iterations/neb3_max1_image04_iter23_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421099133385E+04 0.42110E+04 -0.25377E+05 9008 0.103E+03
DAV: 2 -0.106412173189E+03 -0.43174E+04 -0.39179E+04 11000 0.248E+02
DAV: 3 -0.427547119189E+03 -0.32113E+03 -0.30012E+03 10240 0.655E+01
DAV: 4 -0.436012699636E+03 -0.84656E+01 -0.83713E+01 10848 0.107E+01
DAV: 5 -0.436291291293E+03 -0.27859E+00 -0.27788E+00 11024 0.189E+00 0.992E+01
RMM: 6 -0.385560142500E+03 0.50731E+02 -0.11071E+02 9697 0.145E+01 0.714E+01
RMM: 7 -0.585072705176E+03 -0.19951E+03 -0.21321E+02 10377 0.156E+01 0.108E+02
RMM: 8 -0.549171667385E+03 0.35901E+02 -0.12909E+02 10416 0.120E+01 0.960E+01
RMM: 9 -0.382055073078E+03 0.16712E+03 -0.56566E+01 10308 0.925E+00 0.359E+01
RMM: 10 -0.392013744507E+03 -0.99587E+01 -0.26308E+01 9988 0.671E+00 0.402E+01
RMM: 11 -0.376328479232E+03 0.15685E+02 -0.95959E+00 9912 0.418E+00 0.165E+01
RMM: 12 -0.377350853801E+03 -0.10224E+01 -0.29342E+00 10269 0.220E+00 0.110E+01
RMM: 13 -0.379677573302E+03 -0.23267E+01 -0.82529E-01 10253 0.113E+00 0.108E+01
RMM: 14 -0.380890616497E+03 -0.12130E+01 -0.48743E-01 10128 0.907E-01 0.946E+00
RMM: 15 -0.388658488954E+03 -0.77679E+01 -0.15952E+00 11777 0.155E+00 0.127E+01
RMM: 16 -0.389054420565E+03 -0.39593E+00 -0.56474E-01 10595 0.960E-01 0.901E+00
RMM: 17 -0.390691572462E+03 -0.16372E+01 -0.34703E-01 10461 0.722E-01 0.644E+00
RMM: 18 -0.396013382709E+03 -0.53218E+01 -0.15285E+00 12317 0.132E+00 0.641E+00
RMM: 19 -0.401050805221E+03 -0.50374E+01 -0.17597E+00 12537 0.135E+00 0.557E+00
RMM: 20 -0.404634149331E+03 -0.35833E+01 -0.10100E+00 11944 0.978E-01 0.509E+00
RMM: 21 -0.408490125647E+03 -0.38560E+01 -0.15833E+00 12652 0.111E+00 0.499E+00
RMM: 22 -0.411491744238E+03 -0.30016E+01 -0.11821E+00 12315 0.941E-01 0.802E+00
RMM: 23 -0.411102849049E+03 0.38890E+00 -0.39069E-02 10526 0.252E-01 0.742E+00
RMM: 24 -0.411254934306E+03 -0.15209E+00 -0.15159E-02 10920 0.120E-01 0.786E+00
RMM: 25 -0.411257074976E+03 -0.21407E-02 -0.37054E-02 11058 0.181E-01 0.949E+00
RMM: 26 -0.410785857019E+03 0.47122E+00 -0.49722E-03 10325 0.106E-01 0.951E+00
RMM: 27 -0.409863949101E+03 0.92191E+00 -0.10048E-01 14081 0.328E-01 0.938E+00
RMM: 28 -0.409562272642E+03 0.30168E+00 -0.49425E-02 14007 0.270E-01 0.900E+00
RMM: 29 -0.409769857278E+03 -0.20758E+00 -0.13719E-01 15435 0.449E-01 0.892E+00
RMM: 30 -0.409405631019E+03 0.36423E+00 -0.19890E-01 16006 0.536E-01 0.952E+00
