iterations/neb2_max1_image04_iter2_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421959932714E+04 0.42196E+04 -0.25384E+05 9008 0.103E+03
DAV: 2 -0.105503027932E+03 -0.43251E+04 -0.39264E+04 11008 0.248E+02
DAV: 3 -0.426883058213E+03 -0.32138E+03 -0.30083E+03 10264 0.656E+01
DAV: 4 -0.435400929645E+03 -0.85179E+01 -0.84162E+01 10920 0.107E+01
DAV: 5 -0.435677669581E+03 -0.27674E+00 -0.27609E+00 11176 0.187E+00 0.101E+02
RMM: 6 -0.387722989679E+03 0.47955E+02 -0.10892E+02 9703 0.144E+01 0.721E+01
RMM: 7 -0.771391019557E+03 -0.38367E+03 -0.42064E+02 11277 0.190E+01 0.144E+02
RMM: 8 -0.500724374270E+03 0.27067E+03 -0.11740E+02 10096 0.114E+01 0.918E+01
RMM: 9 -0.404279047902E+03 0.96445E+02 -0.69559E+01 10194 0.108E+01 0.526E+01
RMM: 10 -0.399101647153E+03 0.51774E+01 -0.44106E+01 10307 0.863E+00 0.475E+01
RMM: 11 -0.388741638435E+03 0.10360E+02 -0.24298E+01 10255 0.600E+00 0.458E+01
RMM: 12 -0.375170926043E+03 0.13571E+02 -0.77938E+00 9955 0.375E+00 0.279E+01
RMM: 13 -0.375281695385E+03 -0.11077E+00 -0.31243E+00 10137 0.238E+00 0.236E+01
RMM: 14 -0.374328852052E+03 0.95284E+00 -0.12354E+00 10105 0.149E+00 0.154E+01
RMM: 15 -0.377526980099E+03 -0.31981E+01 -0.12606E+00 10457 0.146E+00 0.122E+01
RMM: 16 -0.383220634550E+03 -0.56937E+01 -0.13052E+00 10601 0.150E+00 0.145E+01
RMM: 17 -0.387035659343E+03 -0.38150E+01 -0.15830E+00 10941 0.153E+00 0.102E+01
RMM: 18 -0.390343965678E+03 -0.33083E+01 -0.78572E-01 10523 0.108E+00 0.720E+00
RMM: 19 -0.394282643766E+03 -0.39387E+01 -0.76786E-01 10918 0.102E+00 0.681E+00
RMM: 20 -0.397396880807E+03 -0.31142E+01 -0.88311E-01 11397 0.107E+00 0.732E+00
RMM: 21 -0.400465661824E+03 -0.30688E+01 -0.11665E+00 11855 0.111E+00 0.694E+00
RMM: 22 -0.402951002435E+03 -0.24853E+01 -0.71586E-01 11558 0.854E-01 0.644E+00
RMM: 23 -0.407280065269E+03 -0.43291E+01 -0.19425E+00 12856 0.124E+00 0.661E+00
RMM: 24 -0.409282231038E+03 -0.20022E+01 -0.63708E-01 11840 0.727E-01 0.685E+00
RMM: 25 -0.409732372432E+03 -0.45014E+00 -0.12223E-01 10810 0.330E-01 0.630E+00
RMM: 26 -0.410131146423E+03 -0.39877E+00 -0.31494E-02 10634 0.164E-01 0.619E+00
RMM: 27 -0.410288469990E+03 -0.15732E+00 -0.85823E-03 10830 0.787E-02 0.615E+00
RMM: 28 -0.409934159363E+03 0.35431E+00 -0.27167E-02 11452 0.183E-01 0.534E+00
RMM: 29 -0.409305084688E+03 0.62907E+00 -0.25115E-01 14916 0.545E-01 0.451E+00
RMM: 30 -0.409745169598E+03 -0.44008E+00 -0.16170E-01 14919 0.482E-01 0.563E+00
RMM: 31 -0.409325331682E+03 0.41984E+00 -0.17723E-02 11071 0.174E-01 0.607E+00
RMM: 32 -0.411828310862E+03 -0.25030E+01 -0.10811E+00 16804 0.109E+00 0.636E+00
RMM: 33 -0.413253672514E+03 -0.14254E+01 -0.46079E-01 16286 0.661E-01 0.585E+00
RMM: 34 -0.415140055743E+03 -0.18864E+01 -0.54012E-01 16352 0.716E-01 0.595E+00
RMM: 35 -0.414973042686E+03 0.16701E+00 -0.55817E-02 13266 0.278E-01 0.478E+00
RMM: 36 -0.415372901270E+03 -0.39986E+00 -0.28475E-02 11930 0.222E-01 0.382E+00
RMM: 37 -0.415983960565E+03 -0.61106E+00 -0.55031E-02 12971 0.290E-01 0.394E+00
