iterations/neb1_max2_image02_iter2_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.424329997046E+04 0.42433E+04 -0.25408E+05 9024 0.103E+03
DAV: 2 -0.985231961936E+02 -0.43418E+04 -0.39434E+04 11000 0.248E+02
DAV: 3 -0.422149768126E+03 -0.32363E+03 -0.30262E+03 10304 0.658E+01
DAV: 4 -0.430559415993E+03 -0.84096E+01 -0.82808E+01 10736 0.106E+01
DAV: 5 -0.430846563210E+03 -0.28715E+00 -0.28651E+00 11120 0.189E+00 0.107E+02
RMM: 6 -0.384729388821E+03 0.46117E+02 -0.11209E+02 9696 0.147E+01 0.757E+01
RMM: 7 -0.923411390722E+03 -0.53868E+03 -0.61875E+02 11882 0.221E+01 0.159E+02
RMM: 8 -0.507063012065E+03 0.41635E+03 -0.13283E+02 9974 0.121E+01 0.964E+01
RMM: 9 -0.423448550979E+03 0.83614E+02 -0.75441E+01 10144 0.111E+01 0.623E+01
RMM: 10 -0.383193137814E+03 0.40255E+02 -0.45420E+01 10331 0.869E+00 0.442E+01
RMM: 11 -0.372392712441E+03 0.10800E+02 -0.22761E+01 10301 0.551E+00 0.405E+01
RMM: 12 -0.371469194346E+03 0.92352E+00 -0.75859E+00 10088 0.367E+00 0.313E+01
RMM: 13 -0.367226747296E+03 0.42424E+01 -0.45283E+00 10155 0.285E+00 0.215E+01
RMM: 14 -0.366943889293E+03 0.28286E+00 -0.15282E+00 10142 0.163E+00 0.138E+01
RMM: 15 -0.371685673122E+03 -0.47418E+01 -0.11960E+00 10294 0.142E+00 0.122E+01
RMM: 16 -0.376293520345E+03 -0.46078E+01 -0.12749E+00 10412 0.150E+00 0.979E+00
RMM: 17 -0.383035688558E+03 -0.67422E+01 -0.22667E+00 11404 0.180E+00 0.869E+00
RMM: 18 -0.385915986958E+03 -0.28803E+01 -0.10548E+00 10686 0.122E+00 0.655E+00
RMM: 19 -0.388599872718E+03 -0.26839E+01 -0.64006E-01 10746 0.905E-01 0.866E+00
RMM: 20 -0.390589273633E+03 -0.19894E+01 -0.52054E-01 10998 0.760E-01 0.903E+00
RMM: 21 -0.393705243423E+03 -0.31160E+01 -0.10567E+00 11924 0.103E+00 0.784E+00
RMM: 22 -0.398562249909E+03 -0.48570E+01 -0.22942E+00 12960 0.141E+00 0.529E+00
RMM: 23 -0.400650629637E+03 -0.20884E+01 -0.20014E-01 10749 0.477E-01 0.480E+00
RMM: 24 -0.401371914799E+03 -0.72129E+00 -0.11606E-01 10730 0.344E-01 0.474E+00
RMM: 25 -0.403359775147E+03 -0.19879E+01 -0.49493E-01 12559 0.646E-01 0.485E+00
RMM: 26 -0.405591125923E+03 -0.22314E+01 -0.86841E-01 13491 0.835E-01 0.505E+00
RMM: 27 -0.406386019945E+03 -0.79489E+00 -0.11740E-01 11204 0.326E-01 0.495E+00
RMM: 28 -0.405891783243E+03 0.49424E+00 -0.59591E-02 10613 0.261E-01 0.483E+00
RMM: 29 -0.405354388977E+03 0.53739E+00 -0.70985E-02 11115 0.303E-01 0.457E+00
RMM: 30 -0.404647585906E+03 0.70680E+00 -0.15096E-01 12434 0.499E-01 0.467E+00
RMM: 31 -0.404108921992E+03 0.53866E+00 -0.12770E-01 12404 0.453E-01 0.551E+00
RMM: 32 -0.404775690768E+03 -0.66677E+00 -0.22287E-02 10241 0.212E-01 0.511E+00
RMM: 33 -0.406664705981E+03 -0.18890E+01 -0.71951E-01 15316 0.938E-01 0.574E+00
RMM: 34 -0.407237564211E+03 -0.57286E+00 -0.60606E-01 15474 0.830E-01 0.429E+00