RMM: 31 -0.408779061417E+03 0.62657E+00 -0.62119E-02 13745 0.299E-01 0.100E+01
RMM: 32 -0.410970864212E+03 -0.21918E+01 -0.78239E-01 16991 0.949E-01 0.881E+00
RMM: 33 -0.411790077455E+03 -0.81921E+00 -0.40127E-01 16569 0.630E-01 0.493E+00
RMM: 34 -0.413366181774E+03 -0.15761E+01 -0.21523E-01 16004 0.500E-01 0.537E+00
RMM: 35 -0.413825812969E+03 -0.45963E+00 -0.78290E-02 14566 0.308E-01 0.600E+00
RMM: 36 -0.414028853060E+03 -0.20304E+00 -0.17961E-01 15222 0.423E-01 0.661E+00
RMM: 37 -0.414009953528E+03 0.18900E-01 -0.13170E-01 14113 0.323E-01 0.656E+00
RMM: 38 -0.413864107934E+03 0.14585E+00 -0.22498E-02 11189 0.132E-01 0.672E+00
RMM: 39 -0.413864621897E+03 -0.51396E-03 -0.30905E-03 10764 0.518E-02 0.662E+00
RMM: 40 -0.413924645214E+03 -0.60023E-01 -0.24005E-03 10692 0.362E-02 0.652E+00
RMM: 41 -0.413993119530E+03 -0.68474E-01 -0.24602E-03 10793 0.337E-02 0.641E+00
RMM: 42 -0.414399951442E+03 -0.40683E+00 -0.61046E-02 15730 0.159E-01 0.570E+00
RMM: 43 -0.415512403556E+03 -0.11125E+01 -0.33983E-01 17749 0.414E-01 0.353E+00
RMM: 44 -0.416190510926E+03 -0.67811E+00 -0.17736E-01 17640 0.337E-01 0.241E+00
RMM: 45 -0.416331212924E+03 -0.14070E+00 -0.28072E-02 15961 0.141E-01 0.226E+00
RMM: 46 -0.416545924030E+03 -0.21471E+00 -0.26286E-02 16753 0.163E-01 0.210E+00
RMM: 47 -0.416830676667E+03 -0.28475E+00 -0.61122E-02 17458 0.242E-01 0.119E+00
RMM: 48 -0.416890650416E+03 -0.59974E-01 -0.20185E-02 15669 0.122E-01 0.100E+00
RMM: 49 -0.416919088399E+03 -0.28438E-01 -0.20816E-03 12422 0.466E-02 0.974E-01
RMM: 50 -0.416998478008E+03 -0.79390E-01 -0.59050E-03 14796 0.870E-02 0.989E-01
RMM: 51 -0.417067509210E+03 -0.69031E-01 -0.55883E-03 14463 0.788E-02 0.104E+00
RMM: 52 -0.417176815438E+03 -0.10931E+00 -0.63087E-03 14171 0.737E-02 0.743E-01
RMM: 53 -0.417265806244E+03 -0.88991E-01 -0.59942E-03 14127 0.736E-02 0.535E-01
RMM: 54 -0.417330791233E+03 -0.64985E-01 -0.51749E-03 14067 0.673E-02 0.466E-01
RMM: 55 -0.417385937555E+03 -0.55146E-01 -0.46953E-03 13732 0.607E-02 0.445E-01
RMM: 56 -0.417452144590E+03 -0.66207E-01 -0.63238E-03 14189 0.695E-02 0.346E-01
RMM: 57 -0.417503481343E+03 -0.51337E-01 -0.41176E-03 13080 0.554E-02 0.442E-01
RMM: 58 -0.417565091464E+03 -0.61610E-01 -0.17636E-03 12235 0.345E-02 0.456E-01
RMM: 59 -0.417585021148E+03 -0.19930E-01 -0.51741E-04 11085 0.200E-02 0.403E-01
RMM: 60 -0.417604837390E+03 -0.19816E-01 -0.66434E-04 11541 0.224E-02 0.333E-01
RMM: 61 -0.417597877497E+03 0.69599E-02 -0.21112E-04 10569 0.146E-02 0.311E-01
