iterations/neb2_max2_image05_iter3_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422725116450E+04 0.42273E+04 -0.25386E+05 8992 0.103E+03
DAV: 2 -0.103614408563E+03 -0.43309E+04 -0.39284E+04 11016 0.248E+02
DAV: 3 -0.426348332317E+03 -0.32273E+03 -0.30228E+03 10240 0.657E+01
DAV: 4 -0.434852173975E+03 -0.85038E+01 -0.84003E+01 10840 0.107E+01
DAV: 5 -0.435153005805E+03 -0.30083E+00 -0.29993E+00 11272 0.196E+00 0.991E+01
RMM: 6 -0.377812366190E+03 0.57341E+02 -0.11497E+02 9680 0.146E+01 0.680E+01
RMM: 7 -0.527403369724E+03 -0.14959E+03 -0.18426E+02 10093 0.156E+01 0.954E+01
RMM: 8 -0.456133535465E+03 0.71270E+02 -0.85268E+01 10157 0.114E+01 0.696E+01
RMM: 9 -0.441411260884E+03 0.14722E+02 -0.42321E+01 10169 0.750E+00 0.649E+01
RMM: 10 -0.396696697125E+03 0.44715E+02 -0.43578E+01 10411 0.798E+00 0.442E+01
RMM: 11 -0.377704313668E+03 0.18992E+02 -0.77808E+00 9625 0.402E+00 0.279E+01
RMM: 12 -0.374949709542E+03 0.27546E+01 -0.51646E+00 10153 0.296E+00 0.218E+01
RMM: 13 -0.374659760525E+03 0.28995E+00 -0.24035E+00 10199 0.195E+00 0.137E+01
RMM: 14 -0.377214269059E+03 -0.25545E+01 -0.11273E+00 10200 0.129E+00 0.118E+01
RMM: 15 -0.381578871106E+03 -0.43646E+01 -0.99155E-01 10402 0.126E+00 0.113E+01
RMM: 16 -0.387809433570E+03 -0.62306E+01 -0.26100E+00 11619 0.188E+00 0.101E+01
RMM: 17 -0.392940296937E+03 -0.51309E+01 -0.15398E+00 11243 0.146E+00 0.879E+00
RMM: 18 -0.394091446735E+03 -0.11511E+01 -0.38797E-01 10265 0.800E-01 0.742E+00
RMM: 19 -0.396961473736E+03 -0.28700E+01 -0.72732E-01 11279 0.928E-01 0.664E+00
RMM: 20 -0.399055744808E+03 -0.20943E+01 -0.41095E-01 11065 0.693E-01 0.596E+00
RMM: 21 -0.399752903222E+03 -0.69716E+00 -0.72059E-02 10445 0.297E-01 0.573E+00
RMM: 22 -0.401826074229E+03 -0.20732E+01 -0.46128E-01 12111 0.692E-01 0.553E+00
RMM: 23 -0.405447033891E+03 -0.36210E+01 -0.14031E+00 13833 0.117E+00 0.533E+00
RMM: 24 -0.409183189311E+03 -0.37362E+01 -0.14233E+00 14155 0.112E+00 0.614E+00
RMM: 25 -0.411270973256E+03 -0.20878E+01 -0.90967E-01 13544 0.874E-01 0.581E+00
RMM: 26 -0.412139066150E+03 -0.86809E+00 -0.74472E-02 10719 0.287E-01 0.587E+00
RMM: 27 -0.411990623884E+03 0.14844E+00 -0.32648E-02 10293 0.211E-01 0.544E+00
RMM: 28 -0.411619757558E+03 0.37087E+00 -0.83796E-02 11365 0.348E-01 0.501E+00
RMM: 29 -0.411568583467E+03 0.51174E-01 -0.49662E-02 10762 0.284E-01 0.489E+00
RMM: 30 -0.411335893982E+03 0.23269E+00 -0.16275E-01 12763 0.494E-01 0.615E+00
RMM: 31 -0.411601495342E+03 -0.26560E+00 -0.77196E-03 10054 0.125E-01 0.583E+00
RMM: 32 -0.412708848210E+03 -0.11074E+01 -0.78348E-01 16217 0.968E-01 0.528E+00
RMM: 33 -0.412809589960E+03 -0.10074E+00 -0.30798E-01 15543 0.606E-01 0.495E+00
RMM: 34 -0.413734305544E+03 -0.92472E+00 -0.12230E-01 14023 0.396E-01 0.286E+00
RMM: 35 -0.413986031311E+03 -0.25173E+00 -0.24065E-03 10394 0.673E-02 0.274E+00
RMM: 36 -0.414215879563E+03 -0.22985E+00 -0.73097E-03 11118 0.116E-01 0.273E+00
RMM: 37 -0.414845007773E+03 -0.62913E+00 -0.42492E-02 14347 0.274E-01 0.160E+00
