iterations/neb0_image03_iter19_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422485185913E+04 0.42249E+04 -0.25381E+05 8992 0.103E+03
DAV: 2 -0.101401102951E+03 -0.43263E+04 -0.39215E+04 11024 0.248E+02
DAV: 3 -0.424393140088E+03 -0.32299E+03 -0.30197E+03 10264 0.657E+01
DAV: 4 -0.433019548724E+03 -0.86264E+01 -0.85078E+01 10888 0.108E+01
DAV: 5 -0.433315717913E+03 -0.29617E+00 -0.29539E+00 11072 0.194E+00 0.981E+01
RMM: 6 -0.389553954931E+03 0.43762E+02 -0.10683E+02 9674 0.144E+01 0.762E+01
RMM: 7 -0.828638816677E+03 -0.43908E+03 -0.43926E+02 11535 0.190E+01 0.154E+02
RMM: 8 -0.484454281629E+03 0.34418E+03 -0.10024E+02 9963 0.108E+01 0.879E+01
RMM: 9 -0.422462440810E+03 0.61992E+02 -0.73953E+01 10235 0.111E+01 0.627E+01
RMM: 10 -0.363109408999E+03 0.59353E+02 -0.31355E+01 10251 0.716E+00 0.230E+01
RMM: 11 -0.366937579517E+03 -0.38282E+01 -0.12462E+01 10175 0.438E+00 0.218E+01
RMM: 12 -0.367997488416E+03 -0.10599E+01 -0.37700E+00 10251 0.245E+00 0.178E+01
RMM: 13 -0.371157702910E+03 -0.31602E+01 -0.26970E+00 10194 0.231E+00 0.141E+01
RMM: 14 -0.375717961368E+03 -0.45603E+01 -0.22349E+00 10252 0.197E+00 0.132E+01
RMM: 15 -0.379132194153E+03 -0.34142E+01 -0.11329E+00 10191 0.136E+00 0.104E+01
RMM: 16 -0.386031644093E+03 -0.68994E+01 -0.21740E+00 11259 0.171E+00 0.105E+01
RMM: 17 -0.389096129958E+03 -0.30645E+01 -0.95792E-01 10610 0.119E+00 0.731E+00
RMM: 18 -0.391407856502E+03 -0.23117E+01 -0.34576E-01 10297 0.689E-01 0.665E+00
RMM: 19 -0.393685596984E+03 -0.22777E+01 -0.43854E-01 11015 0.705E-01 0.633E+00
RMM: 20 -0.397293392689E+03 -0.36078E+01 -0.11816E+00 12278 0.109E+00 0.584E+00
RMM: 21 -0.401313704621E+03 -0.40203E+01 -0.12687E+00 12477 0.108E+00 0.457E+00
RMM: 22 -0.405722766019E+03 -0.44091E+01 -0.13047E+00 12512 0.103E+00 0.447E+00
RMM: 23 -0.408313766370E+03 -0.25910E+01 -0.85120E-01 12219 0.829E-01 0.464E+00
RMM: 24 -0.409452880132E+03 -0.11391E+01 -0.30806E-01 11432 0.513E-01 0.477E+00
RMM: 25 -0.409703990772E+03 -0.25111E+00 -0.35578E-02 10407 0.193E-01 0.470E+00
RMM: 26 -0.409251669094E+03 0.45232E+00 -0.42183E-02 10380 0.244E-01 0.444E+00
RMM: 27 -0.408809793436E+03 0.44188E+00 -0.14973E-01 12178 0.483E-01 0.422E+00
RMM: 28 -0.408752575509E+03 0.57218E-01 -0.26144E-01 13888 0.617E-01 0.601E+00
RMM: 29 -0.408194924763E+03 0.55765E+00 -0.29493E-02 10413 0.230E-01 0.669E+00
RMM: 30 -0.410107560004E+03 -0.19126E+01 -0.53210E-01 14781 0.842E-01 0.524E+00
