iterations/neb1_max2_image03_iter11_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421842901046E+04 0.42184E+04 -0.25377E+05 8992 0.103E+03
DAV: 2 -0.102625711716E+03 -0.43211E+04 -0.39183E+04 11016 0.247E+02
DAV: 3 -0.425785373970E+03 -0.32316E+03 -0.30162E+03 10288 0.656E+01
DAV: 4 -0.434329124896E+03 -0.85438E+01 -0.84405E+01 10704 0.108E+01
DAV: 5 -0.434620150746E+03 -0.29103E+00 -0.29028E+00 11112 0.193E+00 0.975E+01
RMM: 6 -0.389891654923E+03 0.44728E+02 -0.10982E+02 9682 0.145E+01 0.764E+01
RMM: 7 -0.821672148559E+03 -0.43178E+03 -0.42247E+02 11384 0.186E+01 0.148E+02
RMM: 8 -0.484320667801E+03 0.33735E+03 -0.10840E+02 9970 0.110E+01 0.871E+01
RMM: 9 -0.409145790835E+03 0.75175E+02 -0.71299E+01 10218 0.110E+01 0.575E+01
RMM: 10 -0.369933905296E+03 0.39212E+02 -0.32347E+01 10236 0.742E+00 0.306E+01
RMM: 11 -0.378498452966E+03 -0.85645E+01 -0.16938E+01 10334 0.489E+00 0.363E+01
RMM: 12 -0.372414095637E+03 0.60844E+01 -0.51717E+00 10018 0.311E+00 0.249E+01
RMM: 13 -0.368664558070E+03 0.37495E+01 -0.18546E+00 10204 0.185E+00 0.154E+01
RMM: 14 -0.372737370603E+03 -0.40728E+01 -0.14617E+00 10333 0.158E+00 0.131E+01
RMM: 15 -0.380033116114E+03 -0.72957E+01 -0.18651E+00 10720 0.175E+00 0.148E+01
RMM: 16 -0.385198284741E+03 -0.51652E+01 -0.27148E+00 11207 0.198E+00 0.114E+01
RMM: 17 -0.388882925759E+03 -0.36846E+01 -0.16068E+00 10880 0.152E+00 0.883E+00
RMM: 18 -0.392009319909E+03 -0.31264E+01 -0.75033E-01 10387 0.108E+00 0.724E+00
RMM: 19 -0.393520686677E+03 -0.15114E+01 -0.25566E-01 10185 0.627E-01 0.670E+00
RMM: 20 -0.395434088278E+03 -0.19134E+01 -0.35190E-01 10952 0.674E-01 0.669E+00
RMM: 21 -0.397595775051E+03 -0.21617E+01 -0.51040E-01 11580 0.777E-01 0.665E+00
RMM: 22 -0.400408204279E+03 -0.28124E+01 -0.74135E-01 12117 0.858E-01 0.661E+00
RMM: 23 -0.404630063692E+03 -0.42219E+01 -0.17091E+00 13261 0.118E+00 0.469E+00
RMM: 24 -0.408514948552E+03 -0.38849E+01 -0.14391E+00 13218 0.104E+00 0.498E+00
RMM: 25 -0.409520594735E+03 -0.10056E+01 -0.17724E-01 11119 0.414E-01 0.491E+00
RMM: 26 -0.409631740827E+03 -0.11115E+00 -0.19927E-02 10539 0.141E-01 0.492E+00
RMM: 27 -0.409258362643E+03 0.37338E+00 -0.21595E-02 10340 0.171E-01 0.486E+00
RMM: 28 -0.408578619205E+03 0.67974E+00 -0.11924E-01 12476 0.403E-01 0.452E+00
RMM: 29 -0.408857249276E+03 -0.27863E+00 -0.19386E-01 14409 0.519E-01 0.515E+00
RMM: 30 -0.408555643882E+03 0.30161E+00 -0.96030E-02 12866 0.401E-01 0.705E+00
RMM: 31 -0.410281540067E+03 -0.17259E+01 -0.48191E-01 15184 0.810E-01 0.513E+00
RMM: 32 -0.410990421057E+03 -0.70888E+00 -0.29455E-01 14815 0.571E-01 0.560E+00
RMM: 33 -0.411259030120E+03 -0.26861E+00 -0.35221E-02 11186 0.208E-01 0.504E+00
RMM: 34 -0.412351639503E+03 -0.10926E+01 -0.52839E-01 15517 0.666E-01 0.461E+00
RMM: 35 -0.413406791150E+03 -0.10552E+01 -0.32247E-02 11329 0.221E-01 0.345E+00
