iterations/neb2_max1_image03_iter2_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422176091740E+04 0.42218E+04 -0.25386E+05 9008 0.103E+03
DAV: 2 -0.104980990650E+03 -0.43267E+04 -0.39281E+04 11008 0.248E+02
DAV: 3 -0.426608138739E+03 -0.32163E+03 -0.30118E+03 10296 0.656E+01
DAV: 4 -0.435115595461E+03 -0.85075E+01 -0.83673E+01 10888 0.107E+01
DAV: 5 -0.435395739910E+03 -0.28014E+00 -0.27949E+00 11304 0.188E+00 0.102E+02
RMM: 6 -0.388251753403E+03 0.47144E+02 -0.10827E+02 9691 0.143E+01 0.726E+01
RMM: 7 -0.803338348082E+03 -0.41509E+03 -0.45654E+02 11397 0.195E+01 0.148E+02
RMM: 8 -0.500064933756E+03 0.30327E+03 -0.11752E+02 10037 0.114E+01 0.920E+01
RMM: 9 -0.411877936841E+03 0.88187E+02 -0.69471E+01 10172 0.108E+01 0.554E+01
RMM: 10 -0.397016322422E+03 0.14862E+02 -0.43935E+01 10335 0.865E+00 0.455E+01
RMM: 11 -0.387876703090E+03 0.91396E+01 -0.24071E+01 10281 0.587E+00 0.455E+01
RMM: 12 -0.374521419472E+03 0.13355E+02 -0.75327E+00 9961 0.371E+00 0.279E+01
RMM: 13 -0.375138851902E+03 -0.61743E+00 -0.34522E+00 10161 0.249E+00 0.234E+01
RMM: 14 -0.374213427794E+03 0.92542E+00 -0.13650E+00 10121 0.155E+00 0.151E+01
RMM: 15 -0.377856288417E+03 -0.36429E+01 -0.13779E+00 10450 0.151E+00 0.128E+01
RMM: 16 -0.383126518706E+03 -0.52702E+01 -0.13293E+00 10525 0.151E+00 0.140E+01
RMM: 17 -0.387637395791E+03 -0.45109E+01 -0.19305E+00 11111 0.167E+00 0.994E+00
RMM: 18 -0.390430195745E+03 -0.27928E+01 -0.66161E-01 10357 0.101E+00 0.667E+00
RMM: 19 -0.393877781778E+03 -0.34476E+01 -0.58705E-01 10738 0.907E-01 0.666E+00
RMM: 20 -0.396666501790E+03 -0.27887E+01 -0.70068E-01 11292 0.976E-01 0.705E+00
RMM: 21 -0.399691364673E+03 -0.30249E+01 -0.97572E-01 11795 0.105E+00 0.660E+00
RMM: 22 -0.402737917752E+03 -0.30466E+01 -0.92339E-01 11966 0.969E-01 0.558E+00
RMM: 23 -0.407375735136E+03 -0.46378E+01 -0.20304E+00 12937 0.128E+00 0.633E+00
RMM: 24 -0.409584505409E+03 -0.22088E+01 -0.80972E-01 12072 0.811E-01 0.712E+00
RMM: 25 -0.409753616971E+03 -0.16911E+00 -0.10372E-01 10712 0.312E-01 0.654E+00
RMM: 26 -0.409889318516E+03 -0.13570E+00 -0.15024E-02 11054 0.110E-01 0.637E+00
RMM: 27 -0.409776547963E+03 0.11277E+00 -0.56630E-03 10228 0.870E-02 0.577E+00
RMM: 28 -0.409785890246E+03 -0.93423E-02 -0.22384E-02 11520 0.161E-01 0.534E+00
RMM: 29 -0.408458907420E+03 0.13270E+01 -0.41470E-01 16155 0.670E-01 0.436E+00
RMM: 30 -0.408391491492E+03 0.67416E-01 -0.22954E-01 15780 0.571E-01 0.640E+00
RMM: 31 -0.410043290311E+03 -0.16518E+01 -0.29025E-01 15305 0.600E-01 0.546E+00
RMM: 32 -0.412467057212E+03 -0.24238E+01 -0.16926E+00 17294 0.118E+00 0.642E+00
RMM: 33 -0.413997956772E+03 -0.15309E+01 -0.51439E-01 16453 0.690E-01 0.547E+00
RMM: 34 -0.414608211310E+03 -0.61025E+00 -0.17940E-01 15290 0.435E-01 0.441E+00
RMM: 35 -0.414908192782E+03 -0.29998E+00 -0.23565E-02 11985 0.191E-01 0.360E+00
RMM: 36 -0.415422146883E+03 -0.51395E+00 -0.33470E-02 12250 0.233E-01 0.348E+00
