iterations/neb3_max1_image03_iter21_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.420050297906E+04 0.42005E+04 -0.25367E+05 9008 0.103E+03
DAV: 2 -0.106761592329E+03 -0.43073E+04 -0.39073E+04 11008 0.247E+02
DAV: 3 -0.427451963954E+03 -0.32069E+03 -0.29942E+03 10272 0.654E+01
DAV: 4 -0.435874746174E+03 -0.84228E+01 -0.83249E+01 10768 0.106E+01
DAV: 5 -0.436152586833E+03 -0.27784E+00 -0.27718E+00 11000 0.188E+00 0.970E+01
RMM: 6 -0.391080335574E+03 0.45072E+02 -0.10939E+02 9678 0.144E+01 0.769E+01
RMM: 7 -0.600501235263E+03 -0.20942E+03 -0.22570E+02 10659 0.144E+01 0.107E+02
RMM: 8 -0.581229903713E+03 0.19271E+02 -0.15775E+02 10529 0.128E+01 0.106E+02
RMM: 9 -0.387120720705E+03 0.19411E+03 -0.46942E+01 10056 0.891E+00 0.392E+01
RMM: 10 -0.409052130284E+03 -0.21931E+02 -0.41911E+01 10360 0.745E+00 0.525E+01
RMM: 11 -0.378800459305E+03 0.30252E+02 -0.15772E+01 9945 0.520E+00 0.210E+01
RMM: 12 -0.376022598803E+03 0.27779E+01 -0.46011E+00 10253 0.260E+00 0.149E+01
RMM: 13 -0.377623634105E+03 -0.16010E+01 -0.14815E+00 10316 0.147E+00 0.128E+01
RMM: 14 -0.379673611289E+03 -0.20500E+01 -0.76286E-01 10332 0.104E+00 0.121E+01
RMM: 15 -0.382670957234E+03 -0.29973E+01 -0.10114E+00 10759 0.126E+00 0.969E+00
RMM: 16 -0.388586371305E+03 -0.59154E+01 -0.12529E+00 11276 0.137E+00 0.106E+01
RMM: 17 -0.389984403417E+03 -0.13980E+01 -0.65025E-01 10660 0.102E+00 0.809E+00
RMM: 18 -0.391472661840E+03 -0.14883E+01 -0.43120E-01 10677 0.784E-01 0.603E+00
RMM: 19 -0.395052759584E+03 -0.35801E+01 -0.62249E-01 11535 0.872E-01 0.611E+00
RMM: 20 -0.397669965738E+03 -0.26172E+01 -0.55880E-01 11539 0.804E-01 0.512E+00
RMM: 21 -0.402178998974E+03 -0.45090E+01 -0.15323E+00 12728 0.119E+00 0.520E+00
RMM: 22 -0.406691103140E+03 -0.45121E+01 -0.22530E+00 13388 0.134E+00 0.500E+00
RMM: 23 -0.410003698064E+03 -0.33126E+01 -0.14464E+00 12916 0.107E+00 0.954E+00
RMM: 24 -0.409522183071E+03 0.48151E+00 -0.26291E-01 10988 0.509E-01 0.920E+00
RMM: 25 -0.409611637724E+03 -0.89455E-01 -0.50931E-02 10408 0.224E-01 0.555E+00
RMM: 26 -0.412261994665E+03 -0.26504E+01 -0.48651E-01 13182 0.588E-01 0.914E+00
RMM: 27 -0.411263157131E+03 0.99884E+00 -0.31882E-02 10489 0.232E-01 0.913E+00
RMM: 28 -0.410743645639E+03 0.51951E+00 -0.16269E-02 10428 0.144E-01 0.911E+00
RMM: 29 -0.409633560844E+03 0.11101E+01 -0.13316E-01 13521 0.397E-01 0.923E+00
RMM: 30 -0.408245577967E+03 0.13880E+01 -0.22919E-01 14802 0.566E-01 0.609E+00
RMM: 31 -0.409336521575E+03 -0.10909E+01 -0.86899E-02 13071 0.368E-01 0.746E+00
RMM: 32 -0.408983488960E+03 0.35303E+00 -0.16937E-02 10508 0.165E-01 0.715E+00
RMM: 33 -0.408965602094E+03 0.17887E-01 -0.77087E-02 11845 0.236E-01 0.671E+00
RMM: 34 -0.409424107183E+03 -0.45851E+00 -0.46703E-02 11977 0.269E-01 0.643E+00
