iterations/neb3_max1_image04_iter1_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422438815261E+04 0.42244E+04 -0.25388E+05 9008 0.103E+03
DAV: 2 -0.104137547792E+03 -0.43285E+04 -0.39300E+04 11000 0.248E+02
DAV: 3 -0.426055767546E+03 -0.32192E+03 -0.30139E+03 10304 0.656E+01
DAV: 4 -0.434517824657E+03 -0.84621E+01 -0.83557E+01 10888 0.107E+01
DAV: 5 -0.434806300451E+03 -0.28848E+00 -0.28766E+00 11256 0.191E+00 0.102E+02
RMM: 6 -0.380333735514E+03 0.54473E+02 -0.10852E+02 9703 0.142E+01 0.694E+01
RMM: 7 -0.665446759722E+03 -0.28511E+03 -0.29787E+02 10700 0.176E+01 0.128E+02
RMM: 8 -0.521740531068E+03 0.14371E+03 -0.11932E+02 10280 0.115E+01 0.927E+01
RMM: 9 -0.390925696187E+03 0.13081E+03 -0.62060E+01 10229 0.998E+00 0.426E+01
RMM: 10 -0.380327819175E+03 0.10598E+02 -0.30965E+01 10152 0.732E+00 0.285E+01
RMM: 11 -0.400671058090E+03 -0.20343E+02 -0.17407E+01 10291 0.522E+00 0.484E+01
RMM: 12 -0.377048519192E+03 0.23623E+02 -0.55772E+00 9715 0.333E+00 0.244E+01
RMM: 13 -0.374907329862E+03 0.21412E+01 -0.20709E+00 10053 0.187E+00 0.175E+01
RMM: 14 -0.377459535419E+03 -0.25522E+01 -0.16117E+00 10407 0.165E+00 0.118E+01
RMM: 15 -0.383498008155E+03 -0.60385E+01 -0.15017E+00 10543 0.158E+00 0.173E+01
RMM: 16 -0.385200979434E+03 -0.17030E+01 -0.91096E-01 10402 0.125E+00 0.169E+01
RMM: 17 -0.386680318293E+03 -0.14793E+01 -0.59484E-01 10256 0.973E-01 0.127E+01
RMM: 18 -0.390083229449E+03 -0.34029E+01 -0.10800E+00 11300 0.120E+00 0.793E+00
RMM: 19 -0.393584985643E+03 -0.35018E+01 -0.70267E-01 11033 0.101E+00 0.606E+00
RMM: 20 -0.397391016848E+03 -0.38060E+01 -0.96076E-01 11529 0.107E+00 0.574E+00
RMM: 21 -0.400091605591E+03 -0.27006E+01 -0.68593E-01 11409 0.886E-01 0.537E+00
RMM: 22 -0.404674639675E+03 -0.45830E+01 -0.16836E+00 12575 0.121E+00 0.524E+00
RMM: 23 -0.408845287802E+03 -0.41706E+01 -0.19721E+00 12973 0.123E+00 0.471E+00
RMM: 24 -0.411669492472E+03 -0.28242E+01 -0.17780E+00 12934 0.110E+00 0.568E+00
RMM: 25 -0.412799899010E+03 -0.11304E+01 -0.15269E-01 10741 0.394E-01 0.536E+00
RMM: 26 -0.413052663452E+03 -0.25276E+00 -0.26523E-02 10867 0.152E-01 0.532E+00
RMM: 27 -0.413704146488E+03 -0.65148E+00 -0.10069E-01 11691 0.293E-01 0.519E+00
RMM: 28 -0.414205713078E+03 -0.50157E+00 -0.38128E-01 14329 0.659E-01 0.417E+00
RMM: 29 -0.414564793610E+03 -0.35908E+00 -0.77330E-02 11554 0.344E-01 0.372E+00
RMM: 30 -0.415100151030E+03 -0.53536E+00 -0.54211E-02 11143 0.290E-01 0.302E+00
RMM: 31 -0.415754463428E+03 -0.65431E+00 -0.58824E-02 11277 0.306E-01 0.238E+00
RMM: 32 -0.416026322568E+03 -0.27186E+00 -0.54818E-02 11327 0.278E-01 0.249E+00
RMM: 33 -0.416085852588E+03 -0.59530E-01 -0.18003E-02 10336 0.172E-01 0.213E+00
RMM: 34 -0.416187376188E+03 -0.10152E+00 -0.10612E-02 10419 0.120E-01 0.177E+00
RMM: 35 -0.416285122363E+03 -0.97746E-01 -0.71067E-03 10533 0.970E-02 0.143E+00
RMM: 36 -0.416392470824E+03 -0.10735E+00 -0.90849E-03 11036 0.108E-01 0.116E+00