RMM: 35 -0.407782710295E+03 -0.54515E+00 -0.30463E-01 14339 0.587E-01 0.462E+00
RMM: 36 -0.407561861144E+03 0.22085E+00 -0.61222E-03 10518 0.101E-01 0.452E+00
RMM: 37 -0.407770604871E+03 -0.20874E+00 -0.94592E-03 10747 0.126E-01 0.415E+00
RMM: 38 -0.408934224349E+03 -0.11636E+01 -0.99833E-02 14660 0.398E-01 0.215E+00
RMM: 39 -0.409679030053E+03 -0.74481E+00 -0.59944E-02 13875 0.282E-01 0.159E+00
RMM: 40 -0.410057730457E+03 -0.37870E+00 -0.23970E-02 11955 0.175E-01 0.144E+00
RMM: 41 -0.410264659287E+03 -0.20693E+00 -0.27796E-02 12041 0.166E-01 0.119E+00
RMM: 42 -0.410396839444E+03 -0.13218E+00 -0.12873E-02 11351 0.116E-01 0.108E+00
RMM: 43 -0.410484447124E+03 -0.87608E-01 -0.81943E-03 11133 0.950E-02 0.101E+00
RMM: 44 -0.410543486748E+03 -0.59040E-01 -0.10361E-02 11713 0.104E-01 0.942E-01
RMM: 45 -0.410654945278E+03 -0.11146E+00 -0.14267E-02 12248 0.116E-01 0.100E+00
RMM: 46 -0.410809802309E+03 -0.15486E+00 -0.11278E-02 11895 0.104E-01 0.777E-01
RMM: 47 -0.410938040801E+03 -0.12824E+00 -0.80691E-03 11480 0.939E-02 0.507E-01
RMM: 48 -0.410986709121E+03 -0.48668E-01 -0.32104E-03 10764 0.607E-02 0.459E-01
RMM: 49 -0.411068018632E+03 -0.81310E-01 -0.50510E-03 11371 0.647E-02 0.363E-01
RMM: 50 -0.411134977508E+03 -0.66959E-01 -0.34008E-03 11228 0.508E-02 0.314E-01
RMM: 51 -0.411123406870E+03 0.11571E-01 -0.49697E-03 12107 0.720E-02 0.237E-01
RMM: 52 -0.411157114719E+03 -0.33708E-01 -0.26264E-03 11353 0.521E-02 0.146E-01
RMM: 53 -0.411180174108E+03 -0.23059E-01 -0.74457E-04 10690 0.260E-02 0.125E-01
RMM: 54 -0.411222471159E+03 -0.42297E-01 -0.92591E-04 11109 0.287E-02 0.111E-01
RMM: 55 -0.411263294337E+03 -0.40823E-01 -0.50781E-04 11022 0.212E-02 0.131E-01
RMM: 56 -0.411297651056E+03 -0.34357E-01 -0.22685E-04 10389 0.148E-02 0.749E-02
RMM: 57 -0.411314167164E+03 -0.16516E-01 -0.13755E-04 10030 0.112E-02 0.533E-02
RMM: 58 -0.411321005592E+03 -0.68384E-02 -0.86797E-05 9435 0.912E-03 0.296E-02
RMM: 59 -0.411324722379E+03 -0.37168E-02 -0.60461E-05 8644 0.735E-03 0.290E-02
RMM: 60 -0.411326152370E+03 -0.14300E-02 -0.24756E-05 7543 0.484E-03 0.205E-02
RMM: 61 -0.411327268908E+03 -0.11165E-02 -0.19734E-05 7199 0.389E-03 0.130E-02
RMM: 62 -0.411327860027E+03 -0.59112E-03 -0.73638E-06 6574 0.249E-03 0.954E-03
RMM: 63 -0.411328168894E+03 -0.30887E-03 -0.51586E-06 6350 0.202E-03 0.854E-03
RMM: 64 -0.411328362036E+03 -0.19314E-03 -0.21242E-06 4538 0.137E-03 0.482E-03
RMM: 65 -0.411328546131E+03 -0.18410E-03 -0.21053E-06 4542 0.132E-03 0.357E-03
RMM: 66 -0.411328614070E+03 -0.67939E-04 -0.21172E-06 5464 0.143E-03 0.154E-02
RMM: 67 -0.411328623031E+03 -0.89610E-05 -0.47963E-07 3494 0.971E-04
1 F= -.44907303E+03 E0= -.44907236E+03 d E =-.199214E-02 mag= 0.0021