iterations/neb1_max1_image01_iter13_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421424401826E+04 0.42142E+04 -0.25380E+05 9008 0.103E+03
DAV: 2 -0.106048350267E+03 -0.43203E+04 -0.39222E+04 11000 0.248E+02
DAV: 3 -0.427403190975E+03 -0.32135E+03 -0.30038E+03 10288 0.655E+01
DAV: 4 -0.435852441922E+03 -0.84493E+01 -0.83541E+01 10840 0.106E+01
DAV: 5 -0.436133558468E+03 -0.28112E+00 -0.28045E+00 11176 0.189E+00 0.997E+01
RMM: 6 -0.386620926256E+03 0.49513E+02 -0.10937E+02 9708 0.144E+01 0.714E+01
RMM: 7 -0.691508220905E+03 -0.30489E+03 -0.31897E+02 10871 0.175E+01 0.132E+02
RMM: 8 -0.514640094762E+03 0.17687E+03 -0.11872E+02 10243 0.114E+01 0.923E+01
RMM: 9 -0.389937682562E+03 0.12470E+03 -0.68871E+01 10252 0.106E+01 0.451E+01
RMM: 10 -0.394650413816E+03 -0.47127E+01 -0.40456E+01 10176 0.819E+00 0.465E+01
RMM: 11 -0.393175783861E+03 0.14746E+01 -0.21640E+01 10239 0.590E+00 0.474E+01
RMM: 12 -0.377752691907E+03 0.15423E+02 -0.76387E+00 9940 0.378E+00 0.291E+01
RMM: 13 -0.374949763414E+03 0.28029E+01 -0.23957E+00 9988 0.208E+00 0.218E+01
RMM: 14 -0.375162817762E+03 -0.21305E+00 -0.12443E+00 10221 0.147E+00 0.142E+01
RMM: 15 -0.378386779783E+03 -0.32240E+01 -0.10295E+00 10433 0.131E+00 0.117E+01
RMM: 16 -0.384518895900E+03 -0.61321E+01 -0.13103E+00 10858 0.147E+00 0.168E+01
RMM: 17 -0.386952948200E+03 -0.24341E+01 -0.10201E+00 10718 0.127E+00 0.148E+01
RMM: 18 -0.389182477897E+03 -0.22295E+01 -0.81530E-01 10703 0.111E+00 0.110E+01
RMM: 19 -0.393722051772E+03 -0.45396E+01 -0.15077E+00 11583 0.138E+00 0.649E+00
RMM: 20 -0.397273994744E+03 -0.35519E+01 -0.83922E-01 11085 0.107E+00 0.602E+00
RMM: 21 -0.399402663148E+03 -0.21287E+01 -0.64021E-01 11129 0.883E-01 0.608E+00
RMM: 22 -0.401779818381E+03 -0.23772E+01 -0.64881E-01 11452 0.835E-01 0.666E+00
RMM: 23 -0.405276997377E+03 -0.34972E+01 -0.15172E+00 12439 0.114E+00 0.742E+00
RMM: 24 -0.408258870837E+03 -0.29819E+01 -0.17488E+00 12881 0.117E+00 0.720E+00
RMM: 25 -0.410627273770E+03 -0.23684E+01 -0.10211E+00 12162 0.887E-01 0.627E+00
RMM: 26 -0.411534177741E+03 -0.90690E+00 -0.57212E-02 10544 0.253E-01 0.609E+00
RMM: 27 -0.411763125727E+03 -0.22895E+00 -0.22077E-02 10612 0.134E-01 0.607E+00
RMM: 28 -0.412479744336E+03 -0.71662E+00 -0.67675E-02 11712 0.240E-01 0.582E+00
RMM: 29 -0.413488591939E+03 -0.10088E+01 -0.10292E-01 12260 0.304E-01 0.540E+00
RMM: 30 -0.414378279780E+03 -0.88969E+00 -0.17159E-01 13283 0.441E-01 0.446E+00
RMM: 31 -0.414795634917E+03 -0.41736E+00 -0.11256E-01 12929 0.393E-01 0.340E+00
RMM: 32 -0.415263611911E+03 -0.46798E+00 -0.53354E-02 11694 0.285E-01 0.333E+00
RMM: 33 -0.415612051341E+03 -0.34844E+00 -0.68113E-02 12017 0.320E-01 0.343E+00
RMM: 34 -0.415692306605E+03 -0.80255E-01 -0.38916E-02 11105 0.243E-01 0.310E+00
RMM: 35 -0.416153959722E+03 -0.46165E+00 -0.36000E-02 11094 0.215E-01 0.231E+00
