iterations/neb3_max1_image03_iter28_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421800998600E+04 0.42180E+04 -0.25383E+05 9008 0.103E+03
DAV: 2 -0.105544272065E+03 -0.43236E+04 -0.39288E+04 11024 0.248E+02
DAV: 3 -0.426981361190E+03 -0.32144E+03 -0.30077E+03 10240 0.655E+01
DAV: 4 -0.435509737905E+03 -0.85284E+01 -0.84280E+01 10784 0.107E+01
DAV: 5 -0.435796547758E+03 -0.28681E+00 -0.28618E+00 11264 0.191E+00 0.100E+02
RMM: 6 -0.387930213432E+03 0.47866E+02 -0.10824E+02 9695 0.143E+01 0.722E+01
RMM: 7 -0.773679022329E+03 -0.38575E+03 -0.41716E+02 11266 0.189E+01 0.145E+02
RMM: 8 -0.497496786010E+03 0.27618E+03 -0.11559E+02 10079 0.113E+01 0.912E+01
RMM: 9 -0.405660174170E+03 0.91837E+02 -0.68688E+01 10179 0.107E+01 0.533E+01
RMM: 10 -0.397852157939E+03 0.78080E+01 -0.43451E+01 10318 0.857E+00 0.460E+01
RMM: 11 -0.389982079033E+03 0.78701E+01 -0.24393E+01 10266 0.599E+00 0.459E+01
RMM: 12 -0.375233079823E+03 0.14749E+02 -0.77084E+00 9948 0.373E+00 0.278E+01
RMM: 13 -0.375297274415E+03 -0.64195E-01 -0.31502E+00 10147 0.239E+00 0.235E+01
RMM: 14 -0.374390700359E+03 0.90657E+00 -0.12869E+00 10109 0.151E+00 0.153E+01
RMM: 15 -0.377748754888E+03 -0.33581E+01 -0.13095E+00 10456 0.149E+00 0.124E+01
RMM: 16 -0.383422284845E+03 -0.56735E+01 -0.13645E+00 10633 0.153E+00 0.143E+01
RMM: 17 -0.387131637764E+03 -0.37094E+01 -0.15310E+00 10900 0.151E+00 0.976E+00
RMM: 18 -0.390389539363E+03 -0.32579E+01 -0.69106E-01 10416 0.102E+00 0.691E+00
RMM: 19 -0.394237097983E+03 -0.38476E+01 -0.75279E-01 10941 0.101E+00 0.668E+00
RMM: 20 -0.397557542118E+03 -0.33204E+01 -0.99347E-01 11505 0.112E+00 0.730E+00
RMM: 21 -0.400319025128E+03 -0.27615E+01 -0.98372E-01 11723 0.104E+00 0.688E+00
RMM: 22 -0.402963093374E+03 -0.26441E+01 -0.78275E-01 11707 0.888E-01 0.610E+00
RMM: 23 -0.407383372761E+03 -0.44203E+01 -0.19292E+00 12858 0.124E+00 0.652E+00
RMM: 24 -0.409384533984E+03 -0.20012E+01 -0.64321E-01 11839 0.727E-01 0.691E+00
RMM: 25 -0.409609770629E+03 -0.22524E+00 -0.81348E-02 10626 0.278E-01 0.640E+00
RMM: 26 -0.409929847785E+03 -0.32008E+00 -0.24950E-02 10698 0.141E-01 0.630E+00
RMM: 27 -0.409887897579E+03 0.41950E-01 -0.38726E-03 10420 0.675E-02 0.613E+00
RMM: 28 -0.409718614711E+03 0.16928E+00 -0.11757E-02 10840 0.117E-01 0.607E+00
RMM: 29 -0.409351658759E+03 0.36696E+00 -0.14057E-01 15404 0.429E-01 0.780E+00
RMM: 30 -0.408202533845E+03 0.11491E+01 -0.25917E-01 16439 0.623E-01 0.811E+00
RMM: 31 -0.409108123480E+03 -0.90559E+00 -0.36633E-02 12834 0.246E-01 0.827E+00
RMM: 32 -0.411506575408E+03 -0.23985E+01 -0.10978E+00 17474 0.107E+00 0.807E+00
RMM: 33 -0.413500623005E+03 -0.19940E+01 -0.60441E-01 17282 0.766E-01 0.479E+00
RMM: 34 -0.415420728090E+03 -0.19201E+01 -0.27955E-01 16289 0.543E-01 0.425E+00
RMM: 35 -0.415474373225E+03 -0.53645E-01 -0.14264E-02 11611 0.167E-01 0.368E+00
RMM: 36 -0.416095717774E+03 -0.62134E+00 -0.12461E-01 15304 0.436E-01 0.309E+00
