./iterations/neb1_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 0.421374532653E+04 0.42137E+04 -0.25380E+05 9008 0.103E+03
DAV: 2 -0.105964776566E+03 -0.43197E+04 -0.39254E+04 11000 0.248E+02
DAV: 3 -0.427427582785E+03 -0.32146E+03 -0.30060E+03 10256 0.654E+01
DAV: 4 -0.435863630694E+03 -0.84360E+01 -0.83381E+01 10864 0.106E+01
DAV: 5 -0.436144837423E+03 -0.28121E+00 -0.28045E+00 11104 0.189E+00 0.996E+01
RMM: 6 -0.387511598549E+03 0.48633E+02 -0.10957E+02 9696 0.144E+01 0.714E+01
RMM: 7 -0.718142823453E+03 -0.33063E+03 -0.34930E+02 10998 0.179E+01 0.136E+02
RMM: 8 -0.505871576037E+03 0.21227E+03 -0.11558E+02 10181 0.113E+01 0.909E+01
RMM: 9 -0.394988220632E+03 0.11088E+03 -0.68944E+01 10231 0.107E+01 0.482E+01
RMM: 10 -0.398747146483E+03 -0.37589E+01 -0.42835E+01 10208 0.843E+00 0.487E+01
RMM: 11 -0.391459622974E+03 0.72875E+01 -0.23435E+01 10244 0.603E+00 0.476E+01
RMM: 12 -0.376985292705E+03 0.14474E+02 -0.81837E+00 9957 0.382E+00 0.284E+01
RMM: 13 -0.375439296233E+03 0.15460E+01 -0.25042E+00 10039 0.214E+00 0.234E+01
RMM: 14 -0.374783983713E+03 0.65531E+00 -0.11543E+00 10133 0.144E+00 0.156E+01
RMM: 15 -0.377529309016E+03 -0.27453E+01 -0.10334E+00 10447 0.132E+00 0.114E+01
RMM: 16 -0.384002178522E+03 -0.64729E+01 -0.13820E+00 10902 0.150E+00 0.163E+01
RMM: 17 -0.387014776074E+03 -0.30126E+01 -0.12062E+00 10846 0.136E+00 0.138E+01
RMM: 18 -0.389765011187E+03 -0.27502E+01 -0.89206E-01 10732 0.114E+00 0.106E+01
RMM: 19 -0.394525779683E+03 -0.47608E+01 -0.14073E+00 11416 0.132E+00 0.714E+00
RMM: 20 -0.397446090987E+03 -0.29203E+01 -0.69051E-01 10945 0.981E-01 0.612E+00
RMM: 21 -0.400150520838E+03 -0.27044E+01 -0.86400E-01 11476 0.101E+00 0.598E+00
RMM: 22 -0.402661737420E+03 -0.25112E+01 -0.77989E-01 11577 0.909E-01 0.622E+00
RMM: 23 -0.406409934628E+03 -0.37482E+01 -0.16751E+00 12528 0.118E+00 0.717E+00
RMM: 24 -0.408674892958E+03 -0.22650E+01 -0.10296E+00 12203 0.921E-01 0.763E+00
RMM: 25 -0.410638524314E+03 -0.19636E+01 -0.86058E-01 12037 0.805E-01 0.686E+00
RMM: 26 -0.410684423705E+03 -0.45899E-01 -0.24004E-02 10702 0.172E-01 0.664E+00
RMM: 27 -0.410715995744E+03 -0.31572E-01 -0.68269E-03 10820 0.843E-02 0.610E+00
RMM: 28 -0.411209317905E+03 -0.49332E+00 -0.11862E-02 10800 0.121E-01 0.652E+00
RMM: 29 -0.411196113897E+03 0.13204E-01 -0.33346E-03 10328 0.574E-02 0.703E+00
RMM: 30 -0.411022079273E+03 0.17403E+00 -0.12222E-02 12237 0.127E-01 0.709E+00
RMM: 31 -0.410915603587E+03 0.10648E+00 -0.28140E-03 10248 0.728E-02 0.692E+00
RMM: 32 -0.410725645793E+03 0.18996E+00 -0.33337E-02 14450 0.217E-01 0.561E+00
RMM: 33 -0.411302499424E+03 -0.57685E+00 -0.45487E-03 11549 0.830E-02 0.523E+00
RMM: 34 -0.410600713965E+03 0.70179E+00 -0.44688E-01 17851 0.741E-01 0.912E+00
RMM: 35 -0.410585788693E+03 0.14925E-01 -0.18247E-02 13189 0.185E-01 0.819E+00
RMM: 36 -0.410983154171E+03 -0.39737E+00 -0.20639E-01 17361 0.510E-01 0.522E+00