RMM: 37 -0.415974476159E+03 -0.55233E+00 -0.76446E-02 14246 0.326E-01 0.336E+00
RMM: 38 -0.416034894997E+03 -0.60419E-01 -0.46142E-02 13124 0.255E-01 0.264E+00
RMM: 39 -0.416293689700E+03 -0.25879E+00 -0.18689E-02 11613 0.162E-01 0.224E+00
RMM: 40 -0.416487611523E+03 -0.19392E+00 -0.81872E-03 10710 0.109E-01 0.184E+00
RMM: 41 -0.416606415783E+03 -0.11880E+00 -0.54833E-03 10621 0.840E-02 0.165E+00
RMM: 42 -0.416694356301E+03 -0.87941E-01 -0.58290E-03 11091 0.812E-02 0.138E+00
RMM: 43 -0.416834071121E+03 -0.13971E+00 -0.62133E-03 11397 0.821E-02 0.127E+00
RMM: 44 -0.416957058797E+03 -0.12299E+00 -0.10188E-02 12208 0.102E-01 0.108E+00
RMM: 45 -0.417051036508E+03 -0.93978E-01 -0.83693E-03 11988 0.905E-02 0.973E-01
RMM: 46 -0.417154969297E+03 -0.10393E+00 -0.79727E-03 11898 0.845E-02 0.770E-01
RMM: 47 -0.417264856035E+03 -0.10989E+00 -0.11109E-02 12465 0.982E-02 0.505E-01
RMM: 48 -0.417308240561E+03 -0.43385E-01 -0.47172E-03 11445 0.655E-02 0.362E-01
RMM: 49 -0.417340952072E+03 -0.32712E-01 -0.16155E-03 10750 0.410E-02 0.323E-01
RMM: 50 -0.417401430400E+03 -0.60478E-01 -0.28553E-03 11434 0.515E-02 0.328E-01
RMM: 51 -0.417420853685E+03 -0.19423E-01 -0.21581E-03 11451 0.451E-02 0.288E-01
RMM: 52 -0.417458125389E+03 -0.37272E-01 -0.11270E-03 10961 0.359E-02 0.180E-01
RMM: 53 -0.417487401234E+03 -0.29276E-01 -0.13744E-03 11389 0.346E-02 0.128E-01
RMM: 54 -0.417510040109E+03 -0.22639E-01 -0.41201E-04 10628 0.200E-02 0.105E-01
RMM: 55 -0.417552885702E+03 -0.42846E-01 -0.64661E-04 11262 0.216E-02 0.127E-01
RMM: 56 -0.417588602403E+03 -0.35717E-01 -0.41948E-04 11183 0.187E-02 0.131E-01
RMM: 57 -0.417604337102E+03 -0.15735E-01 -0.21685E-04 10978 0.143E-02 0.979E-02
RMM: 58 -0.417619027816E+03 -0.14691E-01 -0.24992E-04 10655 0.127E-02 0.532E-02
RMM: 59 -0.417622167065E+03 -0.31392E-02 -0.85611E-05 9393 0.872E-03 0.406E-02
RMM: 60 -0.417623154802E+03 -0.98774E-03 -0.52176E-05 8595 0.744E-03 0.320E-02
RMM: 61 -0.417623384996E+03 -0.23019E-03 -0.24526E-05 7503 0.509E-03 0.325E-02
RMM: 62 -0.417623803694E+03 -0.41870E-03 -0.13930E-05 6874 0.378E-03 0.180E-02
RMM: 63 -0.417624837434E+03 -0.10337E-02 -0.22539E-05 7271 0.372E-03 0.120E-02
RMM: 64 -0.417625577480E+03 -0.74005E-03 -0.11309E-05 6865 0.268E-03 0.978E-03
RMM: 65 -0.417625982956E+03 -0.40548E-03 -0.43236E-06 6122 0.183E-03 0.727E-03
RMM: 66 -0.417626268326E+03 -0.28537E-03 -0.27081E-06 4660 0.144E-03 0.429E-03
RMM: 67 -0.417626526986E+03 -0.25866E-03 -0.27180E-06 4327 0.132E-03 0.375E-03
RMM: 68 -0.417626619578E+03 -0.92592E-04 -0.12153E-06 3771 0.113E-03 0.334E-03
RMM: 69 -0.417626657937E+03 -0.38359E-04 -0.36182E-07 2893 0.922E-04 0.165E-03
RMM: 70 -0.417626687299E+03 -0.29362E-04 -0.31416E-07 2945 0.910E-04 0.184E-03
RMM: 71 -0.417626699163E+03 -0.11864E-04 -0.38403E-07 3062 0.924E-04 0.157E-03
RMM: 72 -0.417626702142E+03 -0.29792E-05 -0.23428E-07 2768 0.867E-04
1 F= -.45527767E+03 E0= -.45527827E+03 d E =0.178532E-02 mag= -0.0005