E+05 9008 0.103E+03
DAV: 2 -0.106118748950E+03 -0.43223E+04 -0.39239E+04 11008 0.248E+02
DAV: 3 -0.427259904196E+03 -0.32114E+03 -0.30036E+03 10296 0.655E+01
DAV: 4 -0.435686300243E+03 -0.84264E+01 -0.83307E+01 10824 0.106E+01
DAV: 5 -0.435971732105E+03 -0.28543E+00 -0.28475E+00 11200 0.191E+00 0.100E+02
RMM: 6 -0.387297117149E+03 0.48675E+02 -0.10913E+02 9702 0.144E+01 0.716E+01
RMM: 7 -0.741726310305E+03 -0.35443E+03 -0.38009E+02 11144 0.184E+01 0.140E+02
RMM: 8 -0.501504059990E+03 0.24022E+03 -0.11625E+02 10142 0.113E+01 0.911E+01
RMM: 9 -0.397755000889E+03 0.10375E+03 -0.69191E+01 10206 0.107E+01 0.501E+01
RMM: 10 -0.400248849036E+03 -0.24938E+01 -0.44509E+01 10252 0.860E+00 0.496E+01
RMM: 11 -0.389344570079E+03 0.10904E+02 -0.24201E+01 10228 0.609E+00 0.467E+01
RMM: 12 -0.375245635551E+03 0.14099E+02 -0.81440E+00 9957 0.380E+00 0.275E+01
RMM: 13 -0.375192424138E+03 0.53211E-01 -0.27405E+00 10099 0.224E+00 0.232E+01
RMM: 14 -0.374539719296E+03 0.65270E+00 -0.11588E+00 10104 0.145E+00 0.153E+01
RMM: 15 -0.377714641830E+03 -0.31749E+01 -0.11597E+00 10444 0.140E+00 0.119E+01
RMM: 16 -0.383930410431E+03 -0.62158E+01 -0.13799E+00 10811 0.152E+00 0.158E+01
RMM: 17 -0.386735983080E+03 -0.28056E+01 -0.12554E+00 10809 0.138E+00 0.118E+01
RMM: 18 -0.390286851191E+03 -0.35509E+01 -0.94968E-01 10771 0.118E+00 0.869E+00
RMM: 19 -0.394680515353E+03 -0.43937E+01 -0.10361E+00 11109 0.116E+00 0.686E+00
RMM: 20 -0.397587823349E+03 -0.29073E+01 -0.77135E-01 11132 0.102E+00 0.667E+00
RMM: 21 -0.400831024329E+03 -0.32432E+01 -0.12691E+00 11872 0.117E+00 0.657E+00
RMM: 22 -0.403185576368E+03 -0.23546E+01 -0.71493E-01 11446 0.861E-01 0.620E+00
RMM: 23 -0.407321876920E+03 -0.41363E+01 -0.17756E+00 12609 0.118E+00 0.721E+00
RMM: 24 -0.409250756117E+03 -0.19289E+01 -0.76792E-01 11915 0.790E-01 0.764E+00
RMM: 25 -0.409949737395E+03 -0.69898E+00 -0.22478E-01 11100 0.432E-01 0.700E+00
RMM: 26 -0.410266379962E+03 -0.31664E+00 -0.32631E-02 10652 0.171E-01 0.680E+00
RMM: 27 -0.410470265544E+03 -0.20389E+00 -0.11083E-02 10649 0.941E-02 0.677E+00
RMM: 28 -0.410481192062E+03 -0.10927E-01 -0.22942E-03 11413 0.422E-02 0.671E+00
RMM: 29 -0.410499395939E+03 -0.18204E-01 -0.28862E-02 14120 0.173E-01 0.499E+00
RMM: 30 -0.411121433430E+03 -0.62204E+00 -0.69432E-02 15663 0.283E-01 0.458E+00
RMM: 31 -0.411068963155E+03 0.52470E-01 -0.10251E-01 16122 0.366E-01 0.503E+00
RMM: 32 -0.410853621339E+03 0.21534E+00 -0.88879E-02 15854 0.371E-01 0.557E+00
RMM: 33 -0.410091900525E+03 0.76172E+00 -0.99264E-02 15969 0.383E-01 0.735E+00
RMM: 34 -0.411455631349E+03 -0.13637E+01 -0.63991E-01 17635 0.862E-01 0.472E+00
RMM: 35 -0.413396698665E+03 -0.19411E+01 -0.86991E-01 17893 0.907E-01 0.630E+00
RMM: 36 -0.414888720771E+03 -0.14920E+01 -0.36657E-01 17383 0.604E-01 0.444E+00
RMM: 37 -0.415079240030E+03 -0.19052E+00 -0.74659E-02 15611 0.301E-01 0.372E+00
RMM: 38 -0.415069514405E+03 0.97256E-02 -0.13701E-02 12722 0.149E-01 0.346E+00
RMM: 39 -0.415492495576E+03 -0.42298E+00 -0.39273E-02 14798 0.257E-01 0.277E+00
