iterations/neb0_image02_iter52_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422417566369E+04 0.42242E+04 -0.25385E+05 8992 0.103E+03
DAV: 2 -0.104599846862E+03 -0.43288E+04 -0.39265E+04 11008 0.248E+02
DAV: 3 -0.426981539632E+03 -0.32238E+03 -0.30112E+03 10208 0.656E+01
DAV: 4 -0.435467443322E+03 -0.84859E+01 -0.83868E+01 10776 0.107E+01
DAV: 5 -0.435763218629E+03 -0.29578E+00 -0.29505E+00 11208 0.195E+00 0.997E+01
RMM: 6 -0.388960429264E+03 0.46803E+02 -0.11074E+02 9699 0.145E+01 0.729E+01
RMM: 7 -0.798439475290E+03 -0.40948E+03 -0.43325E+02 11313 0.193E+01 0.148E+02
RMM: 8 -0.498245841637E+03 0.30019E+03 -0.11468E+02 10028 0.113E+01 0.914E+01
RMM: 9 -0.418998968027E+03 0.79247E+02 -0.66429E+01 10161 0.106E+01 0.578E+01
RMM: 10 -0.386552006000E+03 0.32447E+02 -0.40657E+01 10289 0.839E+00 0.406E+01
RMM: 11 -0.385801181125E+03 0.75082E+00 -0.23340E+01 10341 0.569E+00 0.450E+01
RMM: 12 -0.375317770867E+03 0.10483E+02 -0.75612E+00 9990 0.365E+00 0.298E+01
RMM: 13 -0.374440698074E+03 0.87707E+00 -0.33372E+00 10167 0.247E+00 0.235E+01
RMM: 14 -0.373132559220E+03 0.13081E+01 -0.13716E+00 10134 0.155E+00 0.155E+01
RMM: 15 -0.376813849520E+03 -0.36813E+01 -0.13450E+00 10451 0.149E+00 0.126E+01
RMM: 16 -0.382390481322E+03 -0.55766E+01 -0.12374E+00 10478 0.146E+00 0.136E+01
RMM: 17 -0.387982049397E+03 -0.55916E+01 -0.22193E+00 11324 0.180E+00 0.103E+01
RMM: 18 -0.391203109940E+03 -0.32211E+01 -0.94054E-01 10584 0.117E+00 0.676E+00
RMM: 19 -0.394044148229E+03 -0.28410E+01 -0.41606E-01 10306 0.799E-01 0.648E+00
RMM: 20 -0.397239115067E+03 -0.31950E+01 -0.88066E-01 11439 0.104E+00 0.693E+00
RMM: 21 -0.400108877182E+03 -0.28698E+01 -0.10980E+00 11949 0.111E+00 0.641E+00
RMM: 22 -0.402948067935E+03 -0.28392E+01 -0.96078E-01 11884 0.980E-01 0.542E+00
RMM: 23 -0.407052471006E+03 -0.41044E+01 -0.18600E+00 12852 0.124E+00 0.685E+00
RMM: 24 -0.408775222167E+03 -0.17228E+01 -0.72295E-01 11898 0.770E-01 0.717E+00
RMM: 25 -0.408807883524E+03 -0.32661E-01 -0.53190E-02 10521 0.236E-01 0.692E+00
RMM: 26 -0.408752773366E+03 0.55110E-01 -0.12098E-02 11274 0.940E-02 0.692E+00
RMM: 27 -0.408728284598E+03 0.24489E-01 -0.20891E-03 11714 0.400E-02 0.693E+00
RMM: 28 -0.408720904644E+03 0.73800E-02 -0.31748E-03 10520 0.687E-02 0.692E+00
RMM: 29 -0.408818350296E+03 -0.97446E-01 -0.63421E-02 15744 0.289E-01 0.659E+00
RMM: 30 -0.408890687434E+03 -0.72337E-01 -0.23225E-02 14275 0.176E-01 0.656E+00
RMM: 31 -0.409101731811E+03 -0.21104E+00 -0.29521E-02 14753 0.194E-01 0.948E+00
RMM: 32 -0.407998589511E+03 0.11031E+01 -0.23641E-02 13003 0.182E-01 0.798E+00
RMM: 33 -0.408737559849E+03 -0.73897E+00 -0.55570E-02 14042 0.200E-01 0.928E+00