RMM: 31 -0.411043415165E+03 -0.93586E+00 -0.50455E-01 14939 0.702E-01 0.562E+00
RMM: 32 -0.411939549343E+03 -0.89613E+00 -0.22887E-01 13347 0.473E-01 0.475E+00
RMM: 33 -0.412533002738E+03 -0.59345E+00 -0.58692E-02 11255 0.298E-01 0.285E+00
RMM: 34 -0.412717518372E+03 -0.18452E+00 -0.84783E-03 10277 0.113E-01 0.249E+00
RMM: 35 -0.412831959239E+03 -0.11444E+00 -0.80945E-03 10503 0.116E-01 0.241E+00
RMM: 36 -0.413048768831E+03 -0.21681E+00 -0.26904E-02 12141 0.212E-01 0.220E+00
RMM: 37 -0.413124385450E+03 -0.75617E-01 -0.13459E-02 11095 0.147E-01 0.156E+00
RMM: 38 -0.413273502052E+03 -0.14912E+00 -0.94334E-03 10797 0.117E-01 0.111E+00
RMM: 39 -0.413378771777E+03 -0.10527E+00 -0.55636E-03 10584 0.873E-02 0.989E-01
RMM: 40 -0.413475044607E+03 -0.96273E-01 -0.60208E-03 11054 0.860E-02 0.872E-01
RMM: 41 -0.413576177575E+03 -0.10113E+00 -0.11162E-02 11952 0.110E-01 0.666E-01
RMM: 42 -0.413690753322E+03 -0.11458E+00 -0.12404E-02 12139 0.111E-01 0.474E-01
RMM: 43 -0.413809106888E+03 -0.11835E+00 -0.11054E-02 11838 0.976E-02 0.357E-01
RMM: 44 -0.413902270838E+03 -0.93164E-01 -0.10466E-02 11957 0.886E-02 0.470E-01
RMM: 45 -0.413919373859E+03 -0.17103E-01 -0.33940E-03 11058 0.558E-02 0.307E-01
RMM: 46 -0.413977110819E+03 -0.57737E-01 -0.33803E-03 11363 0.523E-02 0.306E-01
RMM: 47 -0.414014362109E+03 -0.37251E-01 -0.18428E-03 11140 0.384E-02 0.227E-01
RMM: 48 -0.414054016097E+03 -0.39654E-01 -0.13445E-03 11289 0.334E-02 0.190E-01
RMM: 49 -0.414077680767E+03 -0.23665E-01 -0.65123E-04 10895 0.228E-02 0.109E-01
RMM: 50 -0.414112063378E+03 -0.34383E-01 -0.70552E-04 11434 0.226E-02 0.836E-02
RMM: 51 -0.414135104507E+03 -0.23041E-01 -0.46212E-04 11343 0.191E-02 0.961E-02
RMM: 52 -0.414156207267E+03 -0.21103E-01 -0.19969E-04 10116 0.133E-02 0.533E-02
RMM: 53 -0.414163117671E+03 -0.69104E-02 -0.87770E-05 9119 0.862E-03 0.380E-02
RMM: 54 -0.414165131058E+03 -0.20134E-02 -0.35562E-05 7931 0.527E-03 0.354E-02
RMM: 55 -0.414166487544E+03 -0.13565E-02 -0.21099E-05 7275 0.417E-03 0.274E-02
RMM: 56 -0.414166732133E+03 -0.24459E-03 -0.18873E-05 6924 0.452E-03 0.298E-02
RMM: 57 -0.414167561516E+03 -0.82938E-03 -0.10362E-05 6657 0.322E-03 0.219E-02
RMM: 58 -0.414167965924E+03 -0.40441E-03 -0.59490E-06 6512 0.222E-03 0.132E-02
RMM: 59 -0.414168101200E+03 -0.13528E-03 -0.36776E-06 5747 0.174E-03 0.160E-02
RMM: 60 -0.414168092664E+03 0.85363E-05 -0.10834E-06 4375 0.121E-03
1 F= -.45198559E+03 E0= -.45198525E+03 d E =-.100740E-02 mag= -0.0145