RMM: 38 -0.415367344433E+03 -0.52234E+00 -0.29962E-02 13662 0.207E-01 0.987E-01
RMM: 39 -0.415877296737E+03 -0.50995E+00 -0.22003E-02 12788 0.157E-01 0.837E-01
RMM: 40 -0.416202363112E+03 -0.32507E+00 -0.20266E-02 12357 0.141E-01 0.818E-01
RMM: 41 -0.416209464210E+03 -0.71011E-02 -0.17691E-02 12227 0.130E-01 0.856E-01
RMM: 42 -0.416166907255E+03 0.42557E-01 -0.78530E-03 11422 0.879E-02 0.687E-01
RMM: 43 -0.416291140185E+03 -0.12423E+00 -0.50005E-03 11109 0.734E-02 0.546E-01
RMM: 44 -0.416412806171E+03 -0.12167E+00 -0.84191E-03 11912 0.852E-02 0.512E-01
RMM: 45 -0.416503873211E+03 -0.91067E-01 -0.10352E-02 12317 0.879E-02 0.396E-01
RMM: 46 -0.416614231918E+03 -0.11036E+00 -0.70631E-03 12022 0.754E-02 0.303E-01
RMM: 47 -0.416700416617E+03 -0.86185E-01 -0.29963E-03 11277 0.483E-02 0.199E-01
RMM: 48 -0.416767189284E+03 -0.66773E-01 -0.93014E-04 10707 0.310E-02 0.184E-01
RMM: 49 -0.416834175228E+03 -0.66986E-01 -0.67692E-04 10797 0.260E-02 0.138E-01
RMM: 50 -0.416864305754E+03 -0.30131E-01 -0.37024E-04 10718 0.184E-02 0.830E-02
RMM: 51 -0.416869449193E+03 -0.51434E-02 -0.12228E-04 9771 0.117E-02 0.704E-02
RMM: 52 -0.416871079125E+03 -0.16299E-02 -0.63809E-05 8515 0.815E-03 0.460E-02
RMM: 53 -0.416873376585E+03 -0.22975E-02 -0.53608E-05 8367 0.717E-03 0.355E-02
RMM: 54 -0.416875161261E+03 -0.17847E-02 -0.26318E-05 7602 0.512E-03 0.256E-02
RMM: 55 -0.416876661555E+03 -0.15003E-02 -0.24388E-05 7461 0.452E-03 0.193E-02
RMM: 56 -0.416877381779E+03 -0.72022E-03 -0.99573E-06 6563 0.328E-03 0.155E-02
RMM: 57 -0.416878189485E+03 -0.80771E-03 -0.74591E-06 6679 0.249E-03 0.103E-02
RMM: 58 -0.416878675853E+03 -0.48637E-03 -0.41704E-06 6030 0.186E-03 0.199E-02
RMM: 59 -0.416879015030E+03 -0.33918E-03 -0.23397E-06 4828 0.137E-03 0.189E-02
RMM: 60 -0.416879159515E+03 -0.14449E-03 -0.11538E-06 3912 0.112E-03 0.112E-02
RMM: 61 -0.416879217945E+03 -0.58431E-04 -0.24645E-06 5996 0.154E-03 0.840E-03
RMM: 62 -0.416879245622E+03 -0.27677E-04 -0.15542E-07 2639 0.838E-04 0.716E-03
RMM: 63 -0.416879300046E+03 -0.54424E-04 -0.33514E-07 3200 0.910E-04 0.849E-03
RMM: 64 -0.416879351907E+03 -0.51861E-04 -0.36675E-07 3152 0.913E-04 0.504E-03
RMM: 65 -0.416879447831E+03 -0.95925E-04 -0.70769E-07 3725 0.103E-03 0.329E-03
RMM: 66 -0.416879534035E+03 -0.86204E-04 -0.35658E-07 3260 0.933E-04 0.316E-03
RMM: 67 -0.416879603402E+03 -0.69367E-04 -0.46350E-07 3367 0.946E-04 0.364E-03
RMM: 68 -0.416879650943E+03 -0.47541E-04 -0.34055E-07 3274 0.914E-04 0.240E-03
RMM: 69 -0.416879684769E+03 -0.33826E-04 -0.23259E-07 2775 0.809E-04 0.142E-03
RMM: 70 -0.416879708676E+03 -0.23906E-04 -0.18362E-07 2656 0.794E-04 0.150E-03
RMM: 71 -0.416879724676E+03 -0.16001E-04 -0.17968E-07 2664 0.817E-04 0.147E-03
RMM: 72 -0.416879742336E+03 -0.17660E-04 -0.27216E-07 2922 0.847E-04 0.253E-03
RMM: 73 -0.416879750003E+03 -0.76676E-05 -0.11084E-07 2447 0.789E-04
1 F= -.45460001E+03 E0= -.45459964E+03 d E =-.110177E-02 mag= -0.0005