RMM: 37 -0.412195163061E+03 -0.12120E+01 -0.34218E-01 17864 0.663E-01 0.915E+00
RMM: 38 -0.417230047950E+03 -0.50349E+01 -0.25048E+00 17920 0.172E+00 0.348E+01
RMM: 39 -0.419611554521E+03 -0.23815E+01 -0.10367E-01 17296 0.379E-01 0.381E+01
RMM: 40 -0.420455832314E+03 -0.84428E+00 -0.21029E-02 13827 0.165E-01 0.392E+01
RMM: 41 -0.420086258541E+03 0.36957E+00 -0.11249E-02 12664 0.124E-01 0.385E+01
RMM: 42 -0.418772039345E+03 0.13142E+01 -0.37444E-02 15076 0.213E-01 0.366E+01
RMM: 43 -0.416534572448E+03 0.22375E+01 -0.73827E-02 16338 0.295E-01 0.332E+01
RMM: 44 -0.414947559353E+03 0.15870E+01 -0.56871E-02 15684 0.260E-01 0.302E+01
RMM: 45 -0.416162622870E+03 -0.12151E+01 -0.61124E-02 15237 0.266E-01 0.313E+01
RMM: 46 -0.415451405033E+03 0.71122E+00 -0.33169E-01 17465 0.589E-01 0.272E+01
RMM: 47 -0.414016417222E+03 0.14350E+01 -0.14192E-01 16971 0.408E-01 0.225E+01
RMM: 48 -0.413265335081E+03 0.75108E+00 -0.65526E-02 16025 0.293E-01 0.186E+01
RMM: 49 -0.413090301229E+03 0.17503E+00 -0.76906E-02 16321 0.317E-01 0.146E+01
RMM: 50 -0.413415487287E+03 -0.32519E+00 -0.17593E-01 17570 0.482E-01 0.111E+01
RMM: 51 -0.413404586651E+03 0.10901E-01 -0.11984E-01 16561 0.371E-01 0.111E+01
RMM: 52 -0.413480358024E+03 -0.75771E-01 -0.11586E-02 12600 0.127E-01 0.117E+01
RMM: 53 -0.413816458536E+03 -0.33610E+00 -0.18268E-01 16958 0.448E-01 0.973E+00
RMM: 54 -0.413971139210E+03 -0.15468E+00 -0.11034E-01 16612 0.368E-01 0.766E+00
RMM: 55 -0.413992566136E+03 -0.21427E-01 -0.93051E-02 15979 0.365E-01 0.710E+00
RMM: 56 -0.415154478162E+03 -0.11619E+01 -0.21170E-01 17425 0.491E-01 0.121E+01
RMM: 57 -0.414568188227E+03 0.58629E+00 -0.56075E-02 15200 0.293E-01 0.103E+01
RMM: 58 -0.415070001120E+03 -0.50181E+00 -0.71199E-02 15899 0.292E-01 0.131E+01
RMM: 59 -0.415033273202E+03 0.36728E-01 -0.28508E-02 14563 0.205E-01 0.142E+01
RMM: 60 -0.414933130628E+03 0.10014E+00 -0.15661E-02 13154 0.159E-01 0.134E+01
RMM: 61 -0.415020517740E+03 -0.87387E-01 -0.24617E-02 14360 0.206E-01 0.129E+01
RMM: 62 -0.414972343782E+03 0.48174E-01 -0.31805E-02 14695 0.212E-01 0.117E+01
RMM: 63 -0.414863487695E+03 0.10886E+00 -0.58370E-04 10488 0.375E-02 0.117E+01
RMM: 64 -0.414889597889E+03 -0.26110E-01 -0.28562E-03 11777 0.691E-02 0.117E+01
RMM: 65 -0.414898872413E+03 -0.92745E-02 -0.16544E-04 10109 0.178E-02 0.117E+01
RMM: 66 -0.415149067684E+03 -0.25020E+00 -0.23402E-02 17087 0.166E-01 0.110E+01
RMM: 67 -0.415113642433E+03 0.35425E-01 -0.57329E-04 11455 0.360E-02 0.111E+01
RMM: 68 -0.414828711112E+03 0.28493E+00 -0.56215E-03 15598 0.941E-02 0.104E+01
RMM: 69 -0.413938228616E+03 0.89048E+00 -0.20628E-02 17538 0.192E-01 0.104E+01
RMM: 70 -0.413493549367E+03 0.44468E+00 -0.46351E-02 17920 0.279E-01 0.111E+01
RMM: 71 -0.413730748537E+03 -0.23720E+00 -0.55355E-01 17920 0.776E-01 0.104E+01
RMM: 72 -0.413967102451E+03 -0.23635E+00 -0.66464E-03 16246 0.127E-01 0.103E+01
