iterations/neb1_max2_image01_iter7_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422165613971E+04 0.42217E+04 -0.25382E+05 8992 0.103E+03
DAV: 2 -0.103320190320E+03 -0.43250E+04 -0.39236E+04 10984 0.248E+02
DAV: 3 -0.426819719529E+03 -0.32350E+03 -0.30194E+03 10208 0.656E+01
DAV: 4 -0.435404742036E+03 -0.85850E+01 -0.84796E+01 10784 0.107E+01
DAV: 5 -0.435704901999E+03 -0.30016E+00 -0.29936E+00 11072 0.195E+00 0.990E+01
RMM: 6 -0.390233283581E+03 0.45472E+02 -0.11135E+02 9688 0.146E+01 0.738E+01
RMM: 7 -0.822199793322E+03 -0.43197E+03 -0.44758E+02 11378 0.194E+01 0.152E+02
RMM: 8 -0.492773275840E+03 0.32943E+03 -0.10533E+02 9947 0.109E+01 0.909E+01
RMM: 9 -0.426607206649E+03 0.66166E+02 -0.70123E+01 10205 0.108E+01 0.621E+01
RMM: 10 -0.371409128823E+03 0.55198E+02 -0.37426E+01 10282 0.798E+00 0.306E+01
RMM: 11 -0.383558053782E+03 -0.12149E+02 -0.17564E+01 10427 0.453E+00 0.410E+01
RMM: 12 -0.370816572451E+03 0.12741E+02 -0.48706E+00 9941 0.309E+00 0.210E+01
RMM: 13 -0.370345632939E+03 0.47094E+00 -0.12915E+00 10206 0.158E+00 0.151E+01
RMM: 14 -0.373854806355E+03 -0.35092E+01 -0.11414E+00 10261 0.141E+00 0.136E+01
RMM: 15 -0.384022543366E+03 -0.10168E+02 -0.32496E+00 11812 0.231E+00 0.154E+01
RMM: 16 -0.388892561108E+03 -0.48700E+01 -0.17974E+00 10989 0.164E+00 0.156E+01
RMM: 17 -0.389230433620E+03 -0.33787E+00 -0.71324E-01 10367 0.105E+00 0.106E+01
RMM: 18 -0.392867075327E+03 -0.36366E+01 -0.11037E+00 11240 0.117E+00 0.817E+00
RMM: 19 -0.395102488028E+03 -0.22354E+01 -0.43291E-01 10575 0.812E-01 0.727E+00
RMM: 20 -0.396696463266E+03 -0.15940E+01 -0.21918E-01 10492 0.546E-01 0.725E+00
RMM: 21 -0.398782823349E+03 -0.20864E+01 -0.51268E-01 11617 0.745E-01 0.718E+00
RMM: 22 -0.403087007315E+03 -0.43042E+01 -0.20291E+00 13358 0.133E+00 0.613E+00
RMM: 23 -0.406881320423E+03 -0.37943E+01 -0.13107E+00 12893 0.104E+00 0.520E+00
RMM: 24 -0.409476922689E+03 -0.25956E+01 -0.60297E-01 12028 0.707E-01 0.491E+00
RMM: 25 -0.410801758788E+03 -0.13248E+01 -0.22478E-01 11329 0.448E-01 0.502E+00
RMM: 26 -0.411367640720E+03 -0.56588E+00 -0.10755E-01 10986 0.309E-01 0.495E+00
RMM: 27 -0.411695550963E+03 -0.32791E+00 -0.26286E-02 10478 0.157E-01 0.498E+00
RMM: 28 -0.411624993382E+03 0.70558E-01 -0.12759E-02 10233 0.138E-01 0.489E+00
RMM: 29 -0.411473061065E+03 0.15193E+00 -0.10247E-01 13070 0.394E-01 0.478E+00
RMM: 30 -0.411537686073E+03 -0.64625E-01 -0.12656E-01 14040 0.437E-01 0.497E+00
RMM: 31 -0.411450700858E+03 0.86985E-01 -0.69135E-02 12656 0.333E-01 0.580E+00
RMM: 32 -0.412255536383E+03 -0.80484E+00 -0.22802E-01 14570 0.609E-01 0.538E+00