RMM: 35 -0.410279192090E+03 -0.85508E+00 -0.20908E-01 15179 0.471E-01 0.520E+00
RMM: 36 -0.411666762867E+03 -0.13876E+01 -0.19953E-01 15311 0.482E-01 0.577E+00
RMM: 37 -0.413409216950E+03 -0.17425E+01 -0.44003E-01 16010 0.697E-01 0.475E+00
RMM: 38 -0.414289987820E+03 -0.88077E+00 -0.13783E-01 14621 0.425E-01 0.421E+00
RMM: 39 -0.414349229414E+03 -0.59242E-01 -0.19672E-02 11311 0.172E-01 0.395E+00
RMM: 40 -0.414521623565E+03 -0.17239E+00 -0.79109E-02 12636 0.297E-01 0.402E+00
RMM: 41 -0.414611133913E+03 -0.89510E-01 -0.43690E-02 12471 0.226E-01 0.327E+00
RMM: 42 -0.414804525638E+03 -0.19339E+00 -0.44327E-02 12345 0.221E-01 0.164E+00
RMM: 43 -0.415404930149E+03 -0.60040E+00 -0.41579E-02 12044 0.217E-01 0.108E+00
RMM: 44 -0.415693007156E+03 -0.28808E+00 -0.20079E-02 11362 0.160E-01 0.117E+00
RMM: 45 -0.415680316817E+03 0.12690E-01 -0.19786E-02 11609 0.158E-01 0.120E+00
RMM: 46 -0.415775579203E+03 -0.95262E-01 -0.14314E-02 11401 0.120E-01 0.830E-01
RMM: 47 -0.416043445612E+03 -0.26787E+00 -0.13411E-02 11495 0.115E-01 0.546E-01
RMM: 48 -0.416188397829E+03 -0.14495E+00 -0.42100E-03 10744 0.681E-02 0.598E-01
RMM: 49 -0.416259393129E+03 -0.70995E-01 -0.42073E-03 11104 0.636E-02 0.461E-01
RMM: 50 -0.416314498700E+03 -0.55106E-01 -0.39997E-03 11507 0.669E-02 0.692E-01
RMM: 51 -0.416334492216E+03 -0.19994E-01 -0.19327E-03 10753 0.587E-02 0.175E+00
RMM: 52 -0.416262222814E+03 0.72269E-01 -0.42403E-03 11198 0.637E-02 0.383E-01
RMM: 53 -0.416389369860E+03 -0.12715E+00 -0.27764E-03 11755 0.582E-02 0.359E-01
RMM: 54 -0.416411870476E+03 -0.22501E-01 -0.11448E-03 11155 0.361E-02 0.343E-01
RMM: 55 -0.416445884964E+03 -0.34014E-01 -0.27500E-03 11986 0.418E-02 0.339E-01
RMM: 56 -0.416534298760E+03 -0.88414E-01 -0.33188E-03 12516 0.457E-02 0.268E+00
RMM: 57 -0.416555291896E+03 -0.20993E-01 -0.19449E-03 11059 0.665E-02 0.274E-01
RMM: 58 -0.416599422784E+03 -0.44131E-01 -0.15189E-03 11675 0.506E-02 0.487E-01
RMM: 59 -0.416602864764E+03 -0.34420E-02 -0.14058E-04 10329 0.148E-02 0.375E-01
RMM: 60 -0.416605118708E+03 -0.22539E-02 -0.75986E-05 8777 0.933E-03 0.247E-01
RMM: 61 -0.416610223354E+03 -0.51046E-02 -0.91845E-05 8907 0.995E-03 0.174E-01
RMM: 62 -0.416613777556E+03 -0.35542E-02 -0.60555E-05 8139 0.906E-03 0.182E-01
RMM: 63 -0.416614587642E+03 -0.81009E-03 -0.47572E-05 7517 0.587E-03 0.208E-01
RMM: 64 -0.416614862457E+03 -0.27481E-03 -0.35414E-05 7217 0.465E-03 0.230E-01
RMM: 65 -0.416614822576E+03 0.39881E-04 -0.38750E-05 7190 0.453E-03 0.222E-01
RMM: 66 -0.416614724200E+03 0.98376E-04 -0.18758E-05 6775 0.435E-03 0.234E-01
RMM: 67 -0.416614505106E+03 0.21909E-03 -0.30830E-05 6848 0.425E-03 0.245E-01
RMM: 68 -0.416614506241E+03 -0.11357E-05 -0.10852E-06 4279 0.137E-03
1 F= -.45418873E+03 E0= -.45418856E+03 d E =-.514717E-03 mag= -0.1861