RMM: 34 -0.408360880186E+03 0.37668E+00 -0.86855E-02 14956 0.267E-01 0.994E+00
RMM: 35 -0.408073682643E+03 0.28720E+00 -0.70466E-02 14374 0.217E-01 0.949E+00
RMM: 36 -0.409171184950E+03 -0.10975E+01 -0.31523E-01 16586 0.533E-01 0.755E+00
RMM: 37 -0.409725222211E+03 -0.55404E+00 -0.50025E-01 17250 0.627E-01 0.626E+00
RMM: 38 -0.410982352782E+03 -0.12571E+01 -0.54178E-01 17229 0.630E-01 0.627E+00
RMM: 39 -0.412046569751E+03 -0.10642E+01 -0.10625E+00 17830 0.958E-01 0.583E+00
RMM: 40 -0.413236446134E+03 -0.11899E+01 -0.23016E-01 17508 0.541E-01 0.722E+00
RMM: 41 -0.413017038971E+03 0.21941E+00 -0.82369E-01 17256 0.801E-01 0.773E+00
RMM: 42 -0.411467503241E+03 0.15495E+01 -0.13605E+00 16795 0.887E-01 0.829E+00
RMM: 43 -0.410168932910E+03 0.12986E+01 -0.63789E-01 14418 0.554E-01 0.881E+00
RMM: 44 -0.410556097518E+03 -0.38716E+00 -0.85736E-02 13101 0.243E-01 0.870E+00
RMM: 45 -0.411079916930E+03 -0.52382E+00 -0.12800E-01 13552 0.275E-01 0.860E+00
RMM: 46 -0.411669631483E+03 -0.58971E+00 -0.14903E-01 12501 0.258E-01 0.840E+00
RMM: 47 -0.412508802085E+03 -0.83917E+00 -0.43631E-01 13813 0.436E-01 0.800E+00
RMM: 48 -0.413425983448E+03 -0.91718E+00 -0.62018E-01 14823 0.478E-01 0.568E+00
RMM: 49 -0.414550764197E+03 -0.11248E+01 -0.71639E-01 14893 0.507E-01 0.636E+00
RMM: 50 -0.415015038027E+03 -0.46427E+00 -0.30796E-01 14321 0.330E-01 0.577E+00
RMM: 51 -0.415115855267E+03 -0.10082E+00 -0.98635E-01 17738 0.791E-01 0.513E+00
RMM: 52 -0.415197387084E+03 -0.81532E-01 -0.41494E-02 13681 0.172E-01 0.457E+00
RMM: 53 -0.415229852452E+03 -0.32465E-01 -0.24722E-02 14290 0.173E-01 0.449E+00
RMM: 54 -0.415032058772E+03 0.19779E+00 -0.48273E-02 15430 0.224E-01 0.486E+00
RMM: 55 -0.414759860568E+03 0.27220E+00 -0.76699E-02 15969 0.254E-01 0.514E+00
RMM: 56 -0.414708322800E+03 0.51538E-01 -0.48292E-02 14787 0.191E-01 0.533E+00
RMM: 57 -0.414753688116E+03 -0.45365E-01 -0.13134E-02 13141 0.118E-01 0.677E+00
RMM: 58 -0.414685671962E+03 0.68016E-01 -0.26544E-03 10671 0.753E-02 0.648E+00
RMM: 59 -0.414639321363E+03 0.46351E-01 -0.56385E-02 14484 0.156E-01 0.556E+00
RMM: 60 -0.414743395231E+03 -0.10407E+00 -0.35328E-03 11234 0.741E-02 0.589E+00
RMM: 61 -0.414900968294E+03 -0.15757E+00 -0.91752E-02 14429 0.188E-01 0.618E+00
RMM: 62 -0.415034780398E+03 -0.13381E+00 -0.53750E-03 11828 0.687E-02 0.632E+00
RMM: 63 -0.415063333158E+03 -0.28553E-01 -0.39973E-03 11027 0.492E-02 0.650E+00
RMM: 64 -0.415042204053E+03 0.21129E-01 -0.18365E-02 13371 0.104E-01 0.585E+00
RMM: 65 -0.415129893957E+03 -0.87690E-01 -0.82351E-03 13790 0.941E-02 0.521E+00
RMM: 66 -0.415487728084E+03 -0.35783E+00 -0.79805E-02 17392 0.280E-01 0.354E+00
RMM: 67 -0.415652607166E+03 -0.16488E+00 -0.79754E-03 14077 0.104E-01 0.355E+00