RMM: 33 -0.412962533766E+03 -0.70700E+00 -0.56967E-01 16173 0.839E-01 0.832E+00
RMM: 34 -0.413476503887E+03 -0.51397E+00 -0.20537E-02 11095 0.198E-01 0.810E+00
RMM: 35 -0.413585912741E+03 -0.10941E+00 -0.97562E-03 10808 0.101E-01 0.817E+00
RMM: 36 -0.413945369118E+03 -0.35946E+00 -0.38207E-02 12705 0.195E-01 0.831E+00
RMM: 37 -0.414856311835E+03 -0.91094E+00 -0.37689E-01 16563 0.582E-01 0.617E+00
RMM: 38 -0.415177762713E+03 -0.32145E+00 -0.15191E-01 15151 0.369E-01 0.587E+00
RMM: 39 -0.415239954030E+03 -0.62191E-01 -0.15098E-01 14484 0.322E-01 0.572E+00
RMM: 40 -0.414940302521E+03 0.29965E+00 -0.34582E-01 13884 0.451E-01 0.576E+00
RMM: 41 -0.414612530216E+03 0.32777E+00 -0.33634E-01 12413 0.394E-01 0.588E+00
RMM: 42 -0.414477652514E+03 0.13488E+00 -0.32022E-02 10997 0.129E-01 0.586E+00
RMM: 43 -0.414579399222E+03 -0.10175E+00 -0.43723E-02 11133 0.157E-01 0.591E+00
RMM: 44 -0.414664078627E+03 -0.84679E-01 -0.96677E-02 12493 0.251E-01 0.620E+00
RMM: 45 -0.414731562136E+03 -0.67484E-01 -0.55836E-02 11973 0.177E-01 0.639E+00
RMM: 46 -0.413808797018E+03 0.92277E+00 -0.12607E+00 14769 0.754E-01 0.617E+00
RMM: 47 -0.411669987662E+03 0.21388E+01 -0.21372E+00 15704 0.967E-01 0.625E+00
RMM: 48 -0.412040529503E+03 -0.37054E+00 -0.58123E-02 11956 0.193E-01 0.649E+00
RMM: 49 -0.411113335784E+03 0.92719E+00 -0.17848E-01 14044 0.304E-01 0.635E+00
RMM: 50 -0.410680879284E+03 0.43246E+00 -0.42033E-02 12865 0.153E-01 0.624E+00
RMM: 51 -0.411010256760E+03 -0.32938E+00 -0.21261E-01 17359 0.477E-01 0.750E+00
RMM: 52 -0.411893087635E+03 -0.88283E+00 -0.58243E-01 16437 0.538E-01 0.756E+00
RMM: 53 -0.412382723072E+03 -0.48964E+00 -0.27360E-01 16061 0.393E-01 0.813E+00
RMM: 54 -0.412064601249E+03 0.31812E+00 -0.16315E-01 14804 0.320E-01 0.847E+00
RMM: 55 -0.411774476162E+03 0.29013E+00 -0.10342E-01 13412 0.224E-01 0.858E+00
RMM: 56 -0.412976683964E+03 -0.12022E+01 -0.16374E+00 16941 0.808E-01 0.867E+00
RMM: 57 -0.411612222942E+03 0.13645E+01 -0.25796E+00 16688 0.111E+00 0.814E+00
RMM: 58 -0.411343493662E+03 0.26873E+00 -0.12297E-01 14798 0.257E-01 0.845E+00
RMM: 59 -0.411314099441E+03 0.29394E-01 -0.53366E-03 11334 0.682E-02 0.833E+00
RMM: 60 -0.411319504690E+03 -0.54052E-02 -0.12034E-03 10645 0.382E-02 0.819E+00
RMM: 61 -0.411319543221E+03 -0.38530E-04 -0.77350E-02 16094 0.235E-01 0.790E+00
RMM: 62 -0.411330703633E+03 -0.11160E-01 -0.36921E-02 15663 0.192E-01 0.743E+00
RMM: 63 -0.411278141169E+03 0.52562E-01 -0.85941E-02 15818 0.258E-01 0.691E+00
RMM: 64 -0.411717038611E+03 -0.43890E+00 -0.28409E-01 16819 0.412E-01 0.641E+00
RMM: 65 -0.412195309974E+03 -0.47827E+00 -0.34164E-01 16990 0.413E-01 0.618E+00
