iterations/neb3_max1_image03_iter13_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422151481972E+04 0.42215E+04 -0.25386E+05 9008 0.103E+03
DAV: 2 -0.104458881813E+03 -0.43260E+04 -0.39296E+04 11008 0.248E+02
DAV: 3 -0.426259561733E+03 -0.32180E+03 -0.30126E+03 10312 0.655E+01
DAV: 4 -0.434788913260E+03 -0.85294E+01 -0.83715E+01 10864 0.107E+01
DAV: 5 -0.435075420608E+03 -0.28651E+00 -0.28581E+00 11176 0.191E+00 0.101E+02
RMM: 6 -0.389330807512E+03 0.45745E+02 -0.10689E+02 9692 0.142E+01 0.741E+01
RMM: 7 -0.845783771744E+03 -0.45645E+03 -0.48868E+02 11510 0.199E+01 0.153E+02
RMM: 8 -0.495822080969E+03 0.34996E+03 -0.11409E+02 9932 0.113E+01 0.912E+01
RMM: 9 -0.417244270481E+03 0.78578E+02 -0.70604E+01 10175 0.109E+01 0.588E+01
RMM: 10 -0.378599664689E+03 0.38645E+02 -0.38257E+01 10292 0.807E+00 0.352E+01
RMM: 11 -0.382921694278E+03 -0.43220E+01 -0.19089E+01 10301 0.513E+00 0.404E+01
RMM: 12 -0.374367918945E+03 0.85538E+01 -0.54935E+00 9980 0.327E+00 0.261E+01
RMM: 13 -0.372843410956E+03 0.15245E+01 -0.30625E+00 10187 0.235E+00 0.186E+01
RMM: 14 -0.374573256474E+03 -0.17298E+01 -0.15096E+00 10278 0.163E+00 0.126E+01
RMM: 15 -0.381393772139E+03 -0.68205E+01 -0.14988E+00 10469 0.161E+00 0.169E+01
RMM: 16 -0.383839041588E+03 -0.24453E+01 -0.16306E+00 10624 0.168E+00 0.117E+01
RMM: 17 -0.389138245671E+03 -0.52992E+01 -0.19702E+00 11135 0.168E+00 0.868E+00
RMM: 18 -0.391736914681E+03 -0.25987E+01 -0.65107E-01 10289 0.103E+00 0.630E+00
RMM: 19 -0.394439667381E+03 -0.27028E+01 -0.54615E-01 10671 0.918E-01 0.677E+00
RMM: 20 -0.397130188640E+03 -0.26905E+01 -0.71053E-01 11300 0.973E-01 0.658E+00
RMM: 21 -0.399580186630E+03 -0.24500E+01 -0.64662E-01 11400 0.845E-01 0.622E+00
RMM: 22 -0.402291981970E+03 -0.27118E+01 -0.67012E-01 11620 0.825E-01 0.643E+00
RMM: 23 -0.406365427215E+03 -0.40734E+01 -0.15975E+00 12878 0.119E+00 0.701E+00
RMM: 24 -0.409474037465E+03 -0.31086E+01 -0.13515E+00 12822 0.104E+00 0.607E+00
RMM: 25 -0.410532083605E+03 -0.10580E+01 -0.11519E-01 10737 0.341E-01 0.566E+00
RMM: 26 -0.410189892458E+03 0.34219E+00 -0.26501E-02 10275 0.188E-01 0.553E+00
RMM: 27 -0.409842979178E+03 0.34691E+00 -0.27505E-02 10483 0.175E-01 0.533E+00
RMM: 28 -0.408777826798E+03 0.10652E+01 -0.20190E-01 13288 0.507E-01 0.614E+00
RMM: 29 -0.408081204129E+03 0.69662E+00 -0.25666E-01 14475 0.611E-01 0.695E+00
RMM: 30 -0.407680881129E+03 0.40032E+00 -0.85607E-02 12414 0.377E-01 0.822E+00
RMM: 31 -0.412117313188E+03 -0.44364E+01 -0.13146E+00 15936 0.127E+00 0.535E+00
RMM: 32 -0.413668587106E+03 -0.15513E+01 -0.48319E-01 14869 0.672E-01 0.614E+00
RMM: 33 -0.414476709323E+03 -0.80812E+00 -0.25922E-01 14137 0.526E-01 0.512E+00
RMM: 34 -0.415235230751E+03 -0.75852E+00 -0.15952E-01 13109 0.420E-01 0.320E+00
RMM: 35 -0.415393419054E+03 -0.15819E+00 -0.43422E-02 11355 0.246E-01 0.274E+00
RMM: 36 -0.415660844449E+03 -0.26743E+00 -0.18716E-02 10618 0.183E-01 0.288E+00
