iterations/neb1_max2_image02_iter12_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422241918592E+04 0.42224E+04 -0.25381E+05 8992 0.103E+03
DAV: 2 -0.103439237778E+03 -0.43259E+04 -0.39236E+04 11016 0.248E+02
DAV: 3 -0.426390268268E+03 -0.32295E+03 -0.30150E+03 10248 0.656E+01
DAV: 4 -0.434909932304E+03 -0.85197E+01 -0.84190E+01 10728 0.107E+01
DAV: 5 -0.435200148396E+03 -0.29022E+00 -0.28954E+00 11128 0.193E+00 0.985E+01
RMM: 6 -0.389842835455E+03 0.45357E+02 -0.11164E+02 9700 0.146E+01 0.742E+01
RMM: 7 -0.825423272255E+03 -0.43558E+03 -0.44395E+02 11390 0.192E+01 0.150E+02
RMM: 8 -0.490280706406E+03 0.33514E+03 -0.10568E+02 9926 0.109E+01 0.898E+01
RMM: 9 -0.421299960514E+03 0.68981E+02 -0.69824E+01 10198 0.108E+01 0.610E+01
RMM: 10 -0.368786018155E+03 0.52514E+02 -0.35685E+01 10265 0.772E+00 0.284E+01
RMM: 11 -0.382196066868E+03 -0.13410E+02 -0.16072E+01 10394 0.453E+00 0.381E+01
RMM: 12 -0.372432772951E+03 0.97633E+01 -0.46366E+00 9935 0.300E+00 0.224E+01
RMM: 13 -0.370610209970E+03 0.18226E+01 -0.14923E+00 10107 0.166E+00 0.160E+01
RMM: 14 -0.372435985645E+03 -0.18258E+01 -0.88828E-01 10162 0.123E+00 0.127E+01
RMM: 15 -0.380844841643E+03 -0.84089E+01 -0.25354E+00 11725 0.200E+00 0.139E+01
RMM: 16 -0.387606816252E+03 -0.67620E+01 -0.23226E+00 11527 0.183E+00 0.140E+01
RMM: 17 -0.388901675856E+03 -0.12949E+01 -0.11773E+00 10819 0.131E+00 0.912E+00
RMM: 18 -0.392335988720E+03 -0.34343E+01 -0.97901E-01 10905 0.116E+00 0.761E+00
RMM: 19 -0.394143435116E+03 -0.18074E+01 -0.31051E-01 10270 0.707E-01 0.708E+00
RMM: 20 -0.395634701816E+03 -0.14913E+01 -0.24134E-01 10591 0.574E-01 0.710E+00
RMM: 21 -0.397690627896E+03 -0.20559E+01 -0.53774E-01 11611 0.789E-01 0.678E+00
RMM: 22 -0.401172473411E+03 -0.34818E+01 -0.11086E+00 12569 0.101E+00 0.649E+00
RMM: 23 -0.404629065125E+03 -0.34566E+01 -0.11360E+00 12811 0.997E-01 0.770E+00
RMM: 24 -0.404952075103E+03 -0.32301E+00 -0.95847E-02 10552 0.316E-01 0.529E+00
RMM: 25 -0.408629255032E+03 -0.36772E+01 -0.13510E+00 14088 0.102E+00 0.727E+00
RMM: 26 -0.409620063672E+03 -0.99081E+00 -0.16312E-01 11565 0.407E-01 0.716E+00
RMM: 27 -0.409753189798E+03 -0.13313E+00 -0.10632E-02 10829 0.111E-01 0.713E+00
RMM: 28 -0.409292960493E+03 0.46023E+00 -0.39754E-02 11353 0.222E-01 0.704E+00
RMM: 29 -0.408860043942E+03 0.43292E+00 -0.15340E-01 13899 0.470E-01 0.875E+00
RMM: 30 -0.408883810156E+03 -0.23766E-01 -0.26514E-02 10766 0.181E-01 0.892E+00
RMM: 31 -0.408047830569E+03 0.83598E+00 -0.13205E-01 13877 0.343E-01 0.463E+00
RMM: 32 -0.409353804358E+03 -0.13060E+01 -0.11952E-01 14450 0.427E-01 0.514E+00
RMM: 33 -0.410003179920E+03 -0.64938E+00 -0.84289E-03 10586 0.115E-01 0.517E+00
RMM: 34 -0.411436813834E+03 -0.14336E+01 -0.58255E-01 16909 0.839E-01 0.546E+00