RMM: 37 -0.416367509488E+03 -0.27179E+00 -0.62680E-02 14426 0.287E-01 0.260E+00
RMM: 38 -0.416511506891E+03 -0.14400E+00 -0.26108E-02 12773 0.197E-01 0.284E+00
RMM: 39 -0.416533959719E+03 -0.22453E-01 -0.14647E-02 11906 0.147E-01 0.247E+00
RMM: 40 -0.416644369788E+03 -0.11041E+00 -0.89916E-03 11121 0.115E-01 0.209E+00
RMM: 41 -0.416742579689E+03 -0.98210E-01 -0.94006E-03 11272 0.109E-01 0.168E+00
RMM: 42 -0.416861301562E+03 -0.11872E+00 -0.92157E-03 11521 0.101E-01 0.127E+00
RMM: 43 -0.417003074181E+03 -0.14177E+00 -0.38402E-03 10733 0.679E-02 0.106E+00
RMM: 44 -0.417123832822E+03 -0.12076E+00 -0.46258E-03 11087 0.723E-02 0.856E-01
RMM: 45 -0.417244592555E+03 -0.12076E+00 -0.74428E-03 11916 0.884E-02 0.640E-01
RMM: 46 -0.417306127009E+03 -0.61534E-01 -0.47815E-03 11403 0.714E-02 0.493E-01
RMM: 47 -0.417339843058E+03 -0.33716E-01 -0.73112E-03 12067 0.815E-02 0.366E-01
RMM: 48 -0.417389581794E+03 -0.49739E-01 -0.11113E-02 12618 0.938E-02 0.312E-01
RMM: 49 -0.417461181901E+03 -0.71600E-01 -0.41019E-03 11371 0.588E-02 0.277E-01
RMM: 50 -0.417560740535E+03 -0.99559E-01 -0.55723E-03 11778 0.616E-02 0.257E-01
RMM: 51 -0.417591093641E+03 -0.30353E-01 -0.26996E-03 11432 0.505E-02 0.217E-01
RMM: 52 -0.417621749747E+03 -0.30656E-01 -0.18181E-03 11195 0.388E-02 0.142E-01
RMM: 53 -0.417637408289E+03 -0.15659E-01 -0.55031E-04 10674 0.234E-02 0.133E-01
RMM: 54 -0.417667236215E+03 -0.29828E-01 -0.50206E-04 10949 0.225E-02 0.150E-01
RMM: 55 -0.417708234578E+03 -0.40998E-01 -0.41409E-04 11055 0.180E-02 0.146E-01
RMM: 56 -0.417701578274E+03 0.66563E-02 -0.17783E-04 10457 0.165E-02 0.107E-01
RMM: 57 -0.417737549029E+03 -0.35971E-01 -0.26761E-04 11307 0.154E-02 0.800E-02
RMM: 58 -0.417757785679E+03 -0.20237E-01 -0.18843E-04 10248 0.119E-02 0.353E-02
RMM: 59 -0.417763432939E+03 -0.56473E-02 -0.97689E-05 9432 0.902E-03 0.322E-02
RMM: 60 -0.417765807470E+03 -0.23745E-02 -0.56736E-05 8451 0.685E-03 0.244E-02
RMM: 61 -0.417767092655E+03 -0.12852E-02 -0.26213E-05 7502 0.468E-03 0.166E-02
RMM: 62 -0.417767963010E+03 -0.87036E-03 -0.15744E-05 6974 0.359E-03 0.914E-03
RMM: 63 -0.417768416887E+03 -0.45388E-03 -0.11540E-05 6765 0.259E-03 0.906E-03
RMM: 64 -0.417768654542E+03 -0.23765E-03 -0.30930E-06 4922 0.156E-03 0.686E-03
RMM: 65 -0.417768836587E+03 -0.18205E-03 -0.16110E-06 4241 0.129E-03 0.638E-03
RMM: 66 -0.417768935848E+03 -0.99261E-04 -0.13627E-06 3896 0.116E-03 0.529E-03
RMM: 67 -0.417768973282E+03 -0.37434E-04 -0.11068E-06 3835 0.114E-03 0.423E-03
RMM: 68 -0.417769022049E+03 -0.48767E-04 -0.33079E-07 2902 0.937E-04 0.325E-03
RMM: 69 -0.417769058384E+03 -0.36336E-04 -0.45616E-07 3192 0.980E-04 0.191E-03
RMM: 70 -0.417769077691E+03 -0.19306E-04 -0.31864E-07 2971 0.925E-04 0.167E-03
RMM: 71 -0.417769077213E+03 0.47765E-06 -0.20713E-07 2680 0.872E-04
1 F= -.45541697E+03 E0= -.45541756E+03 d E =0.175452E-02 mag= -0.0003