RMM: 38 -0.416070559486E+03 -0.86599E-01 -0.35741E-02 12306 0.228E-01 0.346E+00
RMM: 39 -0.416153096223E+03 -0.82537E-01 -0.19938E-02 11440 0.166E-01 0.231E+00
RMM: 40 -0.416566275009E+03 -0.41318E+00 -0.16105E-02 11216 0.147E-01 0.162E+00
RMM: 41 -0.416773650609E+03 -0.20738E+00 -0.40176E-03 10398 0.756E-02 0.162E+00
RMM: 42 -0.416815612019E+03 -0.41961E-01 -0.39725E-03 10672 0.708E-02 0.168E+00
RMM: 43 -0.416870640552E+03 -0.55029E-01 -0.96714E-03 11969 0.101E-01 0.141E+00
RMM: 44 -0.416989635499E+03 -0.11899E+00 -0.98423E-03 12182 0.101E-01 0.101E+00
RMM: 45 -0.417183791494E+03 -0.19416E+00 -0.14496E-02 12828 0.120E-01 0.812E-01
RMM: 46 -0.417268352378E+03 -0.84561E-01 -0.11679E-02 12380 0.103E-01 0.714E-01
RMM: 47 -0.417355758628E+03 -0.87406E-01 -0.89750E-03 11815 0.973E-02 0.485E-01
RMM: 48 -0.417407507365E+03 -0.51749E-01 -0.40484E-03 11084 0.632E-02 0.411E-01
RMM: 49 -0.417432233757E+03 -0.24726E-01 -0.24860E-03 10959 0.476E-02 0.357E-01
RMM: 50 -0.417518471666E+03 -0.86238E-01 -0.49026E-03 11843 0.632E-02 0.364E-01
RMM: 51 -0.417526465240E+03 -0.79936E-02 -0.30190E-03 11580 0.559E-02 0.337E-01
RMM: 52 -0.417580417657E+03 -0.53952E-01 -0.18969E-03 11064 0.473E-02 0.166E-01
RMM: 53 -0.417606993432E+03 -0.26576E-01 -0.12188E-03 10992 0.342E-02 0.120E-01
RMM: 54 -0.417638937013E+03 -0.31944E-01 -0.72479E-04 10857 0.259E-02 0.139E-01
RMM: 55 -0.417679963631E+03 -0.41027E-01 -0.57513E-04 10999 0.210E-02 0.163E-01
RMM: 56 -0.417704345649E+03 -0.24382E-01 -0.25808E-04 10707 0.152E-02 0.108E-01
RMM: 57 -0.417732719215E+03 -0.28374E-01 -0.23926E-04 10717 0.133E-02 0.810E-02
RMM: 58 -0.417747059796E+03 -0.14341E-01 -0.14030E-04 9803 0.103E-02 0.711E-02
RMM: 59 -0.417753334383E+03 -0.62746E-02 -0.16575E-04 10905 0.119E-02 0.374E-02
RMM: 60 -0.417755108740E+03 -0.17744E-02 -0.69824E-05 9131 0.821E-03 0.305E-02
RMM: 61 -0.417755845358E+03 -0.73662E-03 -0.21911E-05 7327 0.463E-03 0.212E-02
RMM: 62 -0.417756486970E+03 -0.64161E-03 -0.16378E-05 6948 0.407E-03 0.138E-02
RMM: 63 -0.417756771703E+03 -0.28473E-03 -0.70185E-06 6516 0.239E-03 0.906E-03
RMM: 64 -0.417757070696E+03 -0.29899E-03 -0.50585E-06 5934 0.190E-03 0.109E-02
RMM: 65 -0.417757400875E+03 -0.33018E-03 -0.38267E-06 5049 0.159E-03 0.116E-02
RMM: 66 -0.417757554244E+03 -0.15337E-03 -0.17865E-06 4568 0.129E-03 0.968E-03
RMM: 67 -0.417757577932E+03 -0.23688E-04 -0.79228E-07 3461 0.108E-03 0.602E-03
RMM: 68 -0.417757668236E+03 -0.90304E-04 -0.94567E-07 3836 0.111E-03 0.302E-03
RMM: 69 -0.417757727887E+03 -0.59651E-04 -0.67451E-07 3397 0.100E-03 0.302E-03
RMM: 70 -0.417757788810E+03 -0.60923E-04 -0.45559E-07 3059 0.946E-04 0.179E-03
RMM: 71 -0.417757819129E+03 -0.30319E-04 -0.32730E-07 2957 0.918E-04 0.100E-03
RMM: 72 -0.417757837327E+03 -0.18198E-04 -0.20785E-07 2708 0.878E-04 0.990E-04
RMM: 73 -0.417757853454E+03 -0.16127E-04 -0.11775E-07 2456 0.847E-04 0.671E-04
RMM: 74 -0.417757863243E+03 -0.97899E-05 -0.17179E-07 2599 0.875E-04
1 F= -.45539980E+03 E0= -.45540031E+03 d E =0.153721E-02 mag= -0.0005