RMM: 73 -0.414046151177E+03 -0.79049E-01 -0.34916E-03 14993 0.771E-02 0.107E+01
RMM: 74 -0.414155693289E+03 -0.10954E+00 -0.40450E-03 15383 0.783E-02 0.109E+01
RMM: 75 -0.414322188259E+03 -0.16649E+00 -0.41916E-03 15263 0.791E-02 0.112E+01
RMM: 76 -0.415494858254E+03 -0.11727E+01 -0.14418E-01 17918 0.498E-01 0.143E+01
RMM: 77 -0.416418059822E+03 -0.92320E+00 -0.39895E-02 17917 0.244E-01 0.159E+01
RMM: 78 -0.416805004879E+03 -0.38695E+00 -0.88671E-03 16372 0.117E-01 0.167E+01
RMM: 79 -0.416728648488E+03 0.76356E-01 -0.73447E-04 11396 0.363E-02 0.165E+01
RMM: 80 -0.416781436751E+03 -0.52788E-01 -0.15243E-04 10301 0.166E-02 0.166E+01
RMM: 81 -0.417724664065E+03 -0.94323E+00 -0.74841E-02 17918 0.360E-01 0.190E+01
RMM: 82 -0.417758289242E+03 -0.33625E-01 -0.45127E-03 15707 0.827E-02 0.188E+01
RMM: 83 -0.417836036259E+03 -0.77747E-01 -0.87711E-04 12552 0.388E-02 0.190E+01
RMM: 84 -0.417792947289E+03 0.43089E-01 -0.13862E-04 10395 0.157E-02 0.189E+01
RMM: 85 -0.417816356654E+03 -0.23409E-01 -0.23966E-04 11317 0.188E-02 0.189E+01
RMM: 86 -0.418365392362E+03 -0.54904E+00 -0.27834E-01 17920 0.635E-01 0.224E+01
RMM: 87 -0.418355321061E+03 0.10071E-01 -0.19250E-03 15390 0.585E-02 0.221E+01
RMM: 88 -0.418502579534E+03 -0.14726E+00 -0.83692E-03 17173 0.114E-01 0.218E+01
RMM: 89 -0.418613388984E+03 -0.11081E+00 -0.13434E-02 17727 0.146E-01 0.212E+01
RMM: 90 -0.418937916056E+03 -0.32453E+00 -0.13190E-02 17434 0.138E-01 0.213E+01
RMM: 91 -0.419623690597E+03 -0.68577E+00 -0.88717E-02 17920 0.386E-01 0.238E+01
RMM: 92 -0.419719797378E+03 -0.96107E-01 -0.84219E-03 16792 0.114E-01 0.235E+01
RMM: 93 -0.420001732601E+03 -0.28194E+00 -0.62895E-03 16494 0.955E-02 0.238E+01
RMM: 94 -0.420168511248E+03 -0.16678E+00 -0.30987E-03 15611 0.669E-02 0.240E+01
RMM: 95 -0.420309169500E+03 -0.14066E+00 -0.18482E-03 14943 0.507E-02 0.241E+01
RMM: 96 -0.421099480875E+03 -0.79031E+00 -0.51528E-02 17920 0.284E-01 0.258E+01
RMM: 97 -0.421331418805E+03 -0.23194E+00 -0.13036E-02 17505 0.134E-01 0.262E+01
RMM: 98 -0.421223079015E+03 0.10834E+00 -0.98540E-03 17233 0.124E-01 0.258E+01
RMM: 99 -0.421353669050E+03 -0.13059E+00 -0.61817E-03 16628 0.953E-02 0.257E+01
RMM: 100 -0.421670842897E+03 -0.31717E+00 -0.60399E-03 16576 0.990E-02 0.263E+01
RMM: 101 -0.422035790525E+03 -0.36495E+00 -0.11065E-02 17739 0.130E-01 0.270E+01
RMM: 102 -0.422152036784E+03 -0.11625E+00 -0.33643E-03 15768 0.703E-02 0.273E+01
RMM: 103 -0.422251743908E+03 -0.99707E-01 -0.24423E-03 15232 0.601E-02 0.275E+01
RMM: 104 -0.422383417362E+03 -0.13167E+00 -0.21985E-03 15223 0.562E-02 0.278E+01
RMM: 105 -0.422495583952E+03 -0.11217E+00 -0.12150E-03 14369 0.410E-02 0.280E+01
RMM: 106 -0.414172612459E+03 0.83230E+01 -0.44043E+00 17920 0.263E+00 0.784E+00
RMM: 107 -0.415201178359E+03 -0.10286E+01 -0.18657E-01 17920 0.501E-01 0.819E+00