RMM: 68 -0.415740456256E+03 -0.87849E-01 -0.39129E-02 14601 0.132E-01 0.532E+00
RMM: 69 -0.415522837333E+03 0.21762E+00 -0.28914E-02 14131 0.139E-01 0.469E+00
RMM: 70 -0.415563715608E+03 -0.40878E-01 -0.88097E-03 13066 0.773E-02 0.354E+00
RMM: 71 -0.416176049583E+03 -0.61233E+00 -0.48020E-02 16758 0.241E-01 0.344E+00
RMM: 72 -0.416245106565E+03 -0.69057E-01 -0.74300E-02 15051 0.181E-01 0.408E+00
RMM: 73 -0.415958758636E+03 0.28635E+00 -0.35346E-02 15425 0.177E-01 0.321E+00
RMM: 74 -0.416105730480E+03 -0.14697E+00 -0.14801E-02 14364 0.119E-01 0.468E+00
RMM: 75 -0.416068298057E+03 0.37432E-01 -0.37856E-02 14684 0.154E-01 0.404E+00
RMM: 76 -0.416281751958E+03 -0.21345E+00 -0.19820E+00 17806 0.806E-01 0.378E+00
RMM: 77 -0.416118527417E+03 0.16322E+00 -0.38943E-02 16425 0.191E-01 0.324E+00
RMM: 78 -0.416231583553E+03 -0.11306E+00 -0.26340E-02 14699 0.120E-01 0.238E+00
RMM: 79 -0.416398163794E+03 -0.16658E+00 -0.18898E-02 13665 0.928E-02 0.162E+00
RMM: 80 -0.416593054666E+03 -0.19489E+00 -0.20737E-02 13923 0.105E-01 0.953E-01
RMM: 81 -0.416711471583E+03 -0.11842E+00 -0.62963E-03 13244 0.733E-02 0.578E-01
RMM: 82 -0.416798155334E+03 -0.86684E-01 -0.72306E-03 12782 0.679E-02 0.272E-01
RMM: 83 -0.416885251644E+03 -0.87096E-01 -0.98354E-03 13585 0.793E-02 0.282E-01
RMM: 84 -0.416950932730E+03 -0.65681E-01 -0.37310E-03 12662 0.538E-02 0.296E-01
RMM: 85 -0.417002921726E+03 -0.51989E-01 -0.18005E-03 11883 0.357E-02 0.298E-01
RMM: 86 -0.417041598704E+03 -0.38677E-01 -0.19393E-03 11606 0.322E-02 0.227E-01
RMM: 87 -0.417071885614E+03 -0.30287E-01 -0.57713E-04 10864 0.197E-02 0.193E-01
RMM: 88 -0.417091858322E+03 -0.19973E-01 -0.33378E-04 10486 0.148E-02 0.184E-01
RMM: 89 -0.417105757473E+03 -0.13899E-01 -0.18569E-04 10053 0.112E-02 0.176E-01
RMM: 90 -0.417118816787E+03 -0.13059E-01 -0.91407E-05 9144 0.830E-03 0.159E-01
RMM: 91 -0.417127350488E+03 -0.85337E-02 -0.83403E-05 8887 0.728E-03 0.153E-01
RMM: 92 -0.417130596659E+03 -0.32462E-02 -0.28649E-05 7731 0.452E-03 0.151E-01
RMM: 93 -0.417133806875E+03 -0.32102E-02 -0.39808E-05 7592 0.480E-03 0.141E-01
RMM: 94 -0.417135124968E+03 -0.13181E-02 -0.31975E-05 7483 0.428E-03 0.136E-01
RMM: 95 -0.417135822453E+03 -0.69749E-03 -0.19297E-05 6780 0.331E-03 0.131E-01
RMM: 96 -0.417136093861E+03 -0.27141E-03 -0.10846E-05 6461 0.269E-03 0.125E-01
RMM: 97 -0.417136328805E+03 -0.23494E-03 -0.84695E-06 6366 0.245E-03 0.121E-01
RMM: 98 -0.417136393040E+03 -0.64235E-04 -0.87684E-06 6186 0.237E-03 0.116E-01
RMM: 99 -0.417136426946E+03 -0.33906E-04 -0.44070E-06 5404 0.184E-03 0.113E-01
RMM: 100 -0.417136433698E+03 -0.67523E-05 -0.51944E-06 5730 0.188E-03
1 F= -.45485237E+03 E0= -.45485250E+03 d E =0.394183E-03 mag= -0.0391