RMM: 40 -0.416061329900E+03 -0.56883E+00 -0.37027E-02 14806 0.228E-01 0.217E+00
RMM: 41 -0.416429911627E+03 -0.36858E+00 -0.13815E-02 12813 0.140E-01 0.179E+00
RMM: 42 -0.416647253989E+03 -0.21734E+00 -0.11946E-02 12407 0.127E-01 0.139E+00
RMM: 43 -0.416904333826E+03 -0.25708E+00 -0.15092E-02 12722 0.135E-01 0.127E+00
RMM: 44 -0.417068832268E+03 -0.16450E+00 -0.84080E-03 11878 0.992E-02 0.107E+00
RMM: 45 -0.417233338759E+03 -0.16451E+00 -0.11198E-02 12333 0.109E-01 0.720E-01
RMM: 46 -0.417418239846E+03 -0.18490E+00 -0.25121E-02 13684 0.145E-01 0.801E-01
RMM: 47 -0.417458351825E+03 -0.40112E-01 -0.14652E-02 12714 0.111E-01 0.127E+00
RMM: 48 -0.417354894902E+03 0.10346E+00 -0.63031E-03 11445 0.756E-02 0.126E+00
RMM: 49 -0.417443107653E+03 -0.88213E-01 -0.71111E-03 11718 0.773E-02 0.108E+00
RMM: 50 -0.417562119044E+03 -0.11901E+00 -0.38522E-03 11350 0.637E-02 0.740E-01
RMM: 51 -0.417598434457E+03 -0.36315E-01 -0.67655E-03 12216 0.957E-02 0.615E-01
RMM: 52 -0.417603779821E+03 -0.53454E-02 -0.97146E-04 10484 0.411E-02 0.509E-01
RMM: 53 -0.417624661202E+03 -0.20881E-01 -0.13053E-03 10892 0.421E-02 0.362E-01
RMM: 54 -0.417686394791E+03 -0.61734E-01 -0.12020E-03 11170 0.336E-02 0.249E-01
RMM: 55 -0.417732549121E+03 -0.46154E-01 -0.33867E-04 10566 0.188E-02 0.240E-01
RMM: 56 -0.417756827668E+03 -0.24279E-01 -0.29037E-04 10724 0.191E-02 0.225E-01
RMM: 57 -0.417803813324E+03 -0.46986E-01 -0.48503E-04 11430 0.233E-02 0.109E-01
RMM: 58 -0.417831208473E+03 -0.27395E-01 -0.14616E-04 10590 0.124E-02 0.925E-02
RMM: 59 -0.417851012501E+03 -0.19804E-01 -0.14890E-04 9965 0.112E-02 0.845E-02
RMM: 60 -0.417855824526E+03 -0.48120E-02 -0.76163E-05 9007 0.804E-03 0.833E-02
RMM: 61 -0.417857929667E+03 -0.21051E-02 -0.57314E-05 9289 0.871E-03 0.475E-02
RMM: 62 -0.417859390148E+03 -0.14605E-02 -0.38461E-05 7875 0.574E-03 0.407E-02
RMM: 63 -0.417860437365E+03 -0.10472E-02 -0.30383E-05 7652 0.537E-03 0.334E-02
RMM: 64 -0.417860886200E+03 -0.44884E-03 -0.15473E-05 6922 0.399E-03 0.249E-02
RMM: 65 -0.417861200762E+03 -0.31456E-03 -0.85243E-06 6703 0.274E-03 0.121E-02
RMM: 66 -0.417861355747E+03 -0.15498E-03 -0.28178E-06 5609 0.167E-03 0.113E-02
RMM: 67 -0.417861478282E+03 -0.12253E-03 -0.22845E-06 5020 0.145E-03 0.977E-03
RMM: 68 -0.417861637699E+03 -0.15942E-03 -0.25936E-06 5728 0.157E-03 0.450E-03
RMM: 69 -0.417861753128E+03 -0.11543E-03 -0.17477E-06 4452 0.129E-03 0.479E-03
RMM: 70 -0.417861813352E+03 -0.60224E-04 -0.89868E-07 3483 0.101E-03 0.369E-03
RMM: 71 -0.417861823901E+03 -0.10549E-04 -0.11677E-06 4029 0.108E-03 0.201E-03
RMM: 72 -0.417861869109E+03 -0.45208E-04 -0.39983E-07 2977 0.914E-04 0.154E-03
RMM: 73 -0.417861888883E+03 -0.19774E-04 -0.65311E-07 3486 0.964E-04 0.136E-03
RMM: 74 -0.417861906383E+03 -0.17500E-04 -0.32149E-07 2938 0.883E-04 0.130E-03
RMM: 75 -0.417861917838E+03 -0.11455E-04 -0.35252E-07 3006 0.885E-04 0.350E-03
RMM: 76 -0.417861915028E+03 0.28099E-05 -0.68801E-08 2409 0.816E-04
1 F= -.45549230E+03 E0= -.45549274E+03 d E =0.130832E-02 mag= 0.0001