RMM: 108 -0.415831552502E+03 -0.63037E+00 -0.51294E-02 17905 0.226E-01 0.775E+00
RMM: 109 -0.415944494277E+03 -0.11294E+00 -0.22873E-02 17804 0.162E-01 0.755E+00
RMM: 110 -0.415986873658E+03 -0.42379E-01 -0.53167E-02 17920 0.260E-01 0.690E+00
RMM: 111 -0.414750735768E+03 0.12361E+01 -0.32737E-01 17920 0.671E-01 0.432E+00
RMM: 112 -0.415362005736E+03 -0.61127E+00 -0.74867E-02 17910 0.323E-01 0.365E+00
RMM: 113 -0.415487274281E+03 -0.12527E+00 -0.29229E-02 17885 0.198E-01 0.350E+00
RMM: 114 -0.415848226709E+03 -0.36095E+00 -0.22643E-02 17823 0.169E-01 0.285E+00
RMM: 115 -0.416098852820E+03 -0.25063E+00 -0.17093E-02 17714 0.147E-01 0.212E+00
RMM: 116 -0.416322114405E+03 -0.22326E+00 -0.44612E-02 17895 0.236E-01 0.142E+00
RMM: 117 -0.416776638454E+03 -0.45452E+00 -0.17559E-02 17496 0.141E-01 0.134E+00
RMM: 118 -0.416934129645E+03 -0.15749E+00 -0.84837E-03 16378 0.890E-02 0.960E-01
RMM: 119 -0.417247739551E+03 -0.31361E+00 -0.10312E-02 16874 0.102E-01 0.738E-01
RMM: 120 -0.417440263325E+03 -0.19252E+00 -0.11888E-02 16612 0.101E-01 0.476E-01
RMM: 121 -0.417543350255E+03 -0.10309E+00 -0.51661E-03 15747 0.679E-02 0.369E-01
RMM: 122 -0.417608431810E+03 -0.65082E-01 -0.43278E-03 15306 0.608E-02 0.279E-01
RMM: 123 -0.417649352780E+03 -0.40921E-01 -0.28612E-03 14543 0.489E-02 0.229E-01
RMM: 124 -0.417673889210E+03 -0.24536E-01 -0.16670E-03 13445 0.378E-02 0.160E-01
RMM: 125 -0.417689523007E+03 -0.15634E-01 -0.81494E-04 12507 0.280E-02 0.143E-01
RMM: 126 -0.417707322679E+03 -0.17800E-01 -0.83690E-04 12549 0.279E-02 0.148E-01
RMM: 127 -0.417729074017E+03 -0.21751E-01 -0.61139E-04 12146 0.232E-02 0.103E-01
RMM: 128 -0.417784987270E+03 -0.55913E-01 -0.84354E-04 12470 0.237E-02 0.785E-02
RMM: 129 -0.417835277547E+03 -0.50290E-01 -0.38654E-04 11493 0.161E-02 0.595E-02
RMM: 130 -0.417861752324E+03 -0.26475E-01 -0.19024E-04 10216 0.116E-02 0.350E-02
RMM: 131 -0.417869227900E+03 -0.74756E-02 -0.65024E-05 8984 0.780E-03 0.379E-02
RMM: 132 -0.417871392128E+03 -0.21642E-02 -0.35475E-05 7973 0.557E-03 0.201E-02
RMM: 133 -0.417872928660E+03 -0.15365E-02 -0.22774E-05 7446 0.378E-03 0.192E-02
RMM: 134 -0.417873703875E+03 -0.77521E-03 -0.63334E-06 6511 0.236E-03 0.119E-02
RMM: 135 -0.417874203477E+03 -0.49960E-03 -0.39647E-06 5624 0.174E-03 0.761E-03
RMM: 136 -0.417874443098E+03 -0.23962E-03 -0.21462E-06 5679 0.151E-03 0.717E-03
RMM: 137 -0.417874649749E+03 -0.20665E-03 -0.10955E-06 3884 0.111E-03 0.427E-03
RMM: 138 -0.417874865617E+03 -0.21587E-03 -0.15595E-06 4294 0.123E-03 0.304E-03
RMM: 139 -0.417874973761E+03 -0.10814E-03 -0.10002E-06 3890 0.108E-03 0.239E-03
RMM: 140 -0.417875041852E+03 -0.68092E-04 -0.70085E-07 3439 0.964E-04 0.155E-03
RMM: 141 -0.417875066335E+03 -0.24483E-04 -0.40883E-07 3032 0.877E-04 0.198E-03
RMM: 142 -0.417875074029E+03 -0.76937E-05 -0.21308E-07 2700 0.833E-04
1 F= -.45550183E+03 E0= -.45550211E+03 d E =0.839112E-03 mag= 0.0010