RMM: 37 -0.416476696040E+03 -0.84225E-01 -0.39722E-03 10525 0.673E-02 0.970E-01
RMM: 38 -0.416559339151E+03 -0.82643E-01 -0.50343E-03 11066 0.709E-02 0.810E-01
RMM: 39 -0.416641360949E+03 -0.82022E-01 -0.57893E-03 11640 0.740E-02 0.662E-01
RMM: 40 -0.416725551974E+03 -0.84191E-01 -0.10197E-02 12548 0.955E-02 0.463E-01
RMM: 41 -0.416794446281E+03 -0.68894E-01 -0.12796E-02 12819 0.104E-01 0.450E-01
RMM: 42 -0.416847209400E+03 -0.52763E-01 -0.34756E-03 11255 0.596E-02 0.432E-01
RMM: 43 -0.416898736412E+03 -0.51527E-01 -0.22982E-03 10970 0.454E-02 0.326E-01
RMM: 44 -0.416952149899E+03 -0.53413E-01 -0.21937E-03 11366 0.411E-02 0.376E-01
RMM: 45 -0.417015907968E+03 -0.63758E-01 -0.32798E-03 11900 0.471E-02 0.256E-01
RMM: 46 -0.417080404627E+03 -0.64497E-01 -0.25997E-03 11806 0.411E-02 0.218E-01
RMM: 47 -0.417130661309E+03 -0.50257E-01 -0.18206E-03 11724 0.347E-02 0.154E-01
RMM: 48 -0.417153516064E+03 -0.22855E-01 -0.52854E-04 10945 0.203E-02 0.106E-01
RMM: 49 -0.417175258027E+03 -0.21742E-01 -0.41124E-04 11053 0.172E-02 0.118E-01
RMM: 50 -0.417192747347E+03 -0.17489E-01 -0.35651E-04 11289 0.158E-02 0.108E-01
RMM: 51 -0.417200837117E+03 -0.80898E-02 -0.12112E-04 9972 0.113E-02 0.664E-02
RMM: 52 -0.417205430225E+03 -0.45931E-02 -0.10956E-04 9542 0.924E-03 0.350E-02
RMM: 53 -0.417206811157E+03 -0.13809E-02 -0.33727E-05 8075 0.573E-03 0.285E-02
RMM: 54 -0.417207453045E+03 -0.64189E-03 -0.17295E-05 7076 0.398E-03 0.239E-02
RMM: 55 -0.417207751148E+03 -0.29810E-03 -0.99340E-06 6678 0.293E-03 0.161E-02
RMM: 56 -0.417207630046E+03 0.12110E-03 -0.68028E-06 6506 0.246E-03 0.927E-03
RMM: 57 -0.417207858881E+03 -0.22883E-03 -0.47858E-06 5939 0.190E-03 0.648E-03
RMM: 58 -0.417208025953E+03 -0.16707E-03 -0.29460E-06 4899 0.148E-03 0.571E-03
RMM: 59 -0.417208212513E+03 -0.18656E-03 -0.28711E-06 4538 0.135E-03 0.420E-03
RMM: 60 -0.417208334799E+03 -0.12229E-03 -0.14987E-06 3774 0.112E-03 0.281E-03
RMM: 61 -0.417208469257E+03 -0.13446E-03 -0.14602E-06 3904 0.111E-03 0.270E-03
RMM: 62 -0.417208595521E+03 -0.12626E-03 -0.12470E-06 3765 0.106E-03 0.259E-03
RMM: 63 -0.417208691371E+03 -0.95850E-04 -0.12817E-06 3865 0.107E-03 0.190E-03
RMM: 64 -0.417208772556E+03 -0.81184E-04 -0.54200E-07 3218 0.927E-04 0.148E-03
RMM: 65 -0.417208832491E+03 -0.59936E-04 -0.34408E-07 2947 0.909E-04 0.328E-03
RMM: 66 -0.417208860609E+03 -0.28118E-04 -0.95371E-08 2464 0.832E-04 0.745E-04
RMM: 67 -0.417208890807E+03 -0.30198E-04 -0.11423E-07 2446 0.841E-04 0.169E-03
RMM: 68 -0.417208911465E+03 -0.20658E-04 -0.11376E-07 2416 0.849E-04 0.249E-03
RMM: 69 -0.417208929440E+03 -0.17974E-04 -0.14948E-07 2515 0.855E-04 0.257E-03
RMM: 70 -0.417208939786E+03 -0.10347E-04 -0.81386E-08 2329 0.835E-04 0.133E-03
RMM: 71 -0.417208954523E+03 -0.14736E-04 -0.20604E-07 2619 0.874E-04 0.901E-04
RMM: 72 -0.417208960326E+03 -0.58037E-05 -0.10078E-07 2358 0.838E-04
1 F= -.45488179E+03 E0= -.45488262E+03 d E =0.247783E-02 mag= -0.0001