RMM: 37 -0.415951617217E+03 -0.29077E+00 -0.33137E-02 11149 0.240E-01 0.244E+00
RMM: 38 -0.416107454651E+03 -0.15584E+00 -0.19924E-02 10842 0.173E-01 0.157E+00
RMM: 39 -0.416317920512E+03 -0.21047E+00 -0.70111E-03 10307 0.102E-01 0.144E+00
RMM: 40 -0.416411795533E+03 -0.93875E-01 -0.42251E-03 10421 0.772E-02 0.128E+00
RMM: 41 -0.416532545085E+03 -0.12075E+00 -0.52331E-03 11041 0.807E-02 0.112E+00
RMM: 42 -0.416675489140E+03 -0.14294E+00 -0.59798E-03 11398 0.843E-02 0.824E-01
RMM: 43 -0.416825360534E+03 -0.14987E+00 -0.57762E-03 11483 0.796E-02 0.641E-01
RMM: 44 -0.416919340427E+03 -0.93980E-01 -0.80473E-03 12142 0.888E-02 0.491E-01
RMM: 45 -0.416982175156E+03 -0.62835E-01 -0.93751E-03 12331 0.912E-02 0.464E-01
RMM: 46 -0.417022612161E+03 -0.40437E-01 -0.54603E-03 11640 0.708E-02 0.406E-01
RMM: 47 -0.417092510771E+03 -0.69899E-01 -0.76745E-03 12015 0.772E-02 0.413E-01
RMM: 48 -0.417130529616E+03 -0.38019E-01 -0.27917E-03 11120 0.496E-02 0.334E-01
RMM: 49 -0.417168882456E+03 -0.38353E-01 -0.17710E-03 10984 0.402E-02 0.231E-01
RMM: 50 -0.417221121073E+03 -0.52239E-01 -0.25235E-03 11730 0.435E-02 0.187E-01
RMM: 51 -0.417252969521E+03 -0.31848E-01 -0.15995E-03 11567 0.369E-02 0.134E-01
RMM: 52 -0.417293365791E+03 -0.40396E-01 -0.86116E-04 11220 0.258E-02 0.112E-01
RMM: 53 -0.417320670396E+03 -0.27305E-01 -0.35174E-04 10753 0.173E-02 0.132E-01
RMM: 54 -0.417344956739E+03 -0.24286E-01 -0.21754E-04 10439 0.146E-02 0.113E-01
RMM: 55 -0.417360525004E+03 -0.15568E-01 -0.21085E-04 10875 0.136E-02 0.928E-02
RMM: 56 -0.417360556275E+03 -0.31271E-04 -0.65372E-05 9069 0.905E-03 0.567E-02
RMM: 57 -0.417362958970E+03 -0.24027E-02 -0.54701E-05 8548 0.771E-03 0.342E-02
RMM: 58 -0.417364141772E+03 -0.11828E-02 -0.43891E-05 8190 0.608E-03 0.225E-02
RMM: 59 -0.417364894551E+03 -0.75278E-03 -0.23454E-05 7403 0.427E-03 0.202E-02
RMM: 60 -0.417365643059E+03 -0.74851E-03 -0.21080E-05 7286 0.360E-03 0.136E-02
RMM: 61 -0.417366193782E+03 -0.55072E-03 -0.12159E-05 6944 0.274E-03 0.914E-03
RMM: 62 -0.417366513680E+03 -0.31990E-03 -0.61885E-06 6157 0.203E-03 0.613E-03
RMM: 63 -0.417366761291E+03 -0.24761E-03 -0.31850E-06 4890 0.149E-03 0.494E-03
RMM: 64 -0.417366895483E+03 -0.13419E-03 -0.21240E-06 4316 0.128E-03 0.360E-03
RMM: 65 -0.417366987840E+03 -0.92356E-04 -0.13974E-06 3773 0.113E-03 0.199E-03
RMM: 66 -0.417367024979E+03 -0.37139E-04 -0.68169E-07 3284 0.983E-04 0.245E-03
RMM: 67 -0.417367069443E+03 -0.44464E-04 -0.56425E-07 3205 0.935E-04 0.216E-03
RMM: 68 -0.417367095062E+03 -0.25620E-04 -0.22260E-07 2700 0.858E-04 0.172E-03
RMM: 69 -0.417367122684E+03 -0.27621E-04 -0.30739E-07 3000 0.891E-04 0.120E-03
RMM: 70 -0.417367132790E+03 -0.10106E-04 -0.17607E-07 2645 0.870E-04 0.891E-04
RMM: 71 -0.417367136672E+03 -0.38816E-05 -0.14763E-07 2537 0.856E-04
1 F= -.45504038E+03 E0= -.45504119E+03 d E =0.242704E-02 mag= -0.0006