RMM: 36 -0.416717538048E+03 -0.56358E+00 -0.23208E-02 10824 0.175E-01 0.190E+00
RMM: 37 -0.416916321324E+03 -0.19878E+00 -0.10340E-02 10436 0.116E-01 0.171E+00
RMM: 38 -0.417007448771E+03 -0.91127E-01 -0.90240E-03 10694 0.107E-01 0.159E+00
RMM: 39 -0.417033778776E+03 -0.26330E-01 -0.68356E-03 10842 0.894E-02 0.147E+00
RMM: 40 -0.417072190228E+03 -0.38411E-01 -0.78741E-03 11319 0.959E-02 0.112E+00
RMM: 41 -0.417203675514E+03 -0.13149E+00 -0.67773E-03 11354 0.842E-02 0.865E-01
RMM: 42 -0.417307102058E+03 -0.10343E+00 -0.36492E-03 10874 0.633E-02 0.676E-01
RMM: 43 -0.417396838903E+03 -0.89737E-01 -0.53740E-03 11625 0.730E-02 0.524E-01
RMM: 44 -0.417453563269E+03 -0.56724E-01 -0.55450E-03 11812 0.723E-02 0.373E-01
RMM: 45 -0.417510958813E+03 -0.57396E-01 -0.36892E-03 11345 0.604E-02 0.325E-01
RMM: 46 -0.417559933720E+03 -0.48975E-01 -0.64090E-03 12078 0.706E-02 0.411E-01
RMM: 47 -0.417666305606E+03 -0.10637E+00 -0.34493E-03 11452 0.517E-02 0.421E-01
RMM: 48 -0.417737522647E+03 -0.71217E-01 -0.25355E-03 11273 0.428E-02 0.314E-01
RMM: 49 -0.417758171404E+03 -0.20649E-01 -0.15195E-03 11160 0.354E-02 0.259E-01
RMM: 50 -0.417772183374E+03 -0.14012E-01 -0.88631E-04 10922 0.263E-02 0.192E-01
RMM: 51 -0.417754216989E+03 0.17966E-01 -0.13794E-03 11828 0.339E-02 0.117E-01
RMM: 52 -0.417775856108E+03 -0.21639E-01 -0.62965E-04 11118 0.240E-02 0.903E-02
RMM: 53 -0.417802511492E+03 -0.26655E-01 -0.33216E-04 10670 0.161E-02 0.800E-02
RMM: 54 -0.417825819742E+03 -0.23308E-01 -0.16377E-04 9831 0.120E-02 0.708E-02
RMM: 55 -0.417843806756E+03 -0.17987E-01 -0.24222E-04 10497 0.124E-02 0.529E-02
RMM: 56 -0.417844148096E+03 -0.34134E-03 -0.32288E-05 7945 0.653E-03 0.392E-02
RMM: 57 -0.417847047409E+03 -0.28993E-02 -0.67297E-05 8749 0.756E-03 0.257E-02
RMM: 58 -0.417848277437E+03 -0.12300E-02 -0.34386E-05 7808 0.510E-03 0.184E-02
RMM: 59 -0.417848713672E+03 -0.43624E-03 -0.17410E-05 7033 0.381E-03 0.148E-02
RMM: 60 -0.417848741096E+03 -0.27424E-04 -0.78697E-06 6574 0.271E-03 0.923E-03
RMM: 61 -0.417848904197E+03 -0.16310E-03 -0.43512E-06 6402 0.197E-03 0.572E-03
RMM: 62 -0.417849332183E+03 -0.42799E-03 -0.49541E-06 5357 0.170E-03 0.864E-03
RMM: 63 -0.417849482897E+03 -0.15071E-03 -0.18713E-06 4068 0.124E-03 0.573E-03
RMM: 64 -0.417849607346E+03 -0.12445E-03 -0.20227E-06 4323 0.124E-03 0.351E-03
RMM: 65 -0.417849649119E+03 -0.41773E-04 -0.91509E-07 3554 0.103E-03 0.279E-03
RMM: 66 -0.417849663743E+03 -0.14624E-04 -0.44693E-07 3014 0.949E-04 0.178E-03
RMM: 67 -0.417849722227E+03 -0.58484E-04 -0.55241E-07 3325 0.969E-04 0.122E-03
RMM: 68 -0.417849752081E+03 -0.29854E-04 -0.48432E-07 3304 0.972E-04 0.599E-03
RMM: 69 -0.417849766933E+03 -0.14852E-04 -0.44720E-08 2263 0.800E-04 0.307E-03
RMM: 70 -0.417849776277E+03 -0.93439E-05 -0.38062E-08 2243 0.793E-04
1 F= -.45547571E+03 E0= -.45547609E+03 d E =0.112684E-02 mag= 0.0002