RMM: 66 -0.412250832070E+03 -0.55522E-01 -0.97903E-02 16487 0.244E-01 0.594E+00
RMM: 67 -0.412237960306E+03 0.12872E-01 -0.67198E-02 15535 0.218E-01 0.577E+00
RMM: 68 -0.411839230006E+03 0.39873E+00 -0.10138E-01 16384 0.276E-01 0.540E+00
RMM: 69 -0.411712102028E+03 0.12713E+00 -0.93489E-02 16669 0.282E-01 0.772E+00
RMM: 70 -0.411638699143E+03 0.73403E-01 -0.96281E-03 13848 0.140E-01 0.760E+00
RMM: 71 -0.411016774569E+03 0.62192E+00 -0.13126E-01 16144 0.299E-01 0.777E+00
RMM: 72 -0.411107735108E+03 -0.90961E-01 -0.15507E-02 14634 0.133E-01 0.759E+00
RMM: 73 -0.411217152376E+03 -0.10942E+00 -0.23439E-03 11195 0.497E-02 0.749E+00
RMM: 74 -0.411674324053E+03 -0.45717E+00 -0.52433E-02 14488 0.192E-01 0.708E+00
RMM: 75 -0.412466752675E+03 -0.79243E+00 -0.18096E-01 16081 0.325E-01 0.639E+00
RMM: 76 -0.413382862443E+03 -0.91611E+00 -0.67798E-01 17846 0.679E-01 0.475E+00
RMM: 77 -0.412951303413E+03 0.43156E+00 -0.20621E-01 16807 0.377E-01 0.452E+00
RMM: 78 -0.412753595526E+03 0.19771E+00 -0.13838E-01 15518 0.290E-01 0.428E+00
RMM: 79 -0.412711568471E+03 0.42027E-01 -0.20348E-01 16223 0.346E-01 0.386E+00
RMM: 80 -0.412861057229E+03 -0.14949E+00 -0.17690E-01 15996 0.304E-01 0.354E+00
RMM: 81 -0.411855653676E+03 0.10054E+01 -0.13176E+00 17898 0.973E-01 0.281E+00
RMM: 82 -0.411459120691E+03 0.39653E+00 -0.53754E-02 15832 0.190E-01 0.289E+00
RMM: 83 -0.411692740599E+03 -0.23362E+00 -0.17962E-02 14097 0.116E-01 0.289E+00
RMM: 84 -0.411019467590E+03 0.67327E+00 -0.10674E-01 16718 0.297E-01 0.294E+00
RMM: 85 -0.411090093481E+03 -0.70626E-01 -0.60156E-03 12525 0.750E-02 0.295E+00
RMM: 86 -0.410877603822E+03 0.21249E+00 -0.79993E-02 16419 0.236E-01 0.301E+00
RMM: 87 -0.411113445954E+03 -0.23584E+00 -0.10030E-02 14755 0.107E-01 0.299E+00
RMM: 88 -0.411033437807E+03 0.80008E-01 -0.26577E-02 15151 0.138E-01 0.305E+00
RMM: 89 -0.411033376828E+03 0.60979E-04 -0.16236E-04 9908 0.163E-02 0.305E+00
RMM: 90 -0.411045951032E+03 -0.12574E-01 -0.19405E-04 7662 0.141E-02 0.305E+00
RMM: 91 -0.414377982865E+03 -0.33320E+01 -0.35386E+00 17919 0.127E+00 0.284E+00
RMM: 92 -0.414573269123E+03 -0.19529E+00 -0.67206E-01 17867 0.562E-01 0.266E+00
RMM: 93 -0.413609729083E+03 0.96354E+00 -0.12440E+00 17776 0.828E-01 0.246E+00
RMM: 94 -0.413004235315E+03 0.60549E+00 -0.32808E-01 17704 0.425E-01 0.243E+00
RMM: 95 -0.413289865433E+03 -0.28563E+00 -0.19174E-01 17744 0.341E-01 0.251E+00
RMM: 96 -0.413199091316E+03 0.90774E-01 -0.45093E-02 17530 0.188E-01 0.251E+00
RMM: 97 -0.413288133571E+03 -0.89042E-01 -0.68137E-03 14731 0.679E-02 0.251E+00