RMM: 35 -0.412368539973E+03 -0.93173E+00 -0.60274E-01 17004 0.760E-01 0.655E+00
RMM: 36 -0.413472745907E+03 -0.11042E+01 -0.37336E-01 16688 0.611E-01 0.455E+00
RMM: 37 -0.413793433714E+03 -0.32069E+00 -0.33102E-02 13219 0.212E-01 0.398E+00
RMM: 38 -0.414092766050E+03 -0.29933E+00 -0.29378E-02 13027 0.198E-01 0.386E+00
RMM: 39 -0.414393310062E+03 -0.30054E+00 -0.60434E-02 14620 0.276E-01 0.356E+00
RMM: 40 -0.414562546887E+03 -0.16924E+00 -0.23905E-02 12904 0.188E-01 0.279E+00
RMM: 41 -0.414771051190E+03 -0.20850E+00 -0.12662E-02 11675 0.141E-01 0.228E+00
RMM: 42 -0.414905674722E+03 -0.13462E+00 -0.65639E-03 10721 0.104E-01 0.206E+00
RMM: 43 -0.414948958927E+03 -0.43284E-01 -0.39404E-03 10485 0.761E-02 0.187E+00
RMM: 44 -0.415007146539E+03 -0.58188E-01 -0.79242E-03 11506 0.100E-01 0.146E+00
RMM: 45 -0.415104275646E+03 -0.97129E-01 -0.13337E-02 12445 0.129E-01 0.109E+00
RMM: 46 -0.415229156492E+03 -0.12488E+00 -0.19129E-02 12923 0.140E-01 0.728E-01
RMM: 47 -0.415376209677E+03 -0.14705E+00 -0.15816E-02 12582 0.123E-01 0.564E-01
RMM: 48 -0.415544928283E+03 -0.16872E+00 -0.12752E-02 12261 0.104E-01 0.641E-01
RMM: 49 -0.415616183943E+03 -0.71256E-01 -0.33806E-03 11027 0.590E-02 0.588E-01
RMM: 50 -0.415724314578E+03 -0.10813E+00 -0.68035E-03 11753 0.680E-02 0.579E-01
RMM: 51 -0.415714431813E+03 0.98828E-02 -0.73173E-03 12343 0.851E-02 0.422E-01
RMM: 52 -0.415754283323E+03 -0.39852E-01 -0.21679E-03 11082 0.471E-02 0.328E-01
RMM: 53 -0.415780543969E+03 -0.26261E-01 -0.15174E-03 10958 0.359E-02 0.255E-01
RMM: 54 -0.415801985747E+03 -0.21442E-01 -0.93306E-04 10931 0.292E-02 0.217E-01
RMM: 55 -0.415847637243E+03 -0.45651E-01 -0.14438E-03 11905 0.331E-02 0.156E-01
RMM: 56 -0.415873487072E+03 -0.25850E-01 -0.73990E-04 11267 0.258E-02 0.117E-01
RMM: 57 -0.415908587416E+03 -0.35100E-01 -0.35468E-04 10939 0.184E-02 0.963E-02
RMM: 58 -0.415921997878E+03 -0.13410E-01 -0.13997E-04 9737 0.111E-02 0.971E-02
RMM: 59 -0.415928667789E+03 -0.66699E-02 -0.12918E-04 9840 0.968E-03 0.927E-02
RMM: 60 -0.415930804067E+03 -0.21363E-02 -0.67126E-05 8976 0.709E-03 0.745E-02
RMM: 61 -0.415931717307E+03 -0.91324E-03 -0.48889E-05 8482 0.645E-03 0.648E-02
RMM: 62 -0.415932099719E+03 -0.38241E-03 -0.45347E-05 8089 0.584E-03 0.557E-02
RMM: 63 -0.415932217089E+03 -0.11737E-03 -0.34951E-05 7735 0.473E-03 0.485E-02
RMM: 64 -0.415932287857E+03 -0.70768E-04 -0.17512E-05 6818 0.340E-03 0.437E-02
RMM: 65 -0.415932359453E+03 -0.71596E-04 -0.10908E-05 6444 0.276E-03 0.408E-02
RMM: 66 -0.415932603014E+03 -0.24356E-03 -0.93617E-06 6673 0.292E-03 0.407E-02
RMM: 67 -0.415932609305E+03 -0.62913E-05 -0.97497E-06 6603 0.289E-03
1 F= -.45363479E+03 E0= -.45363435E+03 d E =-.133148E-02 mag= 0.0009