RMM: 62 -0.417609593435E+03 -0.11716E-01 -0.16997E-04 10208 0.124E-02 0.283E-01
RMM: 63 -0.417620182693E+03 -0.10589E-01 -0.33554E-04 11184 0.153E-02 0.238E-01
RMM: 64 -0.417624370763E+03 -0.41881E-02 -0.17382E-04 10039 0.109E-02 0.212E-01
RMM: 65 -0.417625142809E+03 -0.77205E-03 -0.59215E-05 8552 0.683E-03 0.198E-01
RMM: 66 -0.417625286746E+03 -0.14394E-03 -0.10771E-03 13089 0.240E-02 0.157E-01
RMM: 67 -0.417625107553E+03 0.17919E-03 -0.41622E-05 7933 0.767E-03 0.144E-01
RMM: 68 -0.417623680574E+03 0.14270E-02 -0.75017E-05 8403 0.786E-03 0.139E-01
RMM: 69 -0.417622539202E+03 0.11414E-02 -0.37105E-05 7373 0.498E-03 0.132E-01
RMM: 70 -0.417621636639E+03 0.90256E-03 -0.45271E-05 7672 0.502E-03 0.119E-01
RMM: 71 -0.417620019776E+03 0.16169E-02 -0.27087E-04 10889 0.123E-02 0.854E-02
RMM: 72 -0.417619577189E+03 0.44259E-03 -0.43832E-05 7557 0.535E-03 0.776E-02
RMM: 73 -0.417619036091E+03 0.54110E-03 -0.12681E-04 9153 0.768E-03 0.623E-02
RMM: 74 -0.417619004124E+03 0.31967E-04 -0.12554E-04 9158 0.768E-03 0.433E-02
RMM: 75 -0.417619502945E+03 -0.49882E-03 -0.10079E-04 8704 0.720E-03 0.254E-02
RMM: 76 -0.417619540371E+03 -0.37426E-04 -0.13704E-04 9399 0.823E-03 0.141E-02
RMM: 77 -0.417619840417E+03 -0.30005E-03 -0.13976E-05 6969 0.341E-03 0.805E-03
RMM: 78 -0.417620038161E+03 -0.19774E-03 -0.86265E-06 6278 0.227E-03 0.651E-03
RMM: 79 -0.417620203247E+03 -0.16509E-03 -0.57985E-06 5094 0.174E-03 0.534E-03
RMM: 80 -0.417620433065E+03 -0.22982E-03 -0.54154E-06 5411 0.169E-03 0.390E-03
RMM: 81 -0.417620712743E+03 -0.27968E-03 -0.48359E-06 5032 0.154E-03 0.494E-03
RMM: 82 -0.417620837586E+03 -0.12484E-03 -0.17016E-06 3939 0.114E-03 0.352E-03
RMM: 83 -0.417621020210E+03 -0.18262E-03 -0.12897E-06 3927 0.110E-03 0.267E-03
RMM: 84 -0.417621260437E+03 -0.24023E-03 -0.11668E-06 3925 0.108E-03 0.226E-03
RMM: 85 -0.417621449659E+03 -0.18922E-03 -0.11175E-06 3942 0.107E-03 0.148E-03
RMM: 86 -0.417621549291E+03 -0.99632E-04 -0.10650E-06 3761 0.102E-03 0.131E-03
RMM: 87 -0.417621608829E+03 -0.59538E-04 -0.54494E-07 3303 0.925E-04 0.970E-04
RMM: 88 -0.417621627948E+03 -0.19119E-04 -0.18192E-07 2657 0.836E-04 0.917E-04
RMM: 89 -0.417621647275E+03 -0.19327E-04 -0.14022E-07 2601 0.836E-04 0.866E-04
RMM: 90 -0.417621661140E+03 -0.13865E-04 -0.16448E-07 2668 0.851E-04 0.575E-04
RMM: 91 -0.417621670286E+03 -0.91453E-05 -0.21484E-07 2781 0.875E-04
1 F= -.45523925E+03 E0= -.45523962E+03 d E =0.109850E-02 mag= -0.0002