RMM: 98 -0.413305444151E+03 -0.17311E-01 -0.17795E-02 16925 0.125E-01 0.241E+00
RMM: 99 -0.413378795879E+03 -0.73352E-01 -0.38924E-03 15735 0.594E-02 0.241E+00
RMM: 100 -0.413683366732E+03 -0.30457E+00 -0.77476E-02 16659 0.196E-01 0.243E+00
RMM: 101 -0.414593071779E+03 -0.90971E+00 -0.16365E+00 17880 0.726E-01 0.262E+00
RMM: 102 -0.414531149987E+03 0.61922E-01 -0.12724E-02 15829 0.928E-02 0.262E+00
RMM: 103 -0.414525054085E+03 0.60959E-02 -0.15707E-03 10190 0.326E-02 0.263E+00
RMM: 104 -0.413982282763E+03 0.54277E+00 -0.96754E-01 17847 0.683E-01 0.287E+00
RMM: 105 -0.412939339608E+03 0.10429E+01 -0.73576E-01 17875 0.649E-01 0.321E+00
RMM: 106 -0.411172105491E+03 0.17672E+01 -0.95045E-01 17911 0.793E-01 0.387E+00
RMM: 107 -0.410988733969E+03 0.18337E+00 -0.39357E-02 17617 0.179E-01 0.384E+00
RMM: 108 -0.410993458134E+03 -0.47242E-02 -0.33774E-04 9750 0.220E-02 0.385E+00
RMM: 109 -0.410909880768E+03 0.83577E-01 -0.18076E-03 11538 0.405E-02 0.390E+00
RMM: 110 -0.411158832738E+03 -0.24895E+00 -0.17125E-02 16179 0.124E-01 0.368E+00
RMM: 111 -0.413015861711E+03 -0.18570E+01 -0.18068E+00 17920 0.861E-01 0.303E+00
RMM: 112 -0.411812641669E+03 0.12032E+01 -0.29226E-01 17908 0.447E-01 0.299E+00
RMM: 113 -0.411228507328E+03 0.58413E+00 -0.36236E-01 17840 0.462E-01 0.314E+00
RMM: 114 -0.411155192047E+03 0.73315E-01 -0.17953E-02 15453 0.103E-01 0.318E+00
RMM: 115 -0.412234212884E+03 -0.10790E+01 -0.37502E-01 17546 0.457E-01 0.298E+00
RMM: 116 -0.415142470551E+03 -0.29083E+01 -0.43977E+00 17919 0.118E+00 0.256E+00
RMM: 117 -0.415007540664E+03 0.13493E+00 -0.58798E-02 17630 0.197E-01 0.218E+00
RMM: 118 -0.415514930352E+03 -0.50739E+00 -0.36715E-01 17775 0.367E-01 0.175E+00
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RMM: 120 -0.415871321194E+03 -0.24265E+00 -0.26292E-01 17542 0.293E-01 0.188E+00
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RMM: 123 -0.416087962149E+03 -0.42343E-01 -0.26996E-03 13956 0.427E-02 0.144E+00
RMM: 124 -0.416142249220E+03 -0.54287E-01 -0.36195E-02 17196 0.123E-01 0.112E+00
RMM: 125 -0.416187536600E+03 -0.45287E-01 -0.25712E-02 16946 0.103E-01 0.108E+00
RMM: 126 -0.416218908579E+03 -0.31372E-01 -0.13869E-02 16415 0.796E-02 0.752E-01
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RMM: 128 -0.416349897782E+03 -0.99042E-01 -0.65108E-03 15472 0.613E-02 0.567E-01
RMM: 129 -0.416396574447E+03 -0.46677E-01 -0.19251E-03 13292 0.337E-02 0.399E-01
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RMM: 150 -0.416626805256E+03 -0.64041E-05 -0.62053E-07 3312 0.986E-04
1 F= -.45433007E+03 E0= -.45432983E+03 d E =-.709139E-03 mag= -0.0008