RMM: 36 -0.413454923384E+03 -0.48132E-01 -0.60196E-03 10328 0.105E-01 0.304E+00
RMM: 37 -0.413618155478E+03 -0.16323E+00 -0.18564E-02 11685 0.183E-01 0.247E+00
RMM: 38 -0.413698550567E+03 -0.80395E-01 -0.15214E-02 11439 0.161E-01 0.204E+00
RMM: 39 -0.413785790187E+03 -0.87240E-01 -0.97100E-03 10858 0.131E-01 0.165E+00
RMM: 40 -0.413903423469E+03 -0.11763E+00 -0.63590E-03 10558 0.102E-01 0.138E+00
RMM: 41 -0.414029896577E+03 -0.12647E+00 -0.81229E-03 11077 0.103E-01 0.116E+00
RMM: 42 -0.414122782975E+03 -0.92886E-01 -0.55220E-03 10794 0.823E-02 0.928E-01
RMM: 43 -0.414219805449E+03 -0.97022E-01 -0.37480E-03 10786 0.650E-02 0.768E-01
RMM: 44 -0.414330985090E+03 -0.11118E+00 -0.41657E-03 11293 0.651E-02 0.584E-01
RMM: 45 -0.414451900219E+03 -0.12092E+00 -0.86733E-03 12368 0.891E-02 0.436E-01
RMM: 46 -0.414534727104E+03 -0.82827E-01 -0.10780E-02 12822 0.979E-02 0.410E-01
RMM: 47 -0.414645066744E+03 -0.11034E+00 -0.75875E-03 12208 0.811E-02 0.672E-01
RMM: 48 -0.414688690066E+03 -0.43623E-01 -0.26650E-03 11090 0.527E-02 0.406E-01
RMM: 49 -0.414755412360E+03 -0.66722E-01 -0.27150E-03 11283 0.497E-02 0.417E-01
RMM: 50 -0.414769997597E+03 -0.14585E-01 -0.93048E-04 10758 0.321E-02 0.357E-01
RMM: 51 -0.414737142242E+03 0.32855E-01 -0.53898E-03 13210 0.638E-02 0.226E-01
RMM: 52 -0.414774687021E+03 -0.37545E-01 -0.11939E-03 11299 0.348E-02 0.136E-01
RMM: 53 -0.414814506306E+03 -0.39819E-01 -0.97656E-04 11385 0.277E-02 0.103E-01
RMM: 54 -0.414837693687E+03 -0.23187E-01 -0.22547E-04 10072 0.146E-02 0.720E-02
RMM: 55 -0.414868006125E+03 -0.30312E-01 -0.35846E-04 10877 0.157E-02 0.637E-02
RMM: 56 -0.414883450602E+03 -0.15444E-01 -0.31363E-04 11650 0.158E-02 0.535E-02
RMM: 57 -0.414888696006E+03 -0.52454E-02 -0.47054E-05 8514 0.731E-03 0.368E-02
RMM: 58 -0.414891164151E+03 -0.24681E-02 -0.29955E-05 7625 0.557E-03 0.295E-02
RMM: 59 -0.414892473058E+03 -0.13089E-02 -0.20439E-05 7339 0.405E-03 0.246E-02
RMM: 60 -0.414893456331E+03 -0.98327E-03 -0.17713E-05 7149 0.350E-03 0.139E-02
RMM: 61 -0.414894068923E+03 -0.61259E-03 -0.90409E-06 6684 0.276E-03 0.109E-02
RMM: 62 -0.414894309038E+03 -0.24012E-03 -0.53250E-06 6505 0.216E-03 0.129E-02
RMM: 63 -0.414894465431E+03 -0.15639E-03 -0.36059E-06 5082 0.162E-03 0.784E-03
RMM: 64 -0.414894546460E+03 -0.81029E-04 -0.28943E-06 5723 0.157E-03 0.136E-02
RMM: 65 -0.414894573990E+03 -0.27531E-04 -0.57397E-07 3295 0.988E-04 0.679E-03
RMM: 66 -0.414894616292E+03 -0.42302E-04 -0.16198E-06 5216 0.131E-03 0.923E-03
RMM: 67 -0.414894628751E+03 -0.12459E-04 -0.62816E-07 3707 0.989E-04 0.109E-02
RMM: 68 -0.414894641268E+03 -0.12517E-04 -0.43563E-07 3339 0.903E-04 0.111E-02
RMM: 69 -0.414894645033E+03 -0.37655E-05 -0.75669E-08 2461 0.752E-04
1 F= -.45261943E+03 E0= -.45261881E+03 d E =-.185574